A0A077Z1H6_TRITR Loading...

ubiquitinyl hydrolase 1

AlphaFold DB , UniProt , Accession A0A077Z1H6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 751 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.1	Very low	27.5	Very low	236 Å²	236	149.5 Å²	149.5	100%	1.163	83%	0.828	S	S	*	*				0	124.6	0	-78.1	-175	-178.6	0	0	108
2	H	27.3	Very low	27.4	Very low	170 Å²	170	156.8 Å²	156.8	79%	0.787	84%	0.836	S	S	*	*			trans	48.2	106.3	162.4	-68.4	-70.5	0	0	0	119.3
3	C	23.5	Very low	27.1	Very low	105 Å²	105	156.2 Å²	156.2	71%	0.709	83%	0.833	S	S	*	*				82.9	131.8	91.2	-72.3	0	0	0	0	111.4
4	L	27.1	Very low	26.9	Very low	156 Å²	156	156.8 Å²	156.8	82%	0.817	84%	0.835	S	S	*	*			cis	-166.7	160.5	8.2	-92.9	158.5	0	0	0	106.9
5	P	27.7	Very low	26.8	Very low	111 Å²	111	156.8 Å²	156.8	72%	0.721	83%	0.834	S	S	*	*			trans	-89.5	147.5	172.6	35.4	-28.7	0	0	0	111.3
6	L	31.3	Very low	26.6	Very low	177 Å²	177	155 Å²	155	93%	0.927	84%	0.836	S	S	*	*			trans	-130.8	127.5	166.1	-81.8	171.2	0	0	0	110.9
7	S	26.2	Very low	26.7	Very low	91 Å²	91	160.5 Å²	160.5	64%	0.636	84%	0.842	S	S	*	*			trans	-80.2	170.4	176.8	51.5	0	0	0	0	112.4
8	D	26.4	Very low	26.8	Very low	151 Å²	151	160.4 Å²	160.4	81%	0.807	84%	0.843	S	S	*	*			trans	86.7	96.1	154.1	-55.1	-45.4	0	0	0	119.1
9	S	28.9	Very low	27.1	Very low	128 Å²	128	157.3 Å²	157.3	90%	0.895	83%	0.833	S	S	*	*				-155.4	130.5	126.7	45	0	0	0	0	111.2
10	K	26	Very low	27.1	Very low	203 Å²	203	157.3 Å²	157.3	88%	0.883	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-93	168.2	179.7	-102	-173.9	-177.7	177.8	0	110.8
11	P	27.9	Very low	27.1	Very low	117 Å²	117	154.6 Å²	154.6	76%	0.76	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-92.9	160.1	-144.8	37.4	-35.8	0	0	0	114.2
12	Y	26.4	Very low	26.9	Very low	236 Å²	236	148.7 Å²	148.7	93%	0.925	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-83	116.8	169.1	-80	-84.2	0	0	0	111.3
13	D	23	Very low	26.7	Very low	150 Å²	150	147.3 Å²	147.3	80%	0.802	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-65.2	133	158	-89.1	-42.1	0	0	0	110.6
14	L	24.7	Very low	26.8	Very low	164 Å²	164	153.3 Å²	153.3	86%	0.859	81%	0.812	S	S	*	*			trans	-140.7	82.7	156.2	-99.1	165.5	0	0	0	110.3
15	L	25.6	Very low	26.8	Very low	157 Å²	157	155.6 Å²	155.6	82%	0.822	81%	0.81	S	S	*	*			trans	33.4	103.7	135.9	-62.4	169.9	0	0	0	118.7
16	C	23.6	Very low	26.6	Very low	128 Å²	128	161.7 Å²	161.7	87%	0.865	82%	0.818	S	S	*	*			trans	-68.7	134.8	152.8	-70	0	0	0	0	111.2
17	R	27.5	Very low	26.3	Very low	248 Å²	248	164.3 Å²	164.3	94%	0.936	82%	0.817	S	S	*	*			trans	-144.2	122.9	148.5	-87.9	-164.3	-179.9	-161.7	-0.4	112.5
18	N	29.6	Very low	26.2	Very low	160 Å²	160	167.2 Å²	167.2	86%	0.856	83%	0.826	S	S	*	*			trans	78.7	113.8	163.7	-95	4.1	0	0	0	121.7
19	P	32.5	Very low	26.4	Very low	100 Å²	100	168.7 Å²	168.7	65%	0.649	82%	0.82	S	S	*	*			trans	-86.1	162.6	155.9	37.8	-28.1	0	0	0	110.1
20	D	25.7	Very low	26.5	Very low	158 Å²	158	171.9 Å²	171.9	85%	0.845	81%	0.812	S	S	*	*			trans	129.9	132.9	158.3	-62.4	-18	0	0	0	113.7
21	A	27.1	Very low	26.6	Very low	100 Å²	100	167.7 Å²	167.7	83%	0.826	81%	0.809	S	S	*	*			trans	84	99.1	176.7	0	0	0	0	0	117.6
22	V	27.8	Very low	27	Very low	112 Å²	112	167.2 Å²	167.2	68%	0.679	81%	0.805	S	S	*	*			trans	-123.6	101	150.6	-176.3	0	0	0	0	108.6	W24	V22-W24 HydrophobicContact CG1-CD2 4.25Å; V22-W24 HydrophobicContact CG1-CG 4.44Å; V22-W24 HydrophobicContact CG1-CZ2 3.94Å
23	E	23.1	Very low	27.1	Very low	141 Å²	141	163 Å²	163	66%	0.659	80%	0.804	S	S	*	*			trans	-80.3	120.1	167.9	-175.7	-174.3	165.5	0	0	108.6	R25	E23-R25 IonicContact OE1-CZ 3.49Å; E23-R25 VanDerWaalsContact OE1-CZ 3.29Å; E23-R25 IonicContact OE1-NE 3.62Å; E23-R25 PolarHBondContact OE1-NE 3.39Å; E23-R25 IonicContact OE1-NH2 3.42Å; E23-R25 PolarHBondContact OE1-NH2 3.04Å
24	W	25.5	Very low	27.4	Very low	232 Å²	232	159.2 Å²	159.2	88%	0.879	80%	0.8	S	S	*	*			trans	-99.6	109.4	174.3	-67.9	95.7	0	0	0	110.2	V22	V22-W24 HydrophobicContact CG1-CD2 4.25Å; V22-W24 HydrophobicContact CG1-CG 4.44Å; V22-W24 HydrophobicContact CG1-CZ2 3.94Å
25	R	25.9	Very low	27.5	Very low	204 Å²	204	159.6 Å²	159.6	77%	0.77	80%	0.803	S	S	*	*			trans	-97.7	130.5	169.2	-78.5	-167.6	-160.6	158.5	10.2	112.4	E23	E23-R25 IonicContact OE1-CZ 3.49Å; E23-R25 VanDerWaalsContact OE1-CZ 3.29Å; E23-R25 IonicContact OE1-NE 3.62Å; E23-R25 PolarHBondContact OE1-NE 3.39Å; E23-R25 IonicContact OE1-NH2 3.42Å; E23-R25 PolarHBondContact OE1-NH2 3.04Å
26	R	23	Very low	27.7	Very low	239 Å²	239	163.3 Å²	163.3	90%	0.902	81%	0.806	S	S	*	*			trans	-54.2	143.3	166.8	-79.8	177.5	178.6	140	1.1	111.8
27	Y	25.5	Very low	27.8	Very low	232 Å²	232	161.9 Å²	161.9	91%	0.91	80%	0.804	S	S	*	*			trans	-137.7	121.6	144.9	-114.1	-87.4	0	0	0	110.6
28	D	25.4	Very low	28	Very low	151 Å²	151	156.7 Å²	156.7	81%	0.807	80%	0.799	S	S	*	*			trans	-131.9	149.6	165.1	-157	-1.9	0	0	0	107.7
29	R	29.2	Very low	27.9	Very low	182 Å²	182	158.6 Å²	158.6	69%	0.687	81%	0.806	S	S	*	*			trans	100.9	109.1	174.5	-67.5	-169.1	172.5	-168	2.5	121.1
30	R	31.1	Very low	27.6	Very low	196 Å²	196	157.3 Å²	157.3	74%	0.74	81%	0.81	S	S	*	*				85.9	105.8	116.6	-70.4	179.6	-175.1	-162.4	-2.1	120.9
31	S	29	Very low	27.6	Very low	115 Å²	115	159 Å²	159	80%	0.804	81%	0.813	S	S	*	*				77.3	161.2	121.5	-115.2	0	0	0	0	120.3
32	P	36.2	Very low	27.5	Very low	106 Å²	106	159.7 Å²	159.7	69%	0.688	81%	0.81	S	S	*	*				-128.4	-171.4	-104.4	31.7	-8.7	0	0	0	114
33	V	28.4	Very low	27.5	Very low	149 Å²	149	161 Å²	161	90%	0.903	82%	0.818	S	S	*	*			trans	87.4	119.3	164.5	-166.6	0	0	0	0	115.9
34	G	29.4	Very low	27.7	Very low	70 Å²	70	159.5 Å²	159.5	72%	0.722	82%	0.823	S	S	*	*			trans	159.5	86.9	164.3	0	0	0	0	0	114.5	R36	G34-R36 PolarHBondContact O-N 3.36Å
35	N	26.8	Very low	27.7	Very low	171 Å²	171	153.8 Å²	153.8	91%	0.914	81%	0.814	S	S	*	*			trans	-50.9	124.2	164.5	-77.9	-27.2	0	0	0	111.7
36	R	29.8	Very low	27.7	Very low	236 Å²	236	151.9 Å²	151.9	89%	0.891	82%	0.819	S	S	*	*			trans	-174	125.9	130.4	-131.2	168.8	173.6	170.3	-3.6	112.1	G34 T38	G34-R36 PolarHBondContact O-N 3.36Å; R36-T38 PolarHBondContact O-N 2.73Å
37	A	25.1	Very low	27.9	Very low	98 Å²	98	144.1 Å²	144.1	81%	0.81	81%	0.813	S	S	*	*			trans	-56	129.4	166.8	0	0	0	0	0	111.6
38	T	31.3	Very low	28	Very low	138 Å²	138	136 Å²	136	85%	0.847	79%	0.793	S	S	*	*			trans	-149.7	126.6	154.2	30.4	0	0	0	0	108.5	R36	R36-T38 PolarHBondContact O-N 2.73Å
39	M	27.6	Very low	28.4	Very low	200 Å²	200	133 Å²	133	99%	0.985	78%	0.783	S	S	*	*			trans	-61.1	140.9	169.3	-72.1	-163.3	179.4	0	0	110.2
40	G	26.2	Very low	28.9	Very low	73 Å²	73	129 Å²	129	75%	0.753	77%	0.774	S	S	*	*			trans	170.3	86.3	171.6	0	0	0	0	0	116.8
41	Q	25.8	Very low	29.4	Very low	194 Å²	194	126 Å²	126	91%	0.907	76%	0.764	S	S	*	*			trans	73.3	146.4	143.4	-83.8	-174.4	-31.5	0	0	123.4
42	P	25.8	Very low	30.6	Very low	115 Å²	115	122.2 Å²	122.2	75%	0.747	74%	0.737	S	S	*	*			trans	-95.5	143.1	-166.4	38.1	-30.1	0	0	0	112
43	T	27.1	Very low	32	Very low	140 Å²	140	121.3 Å²	121.3	86%	0.859	72%	0.723	S	S	*	*			trans	-132.2	107.7	173	46.4	0	0	0	0	112.1
44	S	27.2	Very low	34.2	Very low	108 Å²	108	115.3 Å²	115.3	76%	0.755	69%	0.687	S	S	*	*			trans	34	104.2	140.3	-157.2	0	0	0	0	118.2
45	V	26	Very low	36.5	Very low	113 Å²	113	116.2 Å²	116.2	69%	0.685	67%	0.672	S	S	*	*				60.9	94.6	80	-171.8	0	0	0	0	112.6
46	N	26.3	Very low	39.2	Very low	164 Å²	164	108.6 Å²	108.6	88%	0.877	63%	0.632	S	S	*	*			trans	162	93.8	143.2	-80.5	-20.8	0	0	0	111.3
47	G	27.3	Very low	41.8	Very low	75 Å²	75	98.2 Å²	98.2	77%	0.773	60%	0.595	S	S	*	*			trans	161.2	65	176.2	0	0	0	0	0	112
48	A	27.6	Very low	44.5	Very low	61 Å²	61	96.2 Å²	96.2	50%	0.504	58%	0.575	S	S	.	*			trans	-64.7	128.6	179.6	0	0	0	0	0	110	L50 F570	A48-L50 PolarHBondContact O-N 3.03Å; A48-F570 HydrophobicContact CB-CE1 3.93Å; A48-F570 HydrophobicContact CB-CZ 3.7Å
49	P	33.3	Very low	46.9	Very low	90 Å²	90	91 Å²	91	58%	0.584	54%	0.54	S	S	*	.			trans	-63.3	127.7	175.2	26.3	-30.3	0	0	0	108.1	Y51	P49-Y51 WeakPolarHBondContact O-CD2 2.92Å; P49-Y51 PolarHBondContact O-N 3.41Å
50	L	38.9	Very low	49.9	Very low	98 Å²	98	81.6 Å²	81.6	51%	0.513	49%	0.494	S	S	.	.			trans	-57.8	107.9	171.5	-72.5	168.2	0	0	0	107.6	A48 C52 F570	A48-L50 PolarHBondContact O-N 3.03Å; L50-C52 PolarHBondContact O-N 3.07Å; L50-F570 HydrophobicContact CD2-CB 4.41Å; L50-F570 HydrophobicContact CD2-CD1 3.86Å; L50-F570 HydrophobicContact CD2-CG 4.37Å
51	Y	43.2	Very low	53	Low	133 Å²	133	78.9 Å²	78.9	52%	0.522	46%	0.461	S	S	.	.			trans	-66.6	82.5	178.7	-77	-88.3	0	0	0	109.7	P49 H53	P49-Y51 WeakPolarHBondContact O-CD2 2.92Å; P49-Y51 PolarHBondContact O-N 3.41Å; Y51-H53 VanDerWaalsContact C-N 3.34Å
52	C	53.9	Low	56.1	Low	34 Å²	34	70 Å²	70	23%	0.23	42%	0.421	C	S	.	.			trans	-89.6	-7.8	169.4	-168.5	0	0	0	0	111.6	L50 L145	L50-C52 PolarHBondContact O-N 3.07Å; C52-L145 VanDerWaalsContact SG-CB 3.53Å; C52-L145 VanDerWaalsContact SG-CD1 3.56Å
53	H	64.5	Low	59.3	Low	87 Å²	87	64.8 Å²	64.8	40%	0.403	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-102.5	123.3	-178.2	-174.5	-95	0	0	0	110	Y51 K239	Y51-H53 VanDerWaalsContact C-N 3.34Å; H53-K239 VanDerWaalsContact CD2-CE 3.41Å; H53-K239 WeakPolarHBondContact CD2-CE 3.33Å; H53-K239 WeakPolarHBondContact NE2-CD 3.46Å
54	V	75.8	Confident	62.3	Low	24 Å²	24	58.9 Å²	58.9	15%	0.145	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-98.8	123.9	168.4	-179.5	0	0	0	0	106.1	T56 W129 L138 A141 V237	V54-T56 HydrophobicContact CG1-CG2 4.44Å; V54-T56 PolarHBondContact O-N 3.27Å; V54-W129 HydrophobicContact CG1-CH2 3.95Å; V54-W129 HydrophobicContact CG1-CZ2 4.22Å; V54-L138 HydrophobicContact CG1-CD2 4.39Å; V54-L138 HydrophobicContact CG2-CD2 4.4Å; V54-A141 HydrophobicContact CG2-CB 3.84Å; V54-V237 HydrophobicContact CB-CG1 4.39Å; V54-V237 HydrophobicContact CG2-CG1 3.94Å
55	E	77	Confident	65.3	Low	89 Å²	89	55 Å²	55	42%	0.416	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-70.9	124.2	173.4	-173.1	159.5	173.8	0	0	109.5	Y619	E55-Y619 HydrophobicContact CB-CE2 4.26Å; E55-Y619 HydrophobicContact CG-CD2 4.16Å; E55-Y619 HydrophobicContact CG-CE2 4.11Å; E55-Y619 VanDerWaalsContact OE1-CB 3.23Å; E55-Y619 WeakPolarHBondContact OE1-CB 3.35Å; E55-Y619 WeakPolarHBondContact OE1-CD1 3.27Å; E55-Y619 WeakPolarHBondContact OE1-CD2 3.48Å; E55-Y619 WeakPolarHBondContact OE2-CD2 3.44Å; E55-Y619 WeakPolarHBondContact OE2-CE2 3.39Å
56	T	83.8	Confident	68.4	Low	11 Å²	11	49.6 Å²	49.6	7%	0.067	29%	0.288	C	S	.	.			trans	-118.9	147.6	-173.8	53.5	0	0	0	0	110.9	V54 M128 W129 L238 H278	V54-T56 HydrophobicContact CG1-CG2 4.44Å; V54-T56 PolarHBondContact O-N 3.27Å; T56-M128 HydrophobicContact CG2-CE 4.36Å; T56-M128 HydrophobicContact CG2-SD 3.68Å; T56-W129 HydrophobicContact CG2-CH2 4.45Å; T56-W129 HydrophobicContact CG2-CZ2 4.16Å; T56-L238 HydrophobicContact CG2-CB 4.17Å; T56-L238 HydrophobicContact CG2-CD2 3.61Å; T56-L238 HydrophobicContact CG2-CG 4.46Å; T56-L238 PolarHBondContact OG1-O 2.88Å; T56-L238 VanDerWaalsContact OG1-O 3.12Å; T56-H278 PolarHBondContact O-CE1 3.03Å; T56-H278 PolarHBondContact O-NE2 3.31Å; T56-H278 PolarHBondContact OG1-CD2 2.95Å; T56-H278 VanDerWaalsContact OG1-CD2 3.24Å; T56-H278 PolarHBondContact OG1-NE2 2.96Å
57	P	83.4	Confident	71.4	Confident	17 Å²	17	44.9 Å²	44.9	11%	0.11	27%	0.268	C	S	.	.			trans	-68.5	146.9	171.7	28.4	-33.8	0	0	0	111.2	Y59 M128 R240	P57-Y59 VanDerWaalsContact C-N 3.28Å; P57-Y59 HydrophobicContact CB-CD1 3.67Å; P57-Y59 HydrophobicContact CB-CD2 4.11Å; P57-Y59 HydrophobicContact CB-CE1 3.28Å; P57-Y59 HydrophobicContact CB-CE2 3.74Å; P57-Y59 HydrophobicContact CB-CG 4.03Å; P57-Y59 WeakPolarHBondContact CB-OH 3.38Å; P57-Y59 HydrophobicContact CG-CD2 4.49Å; P57-Y59 HydrophobicContact CG-CE1 4.35Å; P57-Y59 HydrophobicContact CG-CE2 3.98Å; P57-M128 HydrophobicContact CG-CB 4.03Å; P57-R240 PolarHBondContact O-NH1 3.48Å
58	S	82.9	Confident	74.4	Confident	56 Å²	56	44 Å²	44	39%	0.392	25%	0.251	S	S	.	.	S	Bend	trans	-70.3	-27.2	170.2	55	0	0	0	0	112.7
59	Y	82.5	Confident	77.5	Confident	30 Å²	30	42.8 Å²	42.8	12%	0.118	23%	0.234	C	C	.	.	S	Bend	trans	-79.5	164.2	-179.9	60.8	-99	0	0	0	113	P57 M128 R240 T490 H492 M495	P57-Y59 VanDerWaalsContact C-N 3.28Å; P57-Y59 HydrophobicContact CB-CD1 3.67Å; P57-Y59 HydrophobicContact CB-CD2 4.11Å; P57-Y59 HydrophobicContact CB-CE1 3.28Å; P57-Y59 HydrophobicContact CB-CE2 3.74Å; P57-Y59 HydrophobicContact CB-CG 4.03Å; P57-Y59 WeakPolarHBondContact CB-OH 3.38Å; P57-Y59 HydrophobicContact CG-CD2 4.49Å; P57-Y59 HydrophobicContact CG-CE1 4.35Å; P57-Y59 HydrophobicContact CG-CE2 3.98Å; Y59-M128 WeakPolarHBondContact CE2-O 3.3Å; Y59-R240 PolarHBondContact O-NH1 3.3Å; Y59-T490 WeakPolarHBondContact CB-O 3.22Å; Y59-H492 HydrophobicContact CE1-CB 4.49Å; Y59-H492 WeakPolarHBondContact OH-CB 3.49Å; Y59-M495 HydrophobicContact CD2-CE 3.74Å; Y59-M495 HydrophobicContact CE2-CE 3.35Å
60	T	88.6	Confident	80.4	Confident	2 Å²	2	43 Å²	43	1%	0.012	24%	0.235	C	C	.	.			trans	-108.1	142.8	171.7	-48.2	0	0	0	0	108.9	G127 R240 I486 E487	T60-G127 WeakPolarHBondContact CA-O 3.46Å; T60-G127 VanDerWaalsContact CG2-O 3.27Å; T60-G127 WeakPolarHBondContact CG2-O 3.28Å; T60-R240 PolarHBondContact OG1-NH2 3.01Å; T60-I486 HydrophobicContact CG2-CG2 4.37Å; T60-I486 WeakPolarHBondContact OG1-CG2 3.32Å; T60-E487 PolarHBondContact N-O 3.39Å
61	F	91.8	Very high	83	Confident	15 Å²	15	44.2 Å²	44.2	7%	0.066	24%	0.242	C	C	.	.			trans	-58	139.6	171.8	177.3	-98.8	0	0	0	110.4	L63 L111 L126 G127 V295 M495 M498 I499	F61-L63 HydrophobicContact CE1-CD2 4.17Å; F61-L63 HydrophobicContact CE1-CG 4.46Å; F61-L111 HydrophobicContact CD1-CD1 4.01Å; F61-L111 HydrophobicContact CE1-CD1 4.2Å; F61-L126 VanDerWaalsContact CB-O 3.3Å; F61-L126 WeakPolarHBondContact CB-O 3.47Å; F61-G127 PolarHBondContact N-O 3.11Å; F61-V295 HydrophobicContact CD1-CG1 4.32Å; F61-V295 WeakPolarHBondContact O-CB 3.46Å; F61-V295 WeakPolarHBondContact O-CG1 3.27Å; F61-M495 HydrophobicContact CD2-CE 3.99Å; F61-M495 HydrophobicContact CD2-CG 4.06Å; F61-M495 HydrophobicContact CD2-SD 3.8Å; F61-M495 HydrophobicContact CE2-CG 4.03Å; F61-M495 HydrophobicContact CE2-SD 4.2Å; F61-M498 HydrophobicContact CD2-CE 3.92Å; F61-M498 HydrophobicContact CE2-CE 3.35Å; F61-M498 HydrophobicContact CZ-CE 4.25Å; F61-I499 HydrophobicContact CE2-CD1 4.02Å; F61-I499 HydrophobicContact CE2-CG1 4.01Å; F61-I499 HydrophobicContact CZ-CD1 4.25Å; F61-I499 HydrophobicContact CZ-CG1 4.12Å
62	T	91.8	Very high	85.4	Confident	9 Å²	9	43.7 Å²	43.7	6%	0.055	25%	0.248	C	C	.	.			trans	-122.5	138.2	178.2	61	0	0	0	0	110.2	T296 T488	T62-T296 WeakPolarHBondContact CG2-OG1 3.38Å; T62-T488 HydrophobicContact CG2-CG2 4.09Å
63	L	91.5	Very high	87.4	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.021	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-74.3	146.6	174.4	-79.5	170	0	0	0	110.4	F61 L81 I82 W109 L111 V295 T296 M297 Q298	F61-L63 HydrophobicContact CE1-CD2 4.17Å; F61-L63 HydrophobicContact CE1-CG 4.46Å; L63-L81 HydrophobicContact CD2-CD1 4.48Å; L63-I82 HydrophobicContact CD1-CD1 3.67Å; L63-W109 HydrophobicContact CD1-CB 4.14Å; L63-L111 HydrophobicContact CD1-CD2 3.78Å; L63-L111 HydrophobicContact CD2-CD2 3.82Å; L63-L111 HydrophobicContact CG-CD2 3.93Å; L63-V295 HydrophobicContact CD1-CG2 3.82Å; L63-V295 HydrophobicContact CG-CG2 3.8Å; L63-T296 PolarHBondContact N-O 2.8Å; L63-M297 HydrophobicContact CB-CG 3.85Å; L63-M297 HydrophobicContact CD1-CE 4.07Å; L63-M297 HydrophobicContact CD1-CG 4.36Å; L63-M297 CarbonylContact O-C 3.55Å; L63-M297 WeakPolarHBondContact O-CA 3.33Å; L63-Q298 WeakPolarHBondContact O-CG 3.34Å; L63-Q298 PolarHBondContact O-N 2.83Å
64	P	90.4	Very high	88.8	Confident	17 Å²	17	41.9 Å²	41.9	11%	0.11	23%	0.234	C	C	.	.			trans	-59.9	154	165.3	28.7	-34.9	0	0	0	109.9	L66 I499 L503	P64-L66 HydrophobicContact CG-CD2 4.17Å; P64-L66 PolarHBondContact O-N 2.95Å; P64-I499 HydrophobicContact CB-CG2 4Å; P64-I499 HydrophobicContact CG-CG2 3.72Å; P64-L503 HydrophobicContact CB-CD1 4.48Å; P64-L503 HydrophobicContact CG-CD1 4.26Å; P64-L503 HydrophobicContact CG-CD2 4.47Å
65	D	90.3	Very high	89.7	Confident	26 Å²	26	44.1 Å²	44.1	14%	0.139	25%	0.25	C	S	.	.			trans	-63.1	99.7	175.1	179.1	13.3	0	0	0	110.7	S67 S68 Q298 K300	D65-S67 PolarHBondContact O-N 3.27Å; D65-S67 VanDerWaalsContact OD1-CB 3.27Å; D65-S67 WeakPolarHBondContact OD1-CB 3.3Å; D65-S67 PolarHBondContact OD1-N 3.35Å; D65-S67 PolarHBondContact OD1-OG 3.32Å; D65-S67 PolarHBondContact OD2-OG 3.45Å; D65-S68 VanDerWaalsContact O-CB 3.29Å; D65-S68 WeakPolarHBondContact O-CB 3.42Å; D65-S68 PolarHBondContact O-N 3.09Å; D65-S68 VanDerWaalsContact O-N 3.1Å; D65-S68 PolarHBondContact O-OG 3.3Å; D65-Q298 WeakPolarHBondContact CB-O 3.33Å; D65-K300 WeakPolarHBondContact OD2-CE 3.36Å; D65-K300 WeakPolarHBondContact OD2-CG 3.34Å; D65-K300 IonicContact OD2-NZ 3.18Å; D65-K300 PolarHBondContact OD2-NZ 3.29Å
66	L	91.4	Very high	90.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-66.1	-21.5	-178.5	-59.3	-171.3	0	0	0	112.4	P64 S68 F69 R74 L77 E78 L81 M297	P64-L66 HydrophobicContact CG-CD2 4.17Å; P64-L66 PolarHBondContact O-N 2.95Å; L66-S68 PolarHBondContact O-N 3.44Å; L66-F69 HydrophobicContact CD2-CD2 4.43Å; L66-F69 HydrophobicContact CD2-CE2 4.26Å; L66-F69 PolarHBondContact O-N 3.29Å; L66-R74 HydrophobicContact CB-CG 4.5Å; L66-L77 HydrophobicContact CD2-CD1 4.11Å; L66-E78 HydrophobicContact CD1-CG 4.12Å; L66-L81 HydrophobicContact CD1-CD1 3.88Å; L66-L81 HydrophobicContact CD2-CD1 3.8Å; L66-M297 HydrophobicContact CB-CE 4.14Å; L66-M297 HydrophobicContact CB-SD 4.41Å; L66-M297 HydrophobicContact CD1-CE 3.51Å; L66-M297 HydrophobicContact CG-CE 3.69Å; L66-M297 HydrophobicContact CG-SD 4.33Å
67	S	89.4	Confident	91	Very high	64 Å²	64	40.4 Å²	40.4	45%	0.448	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-71	-10.9	176.5	79.2	0	0	0	0	113.4	D65 F69	D65-S67 PolarHBondContact O-N 3.27Å; D65-S67 VanDerWaalsContact OD1-CB 3.27Å; D65-S67 WeakPolarHBondContact OD1-CB 3.3Å; D65-S67 PolarHBondContact OD1-N 3.35Å; D65-S67 PolarHBondContact OD1-OG 3.32Å; D65-S67 PolarHBondContact OD2-OG 3.45Å; S67-F69 VanDerWaalsContact C-N 3.29Å
68	S	91	Very high	91.5	Very high	58 Å²	58	41.9 Å²	41.9	41%	0.406	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-73.7	-16.9	173.7	71.1	0	0	0	0	114.6	D65 L66	D65-S68 VanDerWaalsContact O-CB 3.29Å; D65-S68 WeakPolarHBondContact O-CB 3.42Å; D65-S68 PolarHBondContact O-N 3.09Å; D65-S68 VanDerWaalsContact O-N 3.1Å; D65-S68 PolarHBondContact O-OG 3.3Å; L66-S68 PolarHBondContact O-N 3.44Å
69	F	92.5	Very high	91.9	Very high	34 Å²	34	46.1 Å²	46.1	15%	0.149	25%	0.248	C	C	.	.	S	Bend	trans	-96.2	154.4	-174.9	-59.6	-65.4	0	0	0	112.3	L66 S67 F73 R74 L77 L503	L66-F69 HydrophobicContact CD2-CD2 4.43Å; L66-F69 HydrophobicContact CD2-CE2 4.26Å; L66-F69 PolarHBondContact O-N 3.29Å; S67-F69 VanDerWaalsContact C-N 3.29Å; F69-F73 HydrophobicContact CB-CD1 3.94Å; F69-F73 HydrophobicContact CD1-CD1 4.05Å; F69-F73 HydrophobicContact CD1-CE1 4.05Å; F69-F73 HydrophobicContact CE1-CE1 4.48Å; F69-F73 HydrophobicContact CG-CD1 4.03Å; F69-F73 HydrophobicContact CG-CE1 4.26Å; F69-R74 HydrophobicContact CB-CB 4.46Å; F69-L77 HydrophobicContact CD2-CD1 3.75Å; F69-L77 HydrophobicContact CE2-CD1 4.07Å; F69-L77 HydrophobicContact CG-CD1 4.28Å; F69-L503 HydrophobicContact CE2-CD2 4.22Å; F69-L503 HydrophobicContact CZ-CD1 3.83Å; F69-L503 HydrophobicContact CZ-CD2 4.04Å
70	P	94.3	Very high	92.3	Very high	95 Å²	95	46.4 Å²	46.4	62%	0.617	25%	0.25	S	S	*	.			trans	-56.1	143.7	173.5	-23.7	33.6	0	0	0	112.4	D72 F73 R74	P70-D72 VanDerWaalsContact C-N 3.3Å; P70-D72 PolarHBondContact O-N 2.96Å; P70-D72 VanDerWaalsContact O-N 3.12Å; P70-F73 PolarHBondContact O-N 3.44Å; P70-R74 WeakPolarHBondContact O-CB 3.23Å; P70-R74 PolarHBondContact O-N 3.45Å
71	D	93.9	Very high	92.6	Very high	123 Å²	123	46.7 Å²	46.7	66%	0.658	25%	0.252	S	S	*	.	H	α-helix	trans	-51.6	-40.8	-170.9	-68.9	-28.4	0	0	0	114.5	R74 S75	D71-R74 PolarHBondContact O-N 3.47Å; D71-S75 WeakPolarHBondContact O-CB 3.5Å; D71-S75 PolarHBondContact O-N 2.95Å; D71-S75 PolarHBondContact O-OG 3.46Å
72	D	93.9	Very high	92.8	Very high	122 Å²	122	46.2 Å²	46.2	65%	0.652	25%	0.25	S	S	*	.	H	α-helix	trans	-65	-44.8	178.5	-63.6	-20.9	0	0	0	111.9	P70 S75 Y76 F510	P70-D72 VanDerWaalsContact C-N 3.3Å; P70-D72 PolarHBondContact O-N 2.96Å; P70-D72 VanDerWaalsContact O-N 3.12Å; D72-S75 PolarHBondContact O-N 3.48Å; D72-Y76 PolarHBondContact O-N 3.32Å; D72-Y76 VanDerWaalsContact O-N 3.1Å; D72-F510 HydrophobicContact CB-CE2 4.27Å; D72-F510 HydrophobicContact CB-CZ 3.81Å
73	F	94.8	Very high	93	Very high	9 Å²	9	47 Å²	47	4%	0.039	25%	0.253	C	S	.	.	H	α-helix	trans	-73.2	-37.3	179	-176.5	-128.3	0	0	0	111.2	F69 P70 Y76 L77 R507 F510	F69-F73 HydrophobicContact CB-CD1 3.94Å; F69-F73 HydrophobicContact CD1-CD1 4.05Å; F69-F73 HydrophobicContact CD1-CE1 4.05Å; F69-F73 HydrophobicContact CE1-CE1 4.48Å; F69-F73 HydrophobicContact CG-CD1 4.03Å; F69-F73 HydrophobicContact CG-CE1 4.26Å; P70-F73 PolarHBondContact O-N 3.44Å; F73-Y76 HydrophobicContact CD2-CD1 4.17Å; F73-Y76 HydrophobicContact CE2-CD1 4.07Å; F73-Y76 WeakPolarHBondContact O-CB 3.31Å; F73-Y76 PolarHBondContact O-N 3.37Å; F73-L77 HydrophobicContact CD1-CD1 4.04Å; F73-L77 HydrophobicContact CD1-CG 4.5Å; F73-L77 HydrophobicContact CD2-CG 4.4Å; F73-L77 HydrophobicContact CE1-CD1 3.65Å; F73-L77 HydrophobicContact CE1-CG 4.16Å; F73-L77 HydrophobicContact CE2-CD1 4.45Å; F73-L77 HydrophobicContact CE2-CD2 4.12Å; F73-L77 HydrophobicContact CE2-CG 4.06Å; F73-L77 HydrophobicContact CZ-CD1 3.88Å; F73-L77 HydrophobicContact CZ-CD2 3.91Å; F73-L77 HydrophobicContact CZ-CG 3.93Å; F73-L77 WeakPolarHBondContact O-CG 3.45Å; F73-L77 PolarHBondContact O-N 2.99Å; F73-R507 HydrophobicContact CE2-CB 4.2Å; F73-R507 HydrophobicContact CZ-CB 3.98Å; F73-F510 HydrophobicContact CB-CD1 4.34Å; F73-F510 HydrophobicContact CB-CE1 4.06Å; F73-F510 HydrophobicContact CB-CZ 4.19Å; F73-F510 HydrophobicContact CD2-CB 3.83Å; F73-F510 AromaticContact CD2-CD1 3.67Å; F73-F510 HydrophobicContact CD2-CD1 3.67Å; F73-F510 HydrophobicContact CD2-CD2 4.16Å; F73-F510 HydrophobicContact CD2-CE1 4.25Å; F73-F510 AromaticContact CD2-CG 3.61Å; F73-F510 HydrophobicContact CD2-CG 3.61Å; F73-F510 HydrophobicContact CE2-CB 3.94Å; F73-F510 HydrophobicContact CE2-CD1 4.44Å; F73-F510 HydrophobicContact CE2-CG 4.25Å; F73-F510 HydrophobicContact CG-CD1 4.35Å
74	R	94.5	Very high	93.1	Very high	75 Å²	75	49.6 Å²	49.6	28%	0.283	27%	0.269	S	S	.	.	H	α-helix	trans	-58.2	-47.4	171.6	176.3	-176.9	170.1	166.4	2.5	111.1	L66 F69 P70 D71 Y76 L77 E78	L66-R74 HydrophobicContact CB-CG 4.5Å; F69-R74 HydrophobicContact CB-CB 4.46Å; P70-R74 WeakPolarHBondContact O-CB 3.23Å; P70-R74 PolarHBondContact O-N 3.45Å; D71-R74 PolarHBondContact O-N 3.47Å; R74-Y76 VanDerWaalsContact C-N 3.28Å; R74-Y76 PolarHBondContact O-N 3.07Å; R74-L77 PolarHBondContact O-N 3.39Å; R74-L77 VanDerWaalsContact O-N 3.16Å; R74-E78 HydrophobicContact CG-CG 4.39Å; R74-E78 IonicContact CZ-OE1 3.28Å; R74-E78 IonicContact NE-OE1 3.05Å; R74-E78 PolarHBondContact NE-OE1 3.06Å; R74-E78 IonicContact NH2-OE1 2.74Å; R74-E78 PolarHBondContact NH2-OE1 3.22Å; R74-E78 WeakPolarHBondContact O-CG 3.08Å; R74-E78 PolarHBondContact O-N 2.6Å
75	S	93.5	Very high	93.3	Very high	71 Å²	71	51.8 Å²	51.8	50%	0.497	29%	0.285	S	S	.	.	H	α-helix	trans	-61.9	-38.2	178.4	-60.7	0	0	0	0	111.9	D71 D72 K79	D71-S75 WeakPolarHBondContact O-CB 3.5Å; D71-S75 PolarHBondContact O-N 2.95Å; D71-S75 PolarHBondContact O-OG 3.46Å; D72-S75 PolarHBondContact O-N 3.48Å; S75-K79 WeakPolarHBondContact O-CB 3.44Å; S75-K79 PolarHBondContact O-N 3.4Å; S75-K79 VanDerWaalsContact O-N 3.08Å
76	Y	94	Very high	93.5	Very high	21 Å²	21	50.6 Å²	50.6	8%	0.082	28%	0.279	C	S	.	.	H	α-helix	trans	-62.4	-47.6	172.4	174.5	-87.9	0	0	0	111.8	D72 F73 R74 K79 E80 A506 R509 F510 E513	D72-Y76 PolarHBondContact O-N 3.32Å; D72-Y76 VanDerWaalsContact O-N 3.1Å; F73-Y76 HydrophobicContact CD2-CD1 4.17Å; F73-Y76 HydrophobicContact CE2-CD1 4.07Å; F73-Y76 WeakPolarHBondContact O-CB 3.31Å; F73-Y76 PolarHBondContact O-N 3.37Å; R74-Y76 VanDerWaalsContact C-N 3.28Å; R74-Y76 PolarHBondContact O-N 3.07Å; Y76-K79 PolarHBondContact O-N 2.87Å; Y76-E80 HydrophobicContact CE1-CG 4.18Å; Y76-E80 WeakPolarHBondContact CE1-OE2 3.44Å; Y76-E80 PolarHBondContact O-N 2.82Å; Y76-E80 VanDerWaalsContact O-N 3.1Å; Y76-E80 PolarHBondContact OH-OE1 3.34Å; Y76-E80 PolarHBondContact OH-OE2 3.37Å; Y76-A506 HydrophobicContact CE1-CB 4.35Å; Y76-A506 WeakPolarHBondContact CE1-O 3.05Å; Y76-R509 WeakPolarHBondContact OH-CB 3.48Å; Y76-F510 HydrophobicContact CD1-CB 3.84Å; Y76-F510 HydrophobicContact CD1-CD2 4.19Å; Y76-F510 HydrophobicContact CD1-CG 4.38Å; Y76-F510 HydrophobicContact CD2-CB 4.15Å; Y76-F510 AromaticContact CD2-CD2 3.73Å; Y76-F510 HydrophobicContact CD2-CD2 3.73Å; Y76-F510 HydrophobicContact CD2-CG 4.44Å; Y76-F510 HydrophobicContact CE1-CB 3.94Å; Y76-F510 HydrophobicContact CE2-CB 4.22Å; Y76-F510 HydrophobicContact CG-CB 3.97Å; Y76-F510 AromaticContact CG-CD2 3.54Å; Y76-F510 HydrophobicContact CG-CD2 3.54Å; Y76-F510 HydrophobicContact CG-CE2 4.46Å; Y76-F510 HydrophobicContact CG-CG 4.16Å; Y76-E513 WeakPolarHBondContact CE2-OE2 3.4Å
77	L	94.7	Very high	93.7	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-45.1	176.8	-73	179.2	0	0	0	112.1	L66 F69 F73 R74 K79 E80 L81 Y502 L503 A506	L66-L77 HydrophobicContact CD2-CD1 4.11Å; F69-L77 HydrophobicContact CD2-CD1 3.75Å; F69-L77 HydrophobicContact CE2-CD1 4.07Å; F69-L77 HydrophobicContact CG-CD1 4.28Å; F73-L77 HydrophobicContact CD1-CD1 4.04Å; F73-L77 HydrophobicContact CD1-CG 4.5Å; F73-L77 HydrophobicContact CD2-CG 4.4Å; F73-L77 HydrophobicContact CE1-CD1 3.65Å; F73-L77 HydrophobicContact CE1-CG 4.16Å; F73-L77 HydrophobicContact CE2-CD1 4.45Å; F73-L77 HydrophobicContact CE2-CD2 4.12Å; F73-L77 HydrophobicContact CE2-CG 4.06Å; F73-L77 HydrophobicContact CZ-CD1 3.88Å; F73-L77 HydrophobicContact CZ-CD2 3.91Å; F73-L77 HydrophobicContact CZ-CG 3.93Å; F73-L77 WeakPolarHBondContact O-CG 3.45Å; F73-L77 PolarHBondContact O-N 2.99Å; R74-L77 PolarHBondContact O-N 3.39Å; R74-L77 VanDerWaalsContact O-N 3.16Å; L77-K79 VanDerWaalsContact C-N 3.28Å; L77-K79 PolarHBondContact O-N 3.41Å; L77-E80 PolarHBondContact O-N 2.9Å; L77-E80 VanDerWaalsContact O-N 3.16Å; L77-L81 HydrophobicContact CB-CD1 3.78Å; L77-L81 HydrophobicContact CD2-CD1 4.23Å; L77-L81 HydrophobicContact CG-CD1 4.47Å; L77-L81 VanDerWaalsContact O-CB 3.31Å; L77-L81 WeakPolarHBondContact O-CB 3.49Å; L77-L81 WeakPolarHBondContact O-CD1 3.28Å; L77-L81 WeakPolarHBondContact O-CG 3.45Å; L77-L81 PolarHBondContact O-N 2.93Å; L77-Y502 HydrophobicContact CD2-CE1 4.25Å; L77-L503 HydrophobicContact CD1-CD2 3.95Å; L77-L503 HydrophobicContact CD2-CD2 4.23Å; L77-A506 HydrophobicContact CD2-CB 3.87Å
78	E	94.1	Very high	94	Very high	49 Å²	49	55.4 Å²	55.4	23%	0.229	29%	0.292	C	S	.	.	H	α-helix	trans	-60.4	-38.9	177.2	-74.5	179.7	-178.5	0	0	111.6	L66 R74 I82	L66-E78 HydrophobicContact CD1-CG 4.12Å; R74-E78 HydrophobicContact CG-CG 4.39Å; R74-E78 IonicContact CZ-OE1 3.28Å; R74-E78 IonicContact NE-OE1 3.05Å; R74-E78 PolarHBondContact NE-OE1 3.06Å; R74-E78 IonicContact NH2-OE1 2.74Å; R74-E78 PolarHBondContact NH2-OE1 3.22Å; R74-E78 WeakPolarHBondContact O-CG 3.08Å; R74-E78 PolarHBondContact O-N 2.6Å; E78-I82 VanDerWaalsContact O-CB 3.31Å; E78-I82 WeakPolarHBondContact O-CB 3.33Å; E78-I82 PolarHBondContact O-N 3.06Å
79	K	91.8	Very high	94.2	Very high	145 Å²	145	54.6 Å²	54.6	63%	0.63	29%	0.286	S	S	*	.	H	α-helix	trans	-66.3	-33.5	175.7	178.8	-173.7	170.6	-164.3	0	113.1	S75 Y76 L77 E513	S75-K79 WeakPolarHBondContact O-CB 3.44Å; S75-K79 PolarHBondContact O-N 3.4Å; S75-K79 VanDerWaalsContact O-N 3.08Å; Y76-K79 PolarHBondContact O-N 2.87Å; L77-K79 VanDerWaalsContact C-N 3.28Å; L77-K79 PolarHBondContact O-N 3.41Å; K79-E513 IonicContact NZ-OE1 2.73Å
80	E	90.6	Very high	94.3	Very high	35 Å²	35	53 Å²	53	16%	0.164	28%	0.279	C	S	.	.	H	α-helix	trans	-84.6	-43	178	-72.3	-154.5	108.5	0	0	113	Y76 L77 Y502 R509 F526	Y76-E80 HydrophobicContact CE1-CG 4.18Å; Y76-E80 WeakPolarHBondContact CE1-OE2 3.44Å; Y76-E80 PolarHBondContact O-N 2.82Å; Y76-E80 VanDerWaalsContact O-N 3.1Å; Y76-E80 PolarHBondContact OH-OE1 3.34Å; Y76-E80 PolarHBondContact OH-OE2 3.37Å; L77-E80 PolarHBondContact O-N 2.9Å; L77-E80 VanDerWaalsContact O-N 3.16Å; E80-Y502 PolarHBondContact OE2-OH 3.27Å; E80-R509 IonicContact OE1-CZ 2.82Å; E80-R509 IonicContact OE1-NH1 3.47Å; E80-R509 PolarHBondContact OE1-NH1 2.99Å; E80-R509 IonicContact OE1-NH2 2.68Å; E80-R509 PolarHBondContact OE1-NH2 3.13Å; E80-R509 IonicContact OE2-CZ 3.69Å; E80-R509 VanDerWaalsContact OE2-CZ 3.28Å; E80-R509 IonicContact OE2-NE 3.5Å; E80-R509 IonicContact OE2-NH1 3.31Å; E80-R509 IonicContact OE2-NH2 3.22Å; E80-R509 PolarHBondContact OE2-NH2 3.16Å; E80-F526 HydrophobicContact CB-CE2 4.45Å; E80-F526 WeakPolarHBondContact O-CD2 3.46Å; E80-F526 WeakPolarHBondContact O-CE2 3.23Å
81	L	94.1	Very high	94.4	Very high	8 Å²	8	51.7 Å²	51.7	4%	0.042	27%	0.265	C	S	.	.	H	α-helix	trans	-89.3	-31.3	-169.5	-47.4	154.3	0	0	0	114.5	L63 L66 L77 L111 A112 Y502 F526	L63-L81 HydrophobicContact CD2-CD1 4.48Å; L66-L81 HydrophobicContact CD1-CD1 3.88Å; L66-L81 HydrophobicContact CD2-CD1 3.8Å; L77-L81 HydrophobicContact CB-CD1 3.78Å; L77-L81 HydrophobicContact CD2-CD1 4.23Å; L77-L81 HydrophobicContact CG-CD1 4.47Å; L77-L81 VanDerWaalsContact O-CB 3.31Å; L77-L81 WeakPolarHBondContact O-CB 3.49Å; L77-L81 WeakPolarHBondContact O-CD1 3.28Å; L77-L81 WeakPolarHBondContact O-CG 3.45Å; L77-L81 PolarHBondContact O-N 2.93Å; L81-L111 WeakPolarHBondContact O-CA 3.49Å; L81-A112 PolarHBondContact O-N 3.16Å; L81-Y502 HydrophobicContact CD2-CD1 3.91Å; L81-Y502 HydrophobicContact CD2-CE1 3.19Å; L81-Y502 HydrophobicContact CD2-CE2 4.47Å; L81-Y502 HydrophobicContact CG-CE1 4.25Å; L81-F526 HydrophobicContact CB-CE2 3.55Å; L81-F526 HydrophobicContact CB-CZ 3.47Å; L81-F526 VanDerWaalsContact CB-CZ 3.47Å; L81-F526 HydrophobicContact CD2-CE1 4.16Å; L81-F526 HydrophobicContact CD2-CE2 3.29Å; L81-F526 HydrophobicContact CD2-CZ 3.03Å; L81-F526 HydrophobicContact CG-CE2 3.58Å; L81-F526 HydrophobicContact CG-CZ 3.62Å
82	I	96	Very high	94.4	Very high	6 Å²	6	50.8 Å²	50.8	3%	0.031	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-107.5	131.5	-170.1	-51.2	-53.5	0	0	0	109.8	L63 E78 T84 L87 W109 P110	L63-I82 HydrophobicContact CD1-CD1 3.67Å; E78-I82 VanDerWaalsContact O-CB 3.31Å; E78-I82 WeakPolarHBondContact O-CB 3.33Å; E78-I82 PolarHBondContact O-N 3.06Å; I82-T84 HydrophobicContact CB-CG2 4.29Å; I82-T84 HydrophobicContact CG2-CG2 4.33Å; I82-T84 PolarHBondContact O-N 2.87Å; I82-L87 HydrophobicContact CG2-CD2 3.98Å; I82-W109 HydrophobicContact CD1-CB 4.06Å; I82-W109 HydrophobicContact CG2-CE3 4.45Å; I82-P110 CarbonylContact C-O 3.51Å; I82-P110 WeakPolarHBondContact CA-O 3.3Å; I82-P110 HydrophobicContact CG2-CG 4.33Å
83	E	96.1	Very high	94.3	Very high	25 Å²	25	47 Å²	47	12%	0.117	25%	0.252	C	S	.	.			trans	-74.4	77.2	168.9	-171	53.3	-124.5	0	0	109.1	S85 S86 L87 P110	E83-S85 PolarHBondContact O-N 3.22Å; E83-S85 PolarHBondContact OE1-OG 3.23Å; E83-S86 VanDerWaalsContact CG-OG 3.26Å; E83-S86 WeakPolarHBondContact CG-OG 3.48Å; E83-S86 PolarHBondContact O-N 2.87Å; E83-L87 PolarHBondContact O-N 3.38Å; E83-P110 HydrophobicContact CB-CB 4.3Å; E83-P110 HydrophobicContact CB-CG 4.46Å; E83-P110 PolarHBondContact N-O 2.71Å
84	T	94.6	Very high	94.3	Very high	58 Å²	58	47.4 Å²	47.4	36%	0.356	26%	0.258	S	S	.	.	H	α-helix	trans	-60.7	-27.4	-171.4	59.1	0	0	0	0	113.6	I82 K88	I82-T84 HydrophobicContact CB-CG2 4.29Å; I82-T84 HydrophobicContact CG2-CG2 4.33Å; I82-T84 PolarHBondContact O-N 2.87Å; T84-K88 WeakPolarHBondContact O-CB 3.27Å; T84-K88 WeakPolarHBondContact O-CG 3.43Å; T84-K88 PolarHBondContact O-N 3.25Å; T84-K88 VanDerWaalsContact O-N 3.13Å
85	S	93.6	Very high	94.3	Very high	64 Å²	64	45 Å²	45	45%	0.448	25%	0.25	S	S	.	.	H	α-helix	trans	-61.2	-57	173.2	-10.6	0	0	0	0	110.8	E83 L87 K88 S89	E83-S85 PolarHBondContact O-N 3.22Å; E83-S85 PolarHBondContact OE1-OG 3.23Å; S85-L87 VanDerWaalsContact C-N 3.34Å; S85-L87 PolarHBondContact O-N 3.08Å; S85-K88 PolarHBondContact O-N 3.01Å; S85-S89 VanDerWaalsContact O-CB 3.28Å; S85-S89 WeakPolarHBondContact O-CB 3.41Å; S85-S89 PolarHBondContact O-N 3.07Å
86	S	95	Very high	94.5	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.007	23%	0.227	C	C	.	.	H	α-helix	trans	-63.2	-40.2	-179.6	-54.7	0	0	0	0	111.8	E83 S89 L90 D287	E83-S86 VanDerWaalsContact CG-OG 3.26Å; E83-S86 WeakPolarHBondContact CG-OG 3.48Å; E83-S86 PolarHBondContact O-N 2.87Å; S86-S89 PolarHBondContact O-N 3.49Å; S86-L90 WeakPolarHBondContact O-CB 3.24Å; S86-L90 WeakPolarHBondContact O-CG 3.48Å; S86-L90 PolarHBondContact O-N 2.78Å; S86-D287 WeakPolarHBondContact CA-OD2 3.32Å
87	L	96.4	Very high	94.6	Very high	19 Å²	19	41.2 Å²	41.2	10%	0.099	23%	0.226	C	C	.	.	H	α-helix	trans	-55.9	-54.5	175.4	178.9	59.6	0	0	0	111	I82 E83 S85 E91 L96 W109 P110	I82-L87 HydrophobicContact CG2-CD2 3.98Å; E83-L87 PolarHBondContact O-N 3.38Å; S85-L87 VanDerWaalsContact C-N 3.34Å; S85-L87 PolarHBondContact O-N 3.08Å; L87-E91 HydrophobicContact CD1-CG 4.02Å; L87-E91 WeakPolarHBondContact O-CB 3.33Å; L87-E91 WeakPolarHBondContact O-CG 3.03Å; L87-E91 PolarHBondContact O-N 2.92Å; L87-L96 HydrophobicContact CD1-CD2 4.01Å; L87-W109 HydrophobicContact CD2-CE3 3.96Å; L87-W109 HydrophobicContact CD2-CZ3 3.96Å; L87-P110 HydrophobicContact CB-CG 3.67Å; L87-P110 HydrophobicContact CD1-CG 4.41Å
88	K	95.6	Very high	94.7	Very high	146 Å²	146	41.8 Å²	41.8	64%	0.635	23%	0.228	S	C	*	.	H	α-helix	trans	-65.6	-42.1	-178.4	-71.6	174	-179	174.8	0	112.2	T84 S85 S92	T84-K88 WeakPolarHBondContact O-CB 3.27Å; T84-K88 WeakPolarHBondContact O-CG 3.43Å; T84-K88 PolarHBondContact O-N 3.25Å; T84-K88 VanDerWaalsContact O-N 3.13Å; S85-K88 PolarHBondContact O-N 3.01Å; K88-S92 WeakPolarHBondContact O-CB 3.37Å; K88-S92 PolarHBondContact O-N 3.24Å; K88-S92 PolarHBondContact O-OG 2.98Å
89	S	93.9	Very high	94.7	Very high	40 Å²	40	39.5 Å²	39.5	28%	0.28	22%	0.217	S	C	.	.	H	α-helix	trans	-61.5	-49.8	179.9	-176	0	0	0	0	111.6	S85 S86 S92 S93 D287	S85-S89 VanDerWaalsContact O-CB 3.28Å; S85-S89 WeakPolarHBondContact O-CB 3.41Å; S85-S89 PolarHBondContact O-N 3.07Å; S86-S89 PolarHBondContact O-N 3.49Å; S89-S92 PolarHBondContact O-OG 3Å; S89-S92 VanDerWaalsContact O-OG 3.09Å; S89-S93 WeakPolarHBondContact O-CB 3.46Å; S89-S93 PolarHBondContact O-N 2.9Å; S89-S93 PolarHBondContact O-OG 3.11Å; S89-D287 WeakPolarHBondContact CB-OD2 3.2Å; S89-D287 PolarHBondContact OG-OD2 2.84Å; S89-D287 VanDerWaalsContact OG-OD2 3.12Å
90	L	95.9	Very high	94.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-76.8	-31.8	-176.8	-63.9	173.8	0	0	0	113.4	S86 S93 G94 H95 L96 C285 D287	S86-L90 WeakPolarHBondContact O-CB 3.24Å; S86-L90 WeakPolarHBondContact O-CG 3.48Å; S86-L90 PolarHBondContact O-N 2.78Å; L90-S93 WeakPolarHBondContact CA-OG 3.44Å; L90-S93 PolarHBondContact O-OG 3.25Å; L90-G94 PolarHBondContact O-N 2.09Å; L90-H95 HydrophobicContact CD2-CB 4.4Å; L90-H95 PolarHBondContact O-N 3.43Å; L90-L96 HydrophobicContact CB-CB 3.59Å; L90-L96 HydrophobicContact CB-CD2 4.19Å; L90-L96 PolarHBondContact O-N 2.72Å; L90-C285 HydrophobicContact CD1-CB 3.58Å; L90-D287 HydrophobicContact CD1-CB 4.45Å; L90-D287 HydrophobicContact CG-CB 4.46Å
91	E	96.3	Very high	94.5	Very high	69 Å²	69	36.3 Å²	36.3	32%	0.322	22%	0.218	S	C	.	.	H	α-helix	trans	-69.2	-44.8	171.5	-74.7	-169.5	150.1	0	0	111.3	L87 S93 G94 L96 N97	L87-E91 HydrophobicContact CD1-CG 4.02Å; L87-E91 WeakPolarHBondContact O-CB 3.33Å; L87-E91 WeakPolarHBondContact O-CG 3.03Å; L87-E91 PolarHBondContact O-N 2.92Å; E91-S93 PolarHBondContact O-N 3.22Å; E91-G94 PolarHBondContact O-N 2.87Å; E91-G94 VanDerWaalsContact O-N 3.09Å; E91-L96 HydrophobicContact CG-CB 4.42Å; E91-L96 HydrophobicContact CG-CG 4.46Å; E91-N97 HydrophobicContact CG-CB 4.22Å; E91-N97 WeakPolarHBondContact OE1-CB 3.33Å; E91-N97 PolarHBondContact OE1-ND2 3.26Å
92	S	93.6	Very high	94.2	Very high	104 Å²	104	37.6 Å²	37.6	73%	0.727	22%	0.224	S	C	*	.	H	α-helix	trans	-69	-31.8	-178.8	64.4	0	0	0	0	113.5	K88 S89 G94	K88-S92 WeakPolarHBondContact O-CB 3.37Å; K88-S92 PolarHBondContact O-N 3.24Å; K88-S92 PolarHBondContact O-OG 2.98Å; S89-S92 PolarHBondContact O-OG 3Å; S89-S92 VanDerWaalsContact O-OG 3.09Å; S92-G94 VanDerWaalsContact C-N 3.26Å
93	S	91.6	Very high	93.7	Very high	42 Å²	42	37.6 Å²	37.6	29%	0.294	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-6.8	172.3	61	0	0	0	0	113.6	S89 L90 E91 H95	S89-S93 WeakPolarHBondContact O-CB 3.46Å; S89-S93 PolarHBondContact O-N 2.9Å; S89-S93 PolarHBondContact O-OG 3.11Å; L90-S93 WeakPolarHBondContact CA-OG 3.44Å; L90-S93 PolarHBondContact O-OG 3.25Å; E91-S93 PolarHBondContact O-N 3.22Å; S93-H95 WeakPolarHBondContact CB-ND1 3.41Å; S93-H95 PolarHBondContact O-ND1 3.38Å; S93-H95 PolarHBondContact OG-ND1 3.48Å
94	G	94	Very high	93.2	Very high	18 Å²	18	39.7 Å²	39.7	19%	0.186	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	18.7	176.2	0	0	0	0	0	115.3	L90 E91 S92	L90-G94 PolarHBondContact O-N 2.09Å; E91-G94 PolarHBondContact O-N 2.87Å; E91-G94 VanDerWaalsContact O-N 3.09Å; S92-G94 VanDerWaalsContact C-N 3.26Å
95	H	95.6	Very high	92.9	Very high	25 Å²	25	37.5 Å²	37.5	12%	0.116	23%	0.229	C	C	.	.	S	Bend	trans	-95.2	-31.8	-179.6	-64.6	88.5	0	0	0	112.9	L90 S93 I245 A246 D247	L90-H95 HydrophobicContact CD2-CB 4.4Å; L90-H95 PolarHBondContact O-N 3.43Å; S93-H95 WeakPolarHBondContact CB-ND1 3.41Å; S93-H95 PolarHBondContact O-ND1 3.38Å; S93-H95 PolarHBondContact OG-ND1 3.48Å; H95-I245 HydrophobicContact CB-CG2 4.07Å; H95-I245 VanDerWaalsContact O-CG2 3.31Å; H95-I245 WeakPolarHBondContact O-CG2 3.48Å; H95-A246 PolarHBondContact CD2-O 3.19Å; H95-D247 IonicContact CE1-OD1 3.12Å; H95-D247 PolarHBondContact CE1-OD1 3.25Å; H95-D247 IonicContact ND1-OD1 2.79Å; H95-D247 IonicContact NE2-OD1 3.33Å
96	L	97	Very high	92.9	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.01	21%	0.213	C	C	.	.	S	Bend	trans	-111.2	143.3	-179.7	-178.3	61.4	0	0	0	111.5	L87 L90 E91 W98 W99 L108 I245 L294	L87-L96 HydrophobicContact CD1-CD2 4.01Å; L90-L96 HydrophobicContact CB-CB 3.59Å; L90-L96 HydrophobicContact CB-CD2 4.19Å; L90-L96 PolarHBondContact O-N 2.72Å; E91-L96 HydrophobicContact CG-CB 4.42Å; E91-L96 HydrophobicContact CG-CG 4.46Å; L96-W98 PolarHBondContact O-N 3.35Å; L96-W99 HydrophobicContact CD1-CH2 3.92Å; L96-W99 HydrophobicContact CD1-CZ2 4.37Å; L96-L108 HydrophobicContact CD1-CB 4.31Å; L96-I245 HydrophobicContact CB-CG2 4.37Å; L96-L294 HydrophobicContact CD1-CD1 3.71Å; L96-L294 HydrophobicContact CD1-CD2 3.88Å; L96-L294 HydrophobicContact CD1-CG 4.48Å; L96-L294 HydrophobicContact CD2-CD2 3.95Å
97	N	96.8	Very high	92.8	Very high	9 Å²	9	40.3 Å²	40.3	5%	0.048	23%	0.234	C	C	.	.	S	Bend	trans	57.3	11.4	173.3	-64.7	-29.3	0	0	0	116.7	E91 W99 A100 K107 L108	E91-N97 HydrophobicContact CG-CB 4.22Å; E91-N97 WeakPolarHBondContact OE1-CB 3.33Å; E91-N97 PolarHBondContact OE1-ND2 3.26Å; N97-W99 PolarHBondContact O-N 3.15Å; N97-A100 PolarHBondContact O-N 3.13Å; N97-K107 HydrophobicContact CB-CG 4.5Å; N97-L108 PolarHBondContact ND2-O 3.19Å; N97-L108 PolarHBondContact OD1-N 3.09Å; N97-L108 PolarHBondContact OD1-O 2.96Å
98	W	95.3	Very high	92.8	Very high	12 Å²	12	39.5 Å²	39.5	5%	0.045	23%	0.229	C	C	.	.	S	Bend	trans	-62	-34.4	176.3	61.8	-98.7	0	0	0	111.8	L96 A100 S101 E102 P311 R315 R317 I481	L96-W98 PolarHBondContact O-N 3.35Å; W98-A100 PolarHBondContact O-N 3.31Å; W98-S101 PolarHBondContact O-N 3.32Å; W98-S101 PolarHBondContact O-OG 2.71Å; W98-E102 PolarHBondContact O-N 3.03Å; W98-P311 HydrophobicContact CH2-CB 3.98Å; W98-P311 HydrophobicContact CH2-CG 3.97Å; W98-P311 HydrophobicContact CZ2-CB 3.63Å; W98-P311 HydrophobicContact CZ2-CG 3.75Å; W98-R315 HydrophobicContact CB-CG 4.43Å; W98-R315 HydrophobicContact CD2-CB 3.93Å; W98-R315 HydrophobicContact CD2-CG 3.99Å; W98-R315 HydrophobicContact CE3-CB 4.35Å; W98-R315 HydrophobicContact CE3-CG 4.01Å; W98-R315 HydrophobicContact CG-CB 4.09Å; W98-R315 HydrophobicContact CG-CG 4.19Å; W98-R317 VanDerWaalsContact CH2-NH1 3.32Å; W98-I481 HydrophobicContact CH2-CG2 4.3Å; W98-I481 HydrophobicContact CZ3-CD1 4.1Å; W98-I481 HydrophobicContact CZ3-CG1 4.17Å
99	W	94.1	Very high	92.9	Very high	1 Å²	1	34.8 Å²	34.8	0%	0.004	21%	0.207	C	C	.	.	H	α-helix	trans	-65.5	-37.1	178	55	91.5	0	0	0	112.5	L96 N97 S101 E102 S103 L108 I310 P311 I481	L96-W99 HydrophobicContact CD1-CH2 3.92Å; L96-W99 HydrophobicContact CD1-CZ2 4.37Å; N97-W99 PolarHBondContact O-N 3.15Å; W99-S101 PolarHBondContact O-N 2.82Å; W99-S101 VanDerWaalsContact O-N 3.15Å; W99-E102 CarbonylContact O-C 3.57Å; W99-E102 PolarHBondContact O-N 2.62Å; W99-S103 PolarHBondContact O-N 2.87Å; W99-S103 PolarHBondContact O-OG 2.9Å; W99-S103 VanDerWaalsContact O-OG 3.08Å; W99-L108 HydrophobicContact CZ2-CD1 3.89Å; W99-L108 HydrophobicContact CZ2-CG 4.15Å; W99-I310 HydrophobicContact CH2-CD1 3.53Å; W99-I310 HydrophobicContact CZ2-CD1 3.84Å; W99-I310 HydrophobicContact CZ3-CD1 4.29Å; W99-P311 HydrophobicContact CB-CG 3.79Å; W99-P311 VanDerWaalsContact CD2-CD 3.45Å; W99-P311 HydrophobicContact CD2-CG 3.56Å; W99-P311 HydrophobicContact CE3-CG 3.48Å; W99-P311 VanDerWaalsContact CE3-CG 3.48Å; W99-P311 HydrophobicContact CG-CG 3.71Å; W99-P311 HydrophobicContact CZ3-CG 4.19Å; W99-I481 HydrophobicContact CB-CD1 3.98Å; W99-I481 HydrophobicContact CB-CG2 4.31Å
100	A	91.9	Very high	93.1	Very high	22 Å²	22	32.9 Å²	32.9	18%	0.182	19%	0.194	C	C	.	.	H	α-helix	trans	-66.8	-13.9	177.8	0	0	0	0	0	113.1	N97 W98 S103 K107	N97-A100 PolarHBondContact O-N 3.13Å; W98-A100 PolarHBondContact O-N 3.31Å; A100-S103 CarbonylContact C-O 3.09Å; A100-K107 HydrophobicContact CB-CG 3.76Å
101	S	87.4	Confident	93.1	Very high	91 Å²	91	32.9 Å²	32.9	64%	0.636	19%	0.194	S	C	*	.	H	α-helix	trans	-92.4	-17.6	171.4	72.7	0	0	0	0	113.7	W98 W99	W98-S101 PolarHBondContact O-N 3.32Å; W98-S101 PolarHBondContact O-OG 2.71Å; W99-S101 PolarHBondContact O-N 2.82Å; W99-S101 VanDerWaalsContact O-N 3.15Å
102	E	87.3	Confident	93.1	Very high	35 Å²	35	29.9 Å²	29.9	16%	0.164	18%	0.181	C	C	.	.	H	α-helix	trans	-104.3	-11.2	-177.1	-69.9	179.3	-164.1	0	0	112.3	W98 W99 R315 R317 V369 E370 I481	W98-E102 PolarHBondContact O-N 3.03Å; W99-E102 CarbonylContact O-C 3.57Å; W99-E102 PolarHBondContact O-N 2.62Å; E102-R315 IonicContact OE1-CZ 2.85Å; E102-R315 IonicContact OE1-NE 3.17Å; E102-R315 PolarHBondContact OE1-NE 3Å; E102-R315 IonicContact OE1-NH2 3.7Å; E102-R315 PolarHBondContact OE1-NH2 3.04Å; E102-R315 VanDerWaalsContact OE1-NH2 3.07Å; E102-R317 IonicContact OE2-CZ 3.63Å; E102-R317 IonicContact OE2-NH1 3.63Å; E102-R317 IonicContact OE2-NH2 3.97Å; E102-R317 PolarHBondContact OE2-NH2 2.86Å; E102-V369 HydrophobicContact CB-CG1 4.28Å; E102-E370 PolarHBondContact O-N 3.15Å; E102-I481 HydrophobicContact CB-CD1 4.07Å
103	S	85	Confident	93	Very high	6 Å²	6	25 Å²	25	4%	0.042	15%	0.147	C	C	.	.	S	Bend	trans	-154.8	170.4	178.3	65.7	0	0	0	0	111.7	W99 A100 C105	W99-S103 PolarHBondContact O-N 2.87Å; W99-S103 PolarHBondContact O-OG 2.9Å; W99-S103 VanDerWaalsContact O-OG 3.08Å; A100-S103 CarbonylContact C-O 3.09Å; S103-C105 PolarHBondContact O-N 3.28Å; S103-C105 PolarHBondContact OG-SG 3.43Å
104	S	85.4	Confident	92.8	Very high	70 Å²	70	26.1 Å²	26.1	49%	0.49	15%	0.147	S	C	.	.	S	Bend	trans	-75.6	34.6	176.9	33.5	0	0	0	0	114.6	T306 E370	S104-T306 VanDerWaalsContact O-CB 3.24Å; S104-T306 WeakPolarHBondContact O-CB 3.38Å; S104-T306 WeakPolarHBondContact O-CG2 3.49Å; S104-E370 WeakPolarHBondContact CB-OE1 3.33Å; S104-E370 PolarHBondContact N-OE1 3.08Å; S104-E370 PolarHBondContact OG-OE1 3.07Å
105	C	90.1	Very high	92.5	Very high	12 Å²	12	28.3 Å²	28.3	8%	0.081	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-85.4	156.8	177.3	-64.5	0	0	0	0	113	S103 I309 I367	S103-C105 PolarHBondContact O-N 3.28Å; S103-C105 PolarHBondContact OG-SG 3.43Å; C105-I309 HydrophobicContact CB-CG1 4.28Å; C105-I367 WeakPolarHBondContact SG-CD1 3.25Å
106	Q	91.8	Very high	92.2	Very high	23 Å²	23	27.6 Å²	27.6	11%	0.107	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-70.2	146.6	174.8	-62.2	-171.6	18.5	0	0	112.6	T296 T306 P307	Q106-T296 HydrophobicContact CB-CG2 4.33Å; Q106-T296 VanDerWaalsContact OE1-CB 3.27Å; Q106-T306 VanDerWaalsContact CG-OG1 3.23Å; Q106-T306 WeakPolarHBondContact CG-OG1 3.48Å; Q106-T306 PolarHBondContact NE2-O 3.26Å; Q106-T306 PolarHBondContact NE2-OG1 3.17Å; Q106-P307 PolarHBondContact N-O 3.09Å; Q106-P307 VanDerWaalsContact N-O 3.15Å
107	K	94.4	Very high	91.9	Very high	101 Å²	101	28.2 Å²	28.2	44%	0.439	17%	0.173	S	C	.	.	P	Polyproline II helix	trans	-76.7	146.9	166.6	-70.4	-168.8	173.8	-161	0	110.9	N97 A100	N97-K107 HydrophobicContact CB-CG 4.5Å; A100-K107 HydrophobicContact CB-CG 3.76Å
108	L	96.8	Very high	91.9	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-103.6	145.5	171.6	-56.2	-176.2	0	0	0	110.9	L96 N97 W99 V283 L294 V295 T296 I310 I486	L96-L108 HydrophobicContact CD1-CB 4.31Å; N97-L108 PolarHBondContact ND2-O 3.19Å; N97-L108 PolarHBondContact OD1-N 3.09Å; N97-L108 PolarHBondContact OD1-O 2.96Å; W99-L108 HydrophobicContact CZ2-CD1 3.89Å; W99-L108 HydrophobicContact CZ2-CG 4.15Å; L108-V283 HydrophobicContact CD1-CG1 4.16Å; L108-L294 HydrophobicContact CB-CB 4.17Å; L108-L294 HydrophobicContact CB-CD2 4.22Å; L108-L294 HydrophobicContact CD1-CB 4.21Å; L108-L294 HydrophobicContact CD1-CD1 4.41Å; L108-V295 WeakPolarHBondContact CA-O 3.5Å; L108-T296 HydrophobicContact CD2-CG2 3.57Å; L108-I310 HydrophobicContact CD1-CD1 3.96Å; L108-I486 HydrophobicContact CD1-CD1 4.11Å; L108-I486 HydrophobicContact CD2-CD1 3.96Å
109	W	97	Very high	91.9	Very high	47 Å²	47	27.7 Å²	27.7	18%	0.178	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.3	-173.3	-59.3	88.6	0	0	0	110	L63 I82 L87 L111 V295 M297	L63-W109 HydrophobicContact CD1-CB 4.14Å; I82-W109 HydrophobicContact CD1-CB 4.06Å; I82-W109 HydrophobicContact CG2-CE3 4.45Å; L87-W109 HydrophobicContact CD2-CE3 3.96Å; L87-W109 HydrophobicContact CD2-CZ3 3.96Å; W109-L111 PolarHBondContact O-N 3.01Å; W109-V295 PolarHBondContact N-O 2.94Å; W109-V295 PolarHBondContact O-N 2.91Å; W109-M297 HydrophobicContact CD2-CE 3.5Å; W109-M297 HydrophobicContact CD2-SD 4.31Å; W109-M297 VanDerWaalsContact CE2-CE 3.49Å; W109-M297 HydrophobicContact CE3-CE 3.95Å; W109-M297 HydrophobicContact CG-CE 3.79Å; W109-M297 HydrophobicContact CG-CG 4.45Å; W109-M297 HydrophobicContact CH2-CE 4.34Å; W109-M297 HydrophobicContact CZ2-CE 3.93Å; W109-M297 HydrophobicContact CZ2-SD 3.96Å; W109-M297 HydrophobicContact CZ3-CE 4.35Å
110	P	97.4	Very high	92.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	118.3	178.6	29.7	-32.6	0	0	0	110.3	I82 E83 L87 A293 L294	I82-P110 CarbonylContact C-O 3.51Å; I82-P110 WeakPolarHBondContact CA-O 3.3Å; I82-P110 HydrophobicContact CG2-CG 4.33Å; E83-P110 HydrophobicContact CB-CB 4.3Å; E83-P110 HydrophobicContact CB-CG 4.46Å; E83-P110 PolarHBondContact N-O 2.71Å; L87-P110 HydrophobicContact CB-CG 3.67Å; L87-P110 HydrophobicContact CD1-CG 4.41Å; P110-A293 CarbonylContact C-O 3.52Å; P110-A293 WeakPolarHBondContact CA-O 3.32Å; P110-L294 HydrophobicContact CB-CD2 3.91Å; P110-L294 HydrophobicContact CG-CD2 4.49Å
111	L	97	Very high	92.4	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-71.4	138.5	174.9	-63.6	-177.3	0	0	0	111.2	F61 L63 L81 W109 T113 L126 S292 A293 V295	F61-L111 HydrophobicContact CD1-CD1 4.01Å; F61-L111 HydrophobicContact CE1-CD1 4.2Å; L63-L111 HydrophobicContact CD1-CD2 3.78Å; L63-L111 HydrophobicContact CD2-CD2 3.82Å; L63-L111 HydrophobicContact CG-CD2 3.93Å; L81-L111 WeakPolarHBondContact O-CA 3.49Å; W109-L111 PolarHBondContact O-N 3.01Å; L111-T113 WeakPolarHBondContact O-CG2 3.41Å; L111-T113 PolarHBondContact O-N 3.39Å; L111-L126 HydrophobicContact CB-CD1 4.42Å; L111-L126 HydrophobicContact CD1-CB 4.2Å; L111-S292 WeakPolarHBondContact O-CB 3.49Å; L111-S292 PolarHBondContact O-OG 2.83Å; L111-A293 HydrophobicContact CB-CB 4.36Å; L111-A293 HydrophobicContact CD1-CB 4.22Å; L111-A293 HydrophobicContact CG-CB 4.44Å; L111-A293 PolarHBondContact N-O 3.48Å; L111-V295 HydrophobicContact CD1-CG1 3.91Å; L111-V295 HydrophobicContact CD1-CG2 4.01Å; L111-V295 HydrophobicContact CD2-CG2 3.74Å; L111-V295 HydrophobicContact CG-CG1 4.28Å; L111-V295 HydrophobicContact CG-CG2 3.74Å
112	A	94.8	Very high	92.8	Very high	5 Å²	5	22.5 Å²	22.5	4%	0.041	13%	0.134	C	C	.	.	P	Polyproline II helix	trans	-63.6	129.4	171.8	0	0	0	0	0	110.2	L81	L81-A112 PolarHBondContact O-N 3.16Å
113	T	91.8	Very high	93.3	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.006	13%	0.126	C	C	.	.			trans	-121.3	157.6	177.5	85.2	0	0	0	0	111.9	L111 A123 L126 H290 F291	L111-T113 WeakPolarHBondContact O-CG2 3.41Å; L111-T113 PolarHBondContact O-N 3.39Å; T113-A123 HydrophobicContact CG2-CB 4.14Å; T113-L126 HydrophobicContact CG2-CD1 3.72Å; T113-H290 PolarHBondContact O-CE1 3.27Å; T113-H290 PolarHBondContact O-NE2 3.1Å; T113-H290 PolarHBondContact OG1-CE1 2.84Å; T113-H290 PolarHBondContact OG1-NE2 2.98Å; T113-F291 WeakPolarHBondContact CG2-O 3.35Å; T113-F291 PolarHBondContact OG1-O 2.67Å
114	K	88.9	Confident	93.9	Very high	67 Å²	67	20.6 Å²	20.6	29%	0.291	12%	0.124	S	C	.	.			trans	-70.5	130.5	175.3	-168.6	-180	173.4	-141.1	0	110.5	D116 H132 C220	K114-D116 HydrophobicContact CD-CB 4.39Å; K114-D116 WeakPolarHBondContact CD-OD2 3.31Å; K114-D116 WeakPolarHBondContact CE-OD2 3.46Å; K114-D116 HydrophobicContact CG-CB 4.32Å; K114-D116 IonicContact NZ-OD2 3.42Å; K114-D116 PolarHBondContact NZ-OD2 2.8Å; K114-D116 PolarHBondContact O-N 3.1Å; K114-H132 PolarHBondContact N-NE2 2.83Å; K114-H132 VanDerWaalsContact N-NE2 3.18Å; K114-C220 VanDerWaalsContact CE-SG 3.59Å; K114-C220 PolarHBondContact NZ-SG 3.12Å; K114-C220 VanDerWaalsContact NZ-SG 3.38Å
115	G	86.1	Confident	94.4	Very high	64 Å²	64	17.3 Å²	17.3	66%	0.66	10%	0.101	S	C	*	.			trans	-92	54.7	179.5	0	0	0	0	0	113.8
116	D	90.5	Very high	94.5	Very high	10 Å²	10	16.8 Å²	16.8	5%	0.053	10%	0.098	C	C	.	.	S	Bend	trans	-102.8	17.6	179.4	63	5.2	0	0	0	113.4	K114 N118 H122 Y223	K114-D116 HydrophobicContact CD-CB 4.39Å; K114-D116 WeakPolarHBondContact CD-OD2 3.31Å; K114-D116 WeakPolarHBondContact CE-OD2 3.46Å; K114-D116 HydrophobicContact CG-CB 4.32Å; K114-D116 IonicContact NZ-OD2 3.42Å; K114-D116 PolarHBondContact NZ-OD2 2.8Å; K114-D116 PolarHBondContact O-N 3.1Å; D116-N118 VanDerWaalsContact C-N 3.25Å; D116-N118 PolarHBondContact O-N 2.81Å; D116-N118 VanDerWaalsContact OD1-CB 3.28Å; D116-N118 WeakPolarHBondContact OD1-CB 3.4Å; D116-N118 PolarHBondContact OD1-N 3.45Å; D116-H122 IonicContact OD1-CD2 2.79Å; D116-H122 IonicContact OD1-NE2 2.78Å; D116-H122 PolarHBondContact OD1-NE2 2.83Å; D116-H122 IonicContact OD2-NE2 3.56Å; D116-H122 PolarHBondContact OD2-NE2 3.28Å; D116-Y223 PolarHBondContact O-N 3.44Å
117	G	90.9	Very high	94.7	Very high	14 Å²	14	15.8 Å²	15.8	14%	0.144	9%	0.093	C	C	.	.	S	Bend	trans	85.4	-13.6	-173.7	0	0	0	0	0	114	R139	G117-R139 PolarHBondContact O-NH2 3.02Å
118	N	95.5	Very high	94.6	Very high	0 Å²	0	11 Å²	11	0%	0	7%	0.072	C	C	.	.			trans	-93.4	12.5	175.6	-157.9	42.3	0	0	0	114	D116 L120 L121 H122 D133 R139 Y223	D116-N118 VanDerWaalsContact C-N 3.25Å; D116-N118 PolarHBondContact O-N 2.81Å; D116-N118 VanDerWaalsContact OD1-CB 3.28Å; D116-N118 WeakPolarHBondContact OD1-CB 3.4Å; D116-N118 PolarHBondContact OD1-N 3.45Å; N118-L120 VanDerWaalsContact C-N 3.3Å; N118-L120 PolarHBondContact O-N 3.25Å; N118-L120 VanDerWaalsContact O-N 3.14Å; N118-L121 PolarHBondContact O-N 3.39Å; N118-L121 WeakPolarHBondContact OD1-CD1 3.42Å; N118-H122 PolarHBondContact ND2-CE1 3.15Å; N118-H122 PolarHBondContact O-N 3.47Å; N118-D133 PolarHBondContact ND2-O 3.04Å; N118-D133 PolarHBondContact ND2-OD2 2.79Å; N118-R139 PolarHBondContact OD1-NE 2.74Å; N118-R139 PolarHBondContact OD1-NH2 3.11Å; N118-Y223 HydrophobicContact CB-CD2 4Å
119	C	96.6	Very high	94.3	Very high	11 Å²	11	13.5 Å²	13.5	7%	0.074	8%	0.082	C	C	.	.	H	α-helix	trans	-55.1	-35	-171.7	60.7	0	0	0	0	114.8	L121 H122 A123	C119-L121 VanDerWaalsContact C-N 3.34Å; C119-L121 PolarHBondContact O-N 3.19Å; C119-H122 PolarHBondContact O-N 3.24Å; C119-A123 VanDerWaalsContact O-CB 3.22Å; C119-A123 WeakPolarHBondContact O-CB 3.33Å; C119-A123 PolarHBondContact O-N 3.38Å
120	L	98	Very high	93.9	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.01	8%	0.076	C	C	.	.	H	α-helix	trans	-58	-46.6	174.9	174.5	61	0	0	0	111.8	N118 A123 A124 L226 H230 V231 L234 L284 F291	N118-L120 VanDerWaalsContact C-N 3.3Å; N118-L120 PolarHBondContact O-N 3.25Å; N118-L120 VanDerWaalsContact O-N 3.14Å; L120-A123 PolarHBondContact O-N 3.31Å; L120-A124 WeakPolarHBondContact O-CB 3.32Å; L120-A124 PolarHBondContact O-N 3.4Å; L120-L226 HydrophobicContact CB-CD1 4.29Å; L120-L226 HydrophobicContact CD2-CB 4.02Å; L120-L226 HydrophobicContact CD2-CD1 3.87Å; L120-H230 HydrophobicContact CD2-CB 4.41Å; L120-V231 HydrophobicContact CD1-CG2 4.08Å; L120-V231 HydrophobicContact CD2-CG2 3.87Å; L120-L234 HydrophobicContact CD1-CD2 4.31Å; L120-L234 HydrophobicContact CD2-CD2 4.46Å; L120-L234 HydrophobicContact CG-CD2 4.14Å; L120-L284 HydrophobicContact CD1-CD1 3.81Å; L120-F291 HydrophobicContact CB-CD2 3.7Å; L120-F291 HydrophobicContact CB-CE2 4.03Å; L120-F291 HydrophobicContact CB-CG 4.12Å; L120-F291 HydrophobicContact CD1-CD1 3.95Å; L120-F291 HydrophobicContact CD1-CD2 4.26Å; L120-F291 HydrophobicContact CD1-CE1 4.06Å; L120-F291 HydrophobicContact CD1-CE2 4.37Å; L120-F291 HydrophobicContact CD1-CG 4.05Å; L120-F291 HydrophobicContact CD1-CZ 4.26Å
121	L	97.8	Very high	93.5	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-80.9	-30.9	-175.1	-55.2	-174.2	0	0	0	111.3	N118 C119 S125 D133 L138 R139 L142 L226 L234	N118-L121 PolarHBondContact O-N 3.39Å; N118-L121 WeakPolarHBondContact OD1-CD1 3.42Å; C119-L121 VanDerWaalsContact C-N 3.34Å; C119-L121 PolarHBondContact O-N 3.19Å; L121-S125 WeakPolarHBondContact O-CB 3.47Å; L121-S125 PolarHBondContact O-N 2.86Å; L121-D133 HydrophobicContact CB-CB 4.22Å; L121-L138 HydrophobicContact CB-CB 4.15Å; L121-L138 HydrophobicContact CD1-CB 4.3Å; L121-L138 HydrophobicContact CD2-CB 4.24Å; L121-L138 HydrophobicContact CG-CB 4.48Å; L121-R139 HydrophobicContact CD1-CB 3.42Å; L121-R139 VanDerWaalsContact CD1-CB 3.42Å; L121-R139 HydrophobicContact CD1-CG 3.98Å; L121-L142 HydrophobicContact CD1-CD2 4.48Å; L121-L226 HydrophobicContact CD1-CD1 4.06Å; L121-L226 HydrophobicContact CD2-CD1 4.32Å; L121-L226 HydrophobicContact CG-CD1 3.97Å; L121-L234 HydrophobicContact CD2-CD1 3.8Å; L121-L234 HydrophobicContact CD2-CD2 3.72Å; L121-L234 HydrophobicContact CD2-CG 4.32Å
122	H	96.6	Very high	93.3	Very high	3 Å²	3	15.3 Å²	15.3	1%	0.014	9%	0.092	C	C	.	.	H	α-helix	trans	-60	-49	165.1	-68.5	-28.2	0	0	0	112.2	D116 N118 C119 A124 S125 L126 H132 D133	D116-H122 IonicContact OD1-CD2 2.79Å; D116-H122 IonicContact OD1-NE2 2.78Å; D116-H122 PolarHBondContact OD1-NE2 2.83Å; D116-H122 IonicContact OD2-NE2 3.56Å; D116-H122 PolarHBondContact OD2-NE2 3.28Å; N118-H122 PolarHBondContact ND2-CE1 3.15Å; N118-H122 PolarHBondContact O-N 3.47Å; C119-H122 PolarHBondContact O-N 3.24Å; H122-A124 PolarHBondContact O-N 3.34Å; H122-S125 PolarHBondContact O-N 2.77Å; H122-L126 WeakPolarHBondContact O-CB 3.36Å; H122-L126 VanDerWaalsContact O-CG 3.28Å; H122-L126 WeakPolarHBondContact O-CG 3.4Å; H122-L126 PolarHBondContact O-N 3.07Å; H122-H132 AromaticContact CD2-CD2 3.78Å; H122-H132 AromaticContact CG-CD2 3.49Å; H122-H132 VanDerWaalsContact CG-CD2 3.49Å; H122-H132 AromaticContact ND1-CD2 3.86Å; H122-D133 PolarHBondContact CE1-O 3.08Å; H122-D133 PolarHBondContact ND1-N 2.95Å; H122-D133 VanDerWaalsContact ND1-N 3.18Å
123	A	97.9	Very high	93.2	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.9	-45.1	177.7	0	0	0	0	0	111.4	T113 C119 L120 S125 L126 G127 L284 F291 A293	T113-A123 HydrophobicContact CG2-CB 4.14Å; C119-A123 VanDerWaalsContact O-CB 3.22Å; C119-A123 WeakPolarHBondContact O-CB 3.33Å; C119-A123 PolarHBondContact O-N 3.38Å; L120-A123 PolarHBondContact O-N 3.31Å; A123-S125 PolarHBondContact O-N 3.15Å; A123-L126 PolarHBondContact O-N 3.14Å; A123-G127 PolarHBondContact O-N 3.15Å; A123-L284 HydrophobicContact CB-CD2 3.96Å; A123-F291 HydrophobicContact CB-CB 4.08Å; A123-A293 VanDerWaalsContact O-CB 3.3Å; A123-A293 WeakPolarHBondContact O-CB 3.29Å
124	A	97.5	Very high	93.2	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61.8	-46	176.5	0	0	0	0	0	112.6	L120 H122 G127 M128 L138 L234 L282	L120-A124 WeakPolarHBondContact O-CB 3.32Å; L120-A124 PolarHBondContact O-N 3.4Å; H122-A124 PolarHBondContact O-N 3.34Å; A124-G127 PolarHBondContact O-N 3.36Å; A124-M128 HydrophobicContact CB-CE 4.48Å; A124-M128 VanDerWaalsContact O-CE 3.31Å; A124-M128 WeakPolarHBondContact O-CE 3.29Å; A124-M128 WeakPolarHBondContact O-CG 3.43Å; A124-M128 PolarHBondContact O-N 2.88Å; A124-L138 HydrophobicContact CB-CD1 4.13Å; A124-L234 HydrophobicContact CB-CD2 3.84Å; A124-L282 HydrophobicContact CB-CD2 3.65Å
125	S	94.8	Very high	93.2	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.014	12%	0.115	C	C	.	.	H	α-helix	trans	-63	-42.2	177.6	-175.1	0	0	0	0	112	L121 H122 A123 M128 W129 G130 F131	L121-S125 WeakPolarHBondContact O-CB 3.47Å; L121-S125 PolarHBondContact O-N 2.86Å; H122-S125 PolarHBondContact O-N 2.77Å; A123-S125 PolarHBondContact O-N 3.15Å; S125-M128 PolarHBondContact O-N 3.35Å; S125-W129 PolarHBondContact O-N 3.3Å; S125-G130 PolarHBondContact O-N 3.49Å; S125-F131 CarbonylContact C-O 3.53Å; S125-F131 WeakPolarHBondContact CB-O 3.48Å; S125-F131 PolarHBondContact OG-O 3.46Å
126	L	93.5	Very high	93.5	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-63	-45.5	175.3	-76.7	172.4	0	0	0	111.6	F61 L111 T113 H122 A123 M128 G130 F131 A293	F61-L126 VanDerWaalsContact CB-O 3.3Å; F61-L126 WeakPolarHBondContact CB-O 3.47Å; L111-L126 HydrophobicContact CB-CD1 4.42Å; L111-L126 HydrophobicContact CD1-CB 4.2Å; T113-L126 HydrophobicContact CG2-CD1 3.72Å; H122-L126 WeakPolarHBondContact O-CB 3.36Å; H122-L126 VanDerWaalsContact O-CG 3.28Å; H122-L126 WeakPolarHBondContact O-CG 3.4Å; H122-L126 PolarHBondContact O-N 3.07Å; A123-L126 PolarHBondContact O-N 3.14Å; L126-M128 PolarHBondContact O-N 3.01Å; L126-G130 VanDerWaalsContact O-CA 3.28Å; L126-G130 WeakPolarHBondContact O-CA 3.24Å; L126-G130 PolarHBondContact O-N 2.91Å; L126-F131 PolarHBondContact N-O 2.55Å; L126-F131 VanDerWaalsContact N-O 3.12Å; L126-A293 HydrophobicContact CB-CB 4.25Å
127	G	94.2	Very high	93.7	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-65.2	-24	-178.9	0	0	0	0	0	113.9	T60 F61 A123 A124	T60-G127 WeakPolarHBondContact CA-O 3.46Å; T60-G127 VanDerWaalsContact CG2-O 3.27Å; T60-G127 WeakPolarHBondContact CG2-O 3.28Å; F61-G127 PolarHBondContact N-O 3.11Å; A123-G127 PolarHBondContact O-N 3.15Å; A124-G127 PolarHBondContact O-N 3.36Å
128	M	92.8	Very high	93.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-96.5	-45.4	177.3	-66.3	-176.6	-68.9	0	0	113.1	T56 P57 Y59 A124 S125 L126 L138 L238 L282	T56-M128 HydrophobicContact CG2-CE 4.36Å; T56-M128 HydrophobicContact CG2-SD 3.68Å; P57-M128 HydrophobicContact CG-CB 4.03Å; Y59-M128 WeakPolarHBondContact CE2-O 3.3Å; A124-M128 HydrophobicContact CB-CE 4.48Å; A124-M128 VanDerWaalsContact O-CE 3.31Å; A124-M128 WeakPolarHBondContact O-CE 3.29Å; A124-M128 WeakPolarHBondContact O-CG 3.43Å; A124-M128 PolarHBondContact O-N 2.88Å; S125-M128 PolarHBondContact O-N 3.35Å; L126-M128 PolarHBondContact O-N 3.01Å; M128-L138 HydrophobicContact CE-CD1 4.24Å; M128-L238 HydrophobicContact CE-CD1 3.98Å; M128-L238 HydrophobicContact CE-CD2 3.62Å; M128-L238 HydrophobicContact CE-CG 4.44Å; M128-L238 HydrophobicContact SD-CD1 4.06Å; M128-L238 HydrophobicContact SD-CD2 4.01Å; M128-L282 HydrophobicContact CG-CD1 4.34Å
129	W	89.9	Confident	94	Very high	54 Å²	54	20.8 Å²	20.8	21%	0.205	9%	0.093	C	C	.	.	H	α-helix	trans	-121.9	-11.2	-167.9	-56.1	-65.8	0	0	0	114.7	V54 T56 S125 F131 L138 M498	V54-W129 HydrophobicContact CG1-CH2 3.95Å; V54-W129 HydrophobicContact CG1-CZ2 4.22Å; T56-W129 HydrophobicContact CG2-CH2 4.45Å; T56-W129 HydrophobicContact CG2-CZ2 4.16Å; S125-W129 PolarHBondContact O-N 3.3Å; W129-F131 HydrophobicContact CB-CD1 3.7Å; W129-F131 HydrophobicContact CB-CE1 3.25Å; W129-F131 HydrophobicContact CB-CE2 4.31Å; W129-F131 HydrophobicContact CB-CG 4.43Å; W129-F131 HydrophobicContact CB-CZ 3.58Å; W129-F131 HydrophobicContact CD2-CZ 4.04Å; W129-F131 HydrophobicContact CE3-CE2 4.14Å; W129-F131 HydrophobicContact CE3-CZ 4.09Å; W129-F131 AromaticContact CG-CE1 3.95Å; W129-F131 HydrophobicContact CG-CE1 3.95Å; W129-F131 AromaticContact CG-CZ 3.86Å; W129-F131 HydrophobicContact CG-CZ 3.86Å; W129-L138 HydrophobicContact CH2-CD2 4.08Å; W129-L138 HydrophobicContact CZ3-CD1 4.14Å; W129-L138 HydrophobicContact CZ3-CD2 4.23Å; W129-L138 HydrophobicContact CZ3-CG 4.31Å; W129-M498 WeakPolarHBondContact O-CE 3.19Å
130	G	90.4	Very high	93.9	Very high	5 Å²	5	23.9 Å²	23.9	5%	0.052	11%	0.106	C	C	.	.	S	Bend	trans	79.7	10.2	-178.9	0	0	0	0	0	115.5	S125 L126	S125-G130 PolarHBondContact O-N 3.49Å; L126-G130 VanDerWaalsContact O-CA 3.28Å; L126-G130 WeakPolarHBondContact O-CA 3.24Å; L126-G130 PolarHBondContact O-N 2.91Å
131	F	89	Confident	93.8	Very high	75 Å²	75	24 Å²	24	33%	0.329	11%	0.107	S	C	.	.	S	Bend	trans	-129.6	161	171.9	58.3	-100.8	0	0	0	112.7	S125 L126 W129	S125-F131 CarbonylContact C-O 3.53Å; S125-F131 WeakPolarHBondContact CB-O 3.48Å; S125-F131 PolarHBondContact OG-O 3.46Å; L126-F131 PolarHBondContact N-O 2.55Å; L126-F131 VanDerWaalsContact N-O 3.12Å; W129-F131 HydrophobicContact CB-CD1 3.7Å; W129-F131 HydrophobicContact CB-CE1 3.25Å; W129-F131 HydrophobicContact CB-CE2 4.31Å; W129-F131 HydrophobicContact CB-CG 4.43Å; W129-F131 HydrophobicContact CB-CZ 3.58Å; W129-F131 HydrophobicContact CD2-CZ 4.04Å; W129-F131 HydrophobicContact CE3-CE2 4.14Å; W129-F131 HydrophobicContact CE3-CZ 4.09Å; W129-F131 AromaticContact CG-CE1 3.95Å; W129-F131 HydrophobicContact CG-CE1 3.95Å; W129-F131 AromaticContact CG-CZ 3.86Å; W129-F131 HydrophobicContact CG-CZ 3.86Å
132	H	91.9	Very high	93.8	Very high	7 Å²	7	24 Å²	24	3%	0.032	11%	0.107	C	C	.	.			trans	-78.1	146.8	179.5	-73.6	70.7	0	0	0	112.1	K114 H122 R134	K114-H132 PolarHBondContact N-NE2 2.83Å; K114-H132 VanDerWaalsContact N-NE2 3.18Å; H122-H132 AromaticContact CD2-CD2 3.78Å; H122-H132 AromaticContact CG-CD2 3.49Å; H122-H132 VanDerWaalsContact CG-CD2 3.49Å; H122-H132 AromaticContact ND1-CD2 3.86Å; H132-R134 HydrophobicContact CB-CG 4.03Å; H132-R134 PolarHBondContact O-N 2.91Å
133	D	93.7	Very high	93.8	Very high	6 Å²	6	25.6 Å²	25.6	3%	0.032	11%	0.114	C	C	.	.			trans	-67.7	66.3	170.1	-175.9	43.5	0	0	0	113.2	N118 L121 H122 L136 I137 L138 R139	N118-D133 PolarHBondContact ND2-O 3.04Å; N118-D133 PolarHBondContact ND2-OD2 2.79Å; L121-D133 HydrophobicContact CB-CB 4.22Å; H122-D133 PolarHBondContact CE1-O 3.08Å; H122-D133 PolarHBondContact ND1-N 2.95Å; H122-D133 VanDerWaalsContact ND1-N 3.18Å; D133-L136 WeakPolarHBondContact OD2-CA 3.33Å; D133-I137 PolarHBondContact OD1-N 2.98Å; D133-L138 PolarHBondContact OD1-N 3.21Å; D133-L138 VanDerWaalsContact OD1-N 3.08Å; D133-L138 PolarHBondContact OD2-N 3.26Å; D133-R139 PolarHBondContact OD2-N 2.89Å
134	R	89.9	Confident	93.7	Very high	99 Å²	99	27.1 Å²	27.1	37%	0.374	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-33	-176.8	-63.9	-166.2	-167.8	143.6	34.8	113.9	H132 L136 S527 S531	H132-R134 HydrophobicContact CB-CG 4.03Å; H132-R134 PolarHBondContact O-N 2.91Å; R134-L136 PolarHBondContact O-N 2.8Å; R134-S527 PolarHBondContact NH1-O 3.49Å; R134-S527 PolarHBondContact NH2-O 2.82Å; R134-S531 PolarHBondContact NH1-OG 2.73Å
135	F	89.8	Confident	93.6	Very high	94 Å²	94	27.3 Å²	27.3	41%	0.412	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	3	177.5	-62	-66.9	0	0	0	112.9	I137 K140 E551	F135-I137 HydrophobicContact CB-CD1 4.15Å; F135-I137 HydrophobicContact CB-CG1 3.94Å; F135-I137 PolarHBondContact O-N 3.2Å; F135-K140 PolarHBondContact O-NZ 3.24Å; F135-K140 VanDerWaalsContact O-NZ 3.15Å; F135-E551 WeakPolarHBondContact CZ-O 3.19Å
136	L	93.4	Very high	93.7	Very high	17 Å²	17	27.3 Å²	27.3	9%	0.089	12%	0.123	C	C	.	.			trans	58.1	31.9	-179.5	-53	-179.3	0	0	0	112.2	D133 R134 R139 K140 P192 Y223	D133-L136 WeakPolarHBondContact OD2-CA 3.33Å; R134-L136 PolarHBondContact O-N 2.8Å; L136-R139 HydrophobicContact CB-CB 4.07Å; L136-R139 HydrophobicContact CD2-CB 4.48Å; L136-R139 PolarHBondContact O-N 3.19Å; L136-K140 VanDerWaalsContact O-CB 3.24Å; L136-K140 WeakPolarHBondContact O-CB 3.24Å; L136-K140 WeakPolarHBondContact O-CD 3.41Å; L136-K140 WeakPolarHBondContact O-CG 3.35Å; L136-K140 PolarHBondContact O-N 3.36Å; L136-P192 HydrophobicContact CB-CB 4.46Å; L136-P192 HydrophobicContact CD1-CB 3.94Å; L136-Y223 HydrophobicContact CD1-CE1 3.56Å; L136-Y223 WeakPolarHBondContact CD1-OH 2.95Å; L136-Y223 HydrophobicContact CD2-CE1 4.1Å; L136-Y223 HydrophobicContact CD2-CE2 4.09Å; L136-Y223 HydrophobicContact CG-CE1 4.46Å
137	I	93.3	Very high	93.8	Very high	59 Å²	59	29.3 Å²	29.3	30%	0.303	14%	0.135	S	C	.	.	H	α-helix	trans	-63.8	-50.7	-178.1	-65	170.4	0	0	0	108.7	D133 F135 R139 K140 A141	D133-I137 PolarHBondContact OD1-N 2.98Å; F135-I137 HydrophobicContact CB-CD1 4.15Å; F135-I137 HydrophobicContact CB-CG1 3.94Å; F135-I137 PolarHBondContact O-N 3.2Å; I137-R139 VanDerWaalsContact C-N 3.32Å; I137-R139 PolarHBondContact O-N 3.33Å; I137-K140 PolarHBondContact O-N 3.04Å; I137-A141 WeakPolarHBondContact O-CB 3.39Å; I137-A141 PolarHBondContact O-N 2.73Å
138	L	96.1	Very high	93.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.5	-38.6	177.5	-65.6	-176.5	0	0	0	110.8	V54 L121 A124 M128 W129 D133 A141 L142 L238	V54-L138 HydrophobicContact CG1-CD2 4.39Å; V54-L138 HydrophobicContact CG2-CD2 4.4Å; L121-L138 HydrophobicContact CB-CB 4.15Å; L121-L138 HydrophobicContact CD1-CB 4.3Å; L121-L138 HydrophobicContact CD2-CB 4.24Å; L121-L138 HydrophobicContact CG-CB 4.48Å; A124-L138 HydrophobicContact CB-CD1 4.13Å; M128-L138 HydrophobicContact CE-CD1 4.24Å; W129-L138 HydrophobicContact CH2-CD2 4.08Å; W129-L138 HydrophobicContact CZ3-CD1 4.14Å; W129-L138 HydrophobicContact CZ3-CD2 4.23Å; W129-L138 HydrophobicContact CZ3-CG 4.31Å; D133-L138 PolarHBondContact OD1-N 3.21Å; D133-L138 VanDerWaalsContact OD1-N 3.08Å; D133-L138 PolarHBondContact OD2-N 3.26Å; L138-A141 PolarHBondContact O-N 3.26Å; L138-L142 VanDerWaalsContact O-CB 3.27Å; L138-L142 WeakPolarHBondContact O-CB 3.4Å; L138-L142 PolarHBondContact O-N 2.84Å; L138-L238 HydrophobicContact CD2-CD2 3.83Å
139	R	96.5	Very high	93.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65.1	-44.3	179.8	-171.6	166.4	-93.1	-94.3	4.6	112	G117 N118 L121 D133 L136 I137 L142 H143 I189 A190 S191 P192 E224	G117-R139 PolarHBondContact O-NH2 3.02Å; N118-R139 PolarHBondContact OD1-NE 2.74Å; N118-R139 PolarHBondContact OD1-NH2 3.11Å; L121-R139 HydrophobicContact CD1-CB 3.42Å; L121-R139 VanDerWaalsContact CD1-CB 3.42Å; L121-R139 HydrophobicContact CD1-CG 3.98Å; D133-R139 PolarHBondContact OD2-N 2.89Å; L136-R139 HydrophobicContact CB-CB 4.07Å; L136-R139 HydrophobicContact CD2-CB 4.48Å; L136-R139 PolarHBondContact O-N 3.19Å; I137-R139 VanDerWaalsContact C-N 3.32Å; I137-R139 PolarHBondContact O-N 3.33Å; R139-L142 PolarHBondContact O-N 2.75Å; R139-H143 WeakPolarHBondContact O-CB 3.42Å; R139-H143 PolarHBondContact O-N 3.48Å; R139-I189 PolarHBondContact NH1-O 3.45Å; R139-A190 WeakPolarHBondContact CG-O 3.46Å; R139-S191 PolarHBondContact NH1-O 3.12Å; R139-P192 HydrophobicContact CG-CB 4.26Å; R139-E224 PolarHBondContact NH2-O 3.44Å
140	K	95.9	Very high	93.6	Very high	77 Å²	77	36.3 Å²	36.3	34%	0.335	18%	0.184	S	C	.	.	H	α-helix	trans	-62	-46.1	175.3	-73.1	164.5	-177.8	166.6	0	110.9	F135 L136 I137 H143 L144 P192	F135-K140 PolarHBondContact O-NZ 3.24Å; F135-K140 VanDerWaalsContact O-NZ 3.15Å; L136-K140 VanDerWaalsContact O-CB 3.24Å; L136-K140 WeakPolarHBondContact O-CB 3.24Å; L136-K140 WeakPolarHBondContact O-CD 3.41Å; L136-K140 WeakPolarHBondContact O-CG 3.35Å; L136-K140 PolarHBondContact O-N 3.36Å; I137-K140 PolarHBondContact O-N 3.04Å; K140-H143 PolarHBondContact O-N 3.34Å; K140-L144 WeakPolarHBondContact O-CB 3.29Å; K140-L144 VanDerWaalsContact O-CG 3.24Å; K140-L144 WeakPolarHBondContact O-CG 3.34Å; K140-L144 PolarHBondContact O-N 3.29Å; K140-P192 HydrophobicContact CG-CB 3.95Å; K140-P192 HydrophobicContact CG-CG 4.01Å
141	A	95.8	Very high	93.6	Very high	5 Å²	5	39 Å²	39	4%	0.041	19%	0.193	C	C	.	.	H	α-helix	trans	-62.5	-44	179.1	0	0	0	0	0	112.3	V54 I137 L138 L144 L145 V237	V54-A141 HydrophobicContact CG2-CB 3.84Å; I137-A141 WeakPolarHBondContact O-CB 3.39Å; I137-A141 PolarHBondContact O-N 2.73Å; L138-A141 PolarHBondContact O-N 3.26Å; A141-L144 PolarHBondContact O-N 2.84Å; A141-L145 PolarHBondContact O-N 2.87Å; A141-V237 HydrophobicContact CB-CG1 3.7Å
142	L	97	Very high	93.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-57.9	-51.4	174.3	-177.7	85	0	0	0	111.7	L121 L138 R139 L144 L145 L146 A190 L226 H230 A233 L234	L121-L142 HydrophobicContact CD1-CD2 4.48Å; L138-L142 VanDerWaalsContact O-CB 3.27Å; L138-L142 WeakPolarHBondContact O-CB 3.4Å; L138-L142 PolarHBondContact O-N 2.84Å; R139-L142 PolarHBondContact O-N 2.75Å; L142-L144 VanDerWaalsContact C-N 3.34Å; L142-L144 PolarHBondContact O-N 3.48Å; L142-L145 WeakPolarHBondContact O-CB 3.31Å; L142-L145 PolarHBondContact O-N 3.46Å; L142-L146 PolarHBondContact O-N 3.49Å; L142-A190 HydrophobicContact CD2-CB 4.2Å; L142-L226 HydrophobicContact CD2-CD1 3.92Å; L142-L226 HydrophobicContact CD2-CD2 4.44Å; L142-H230 HydrophobicContact CD1-CB 4.45Å; L142-H230 VanDerWaalsContact CD1-O 3.26Å; L142-H230 WeakPolarHBondContact CD1-O 3.46Å; L142-H230 HydrophobicContact CD2-CB 4.08Å; L142-A233 HydrophobicContact CD1-CB 3.67Å; L142-L234 HydrophobicContact CD1-CB 3.99Å
143	H	97.1	Very high	94	Very high	36 Å²	36	44.1 Å²	44.1	17%	0.167	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-38.8	179.5	-174.4	66.1	0	0	0	112.1	R139 K140 L146 T147 V187 A190 S191	R139-H143 WeakPolarHBondContact O-CB 3.42Å; R139-H143 PolarHBondContact O-N 3.48Å; K140-H143 PolarHBondContact O-N 3.34Å; H143-L146 PolarHBondContact O-N 3.14Å; H143-T147 WeakPolarHBondContact O-CB 3.26Å; H143-T147 WeakPolarHBondContact O-CG2 3.41Å; H143-T147 PolarHBondContact O-N 3.35Å; H143-T147 PolarHBondContact O-OG1 2.63Å; H143-V187 PolarHBondContact CE1-O 2.98Å; H143-V187 VanDerWaalsContact CE1-O 3.25Å; H143-V187 PolarHBondContact ND1-O 2.93Å; H143-A190 HydrophobicContact CB-CB 4.28Å; H143-S191 PolarHBondContact ND1-N 3.21Å
144	L	96.1	Very high	94.1	Very high	32 Å²	32	44.1 Å²	44.1	17%	0.168	22%	0.215	C	C	.	.	H	α-helix	trans	-63.5	-39.9	175	-77	171.3	0	0	0	112.2	K140 A141 L142 L146 T147 K148 G149	K140-L144 WeakPolarHBondContact O-CB 3.29Å; K140-L144 VanDerWaalsContact O-CG 3.24Å; K140-L144 WeakPolarHBondContact O-CG 3.34Å; K140-L144 PolarHBondContact O-N 3.29Å; A141-L144 PolarHBondContact O-N 2.84Å; L142-L144 VanDerWaalsContact C-N 3.34Å; L142-L144 PolarHBondContact O-N 3.48Å; L144-L146 VanDerWaalsContact C-N 3.34Å; L144-L146 PolarHBondContact O-N 3.04Å; L144-T147 WeakPolarHBondContact CA-OG1 3.34Å; L144-T147 PolarHBondContact O-N 2.71Å; L144-T147 PolarHBondContact O-OG1 3.33Å; L144-K148 HydrophobicContact CD2-CD 4.34Å; L144-K148 PolarHBondContact O-N 3.13Å; L144-G149 PolarHBondContact O-N 3.33Å
145	L	95.5	Very high	94.5	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-59.3	-45.7	175.2	178.2	62.4	0	0	0	111.3	C52 A141 L142 G149 R151 L155 A233 H236 V237	C52-L145 VanDerWaalsContact SG-CB 3.53Å; C52-L145 VanDerWaalsContact SG-CD1 3.56Å; A141-L145 PolarHBondContact O-N 2.87Å; L142-L145 WeakPolarHBondContact O-CB 3.31Å; L142-L145 PolarHBondContact O-N 3.46Å; L145-G149 VanDerWaalsContact O-CA 3.26Å; L145-G149 WeakPolarHBondContact O-CA 3.33Å; L145-G149 PolarHBondContact O-N 3.3Å; L145-G149 VanDerWaalsContact O-N 3.1Å; L145-R151 HydrophobicContact CD1-CB 4.48Å; L145-L155 HydrophobicContact CD1-CD1 4.5Å; L145-L155 HydrophobicContact CD2-CD1 4.02Å; L145-L155 HydrophobicContact CG-CD1 4.02Å; L145-A233 HydrophobicContact CD2-CB 4.07Å; L145-A233 VanDerWaalsContact CD2-O 3.27Å; L145-A233 WeakPolarHBondContact CD2-O 3.11Å; L145-H236 HydrophobicContact CD2-CB 3.83Å; L145-V237 HydrophobicContact CB-CG2 4.24Å; L145-V237 HydrophobicContact CD2-CG2 3.79Å
146	L	96.4	Very high	94.9	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-73.9	-33.4	-177.3	-67.3	176.4	0	0	0	113.1	L142 H143 L144 L155 W183 V187 A190 A233	L142-L146 PolarHBondContact O-N 3.49Å; H143-L146 PolarHBondContact O-N 3.14Å; L144-L146 VanDerWaalsContact C-N 3.34Å; L144-L146 PolarHBondContact O-N 3.04Å; L146-L155 HydrophobicContact CD2-CD1 4.01Å; L146-W183 HydrophobicContact CD2-CH2 4.18Å; L146-V187 HydrophobicContact CB-CG2 4.29Å; L146-A190 HydrophobicContact CD1-CB 3.95Å; L146-A233 HydrophobicContact CD2-CB 3.95Å; L146-A233 HydrophobicContact CG-CB 4.27Å
147	T	95.6	Very high	95	Very high	42 Å²	42	38.8 Å²	38.8	26%	0.258	19%	0.191	S	C	.	.	H	α-helix	trans	-84.7	-48.9	-179.1	51.9	0	0	0	0	113.4	H143 L144 V187	H143-T147 WeakPolarHBondContact O-CB 3.26Å; H143-T147 WeakPolarHBondContact O-CG2 3.41Å; H143-T147 PolarHBondContact O-N 3.35Å; H143-T147 PolarHBondContact O-OG1 2.63Å; L144-T147 WeakPolarHBondContact CA-OG1 3.34Å; L144-T147 PolarHBondContact O-N 2.71Å; L144-T147 PolarHBondContact O-OG1 3.33Å; T147-V187 HydrophobicContact CG2-CG1 3.44Å; T147-V187 VanDerWaalsContact CG2-CG1 3.44Å
148	K	92.5	Very high	95.2	Very high	74 Å²	74	37 Å²	37	32%	0.322	18%	0.18	S	C	.	.	H	α-helix	trans	-124	-7.2	-168	-61.3	-179	-172.3	177.1	0	113.8	L144 F570 S574	L144-K148 HydrophobicContact CD2-CD 4.34Å; L144-K148 PolarHBondContact O-N 3.13Å; K148-F570 PolarHBondContact NZ-O 3.42Å; K148-F570 VanDerWaalsContact NZ-O 3.15Å; K148-S574 PolarHBondContact NZ-OG 3.47Å
149	G	89.7	Confident	95.3	Very high	10 Å²	10	37.3 Å²	37.3	10%	0.103	18%	0.182	C	C	.	.			trans	-65.6	144.3	-177.4	0	0	0	0	0	113.3	L144 L145 R151 R152	L144-G149 PolarHBondContact O-N 3.33Å; L145-G149 VanDerWaalsContact O-CA 3.26Å; L145-G149 WeakPolarHBondContact O-CA 3.33Å; L145-G149 PolarHBondContact O-N 3.3Å; L145-G149 VanDerWaalsContact O-N 3.1Å; G149-R151 PolarHBondContact O-N 3.45Å; G149-R152 WeakPolarHBondContact O-CB 3.11Å; G149-R152 WeakPolarHBondContact O-CD 3.17Å; G149-R152 VanDerWaalsContact O-CG 3.23Å; G149-R152 WeakPolarHBondContact O-CG 3.47Å; G149-R152 PolarHBondContact O-N 3.04Å
150	S	90.1	Very high	95.4	Very high	118 Å²	118	37.7 Å²	37.7	83%	0.825	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-28.1	178.2	54.3	0	0	0	0	113.2
151	R	91.6	Very high	95.4	Very high	62 Å²	62	35.1 Å²	35.1	23%	0.234	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-6.3	-178.9	-64.6	167.2	174.8	151.1	0	114.3	L145 G149 H153 A154 L155 E271 C272	L145-R151 HydrophobicContact CD1-CB 4.48Å; G149-R151 PolarHBondContact O-N 3.45Å; R151-H153 PolarHBondContact O-N 2.84Å; R151-H153 VanDerWaalsContact O-N 3.08Å; R151-A154 PolarHBondContact O-N 3.15Å; R151-L155 PolarHBondContact O-N 3.42Å; R151-L155 VanDerWaalsContact O-N 3.08Å; R151-E271 HydrophobicContact CB-CB 4.25Å; R151-E271 HydrophobicContact CG-CB 3.91Å; R151-E271 VanDerWaalsContact CZ-O 3.31Å; R151-E271 PolarHBondContact NE-O 3.22Å; R151-E271 PolarHBondContact NH2-O 3.19Å; R151-C272 PolarHBondContact NH1-SG 2.93Å; R151-C272 PolarHBondContact NH2-SG 3.45Å; R151-C272 VanDerWaalsContact NH2-SG 3.41Å
152	R	94.1	Very high	95.4	Very high	90 Å²	90	36.4 Å²	36.4	34%	0.34	18%	0.176	S	C	.	.	H	α-helix	trans	-53.9	-35.7	-172.9	73.8	-170.6	-176.6	109.5	4	113.8	G149 L155 W156	G149-R152 WeakPolarHBondContact O-CB 3.11Å; G149-R152 WeakPolarHBondContact O-CD 3.17Å; G149-R152 VanDerWaalsContact O-CG 3.23Å; G149-R152 WeakPolarHBondContact O-CG 3.47Å; G149-R152 PolarHBondContact O-N 3.04Å; R152-L155 PolarHBondContact O-N 3.07Å; R152-W156 WeakPolarHBondContact O-CB 3.41Å; R152-W156 PolarHBondContact O-N 3.4Å
153	H	95	Very high	95.3	Very high	99 Å²	99	38.5 Å²	38.5	46%	0.458	19%	0.186	S	C	.	.	H	α-helix	trans	-70.9	-35.7	-179.9	-66.8	-67.7	0	0	0	112.5	R151 R157	R151-H153 PolarHBondContact O-N 2.84Å; R151-H153 VanDerWaalsContact O-N 3.08Å; H153-R157 WeakPolarHBondContact O-CG 3.13Å; H153-R157 PolarHBondContact O-N 3.46Å
154	A	95.9	Very high	95.2	Very high	7 Å²	7	38.7 Å²	38.7	6%	0.058	19%	0.19	C	C	.	.	H	α-helix	trans	-70.7	-41.5	174.2	0	0	0	0	0	111	R151 W156 R157 R158 E271	R151-A154 PolarHBondContact O-N 3.15Å; A154-W156 VanDerWaalsContact C-N 3.3Å; A154-W156 PolarHBondContact O-N 3.24Å; A154-R157 PolarHBondContact O-N 2.91Å; A154-R158 WeakPolarHBondContact O-CG 3.31Å; A154-R158 PolarHBondContact O-N 3.04Å; A154-E271 HydrophobicContact CB-CG 3.95Å; A154-E271 WeakPolarHBondContact CB-OE2 3.42Å
155	L	97	Very high	95	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-57.5	-43.7	172.6	-60.5	-179.8	0	0	0	111.5	L145 L146 R151 R152 R158 W159 W183 F232 A233 E271	L145-L155 HydrophobicContact CD1-CD1 4.5Å; L145-L155 HydrophobicContact CD2-CD1 4.02Å; L145-L155 HydrophobicContact CG-CD1 4.02Å; L146-L155 HydrophobicContact CD2-CD1 4.01Å; R151-L155 PolarHBondContact O-N 3.42Å; R151-L155 VanDerWaalsContact O-N 3.08Å; R152-L155 PolarHBondContact O-N 3.07Å; L155-R158 PolarHBondContact O-N 3.35Å; L155-W159 WeakPolarHBondContact O-CB 3.29Å; L155-W159 PolarHBondContact O-N 3.14Å; L155-W183 HydrophobicContact CB-CH2 4.37Å; L155-F232 HydrophobicContact CD2-CD1 3.65Å; L155-F232 HydrophobicContact CD2-CE1 3.41Å; L155-F232 VanDerWaalsContact CD2-CE1 3.41Å; L155-F232 HydrophobicContact CD2-CZ 4.46Å; L155-A233 HydrophobicContact CD1-CB 4.34Å; L155-E271 HydrophobicContact CD2-CG 4.43Å
156	W	97.6	Very high	94.8	Very high	59 Å²	59	43.7 Å²	43.7	22%	0.223	21%	0.212	C	C	.	.	H	α-helix	trans	-60.1	-46.2	174.4	174.8	81.4	0	0	0	112.7	R152 A154 W159 R160 W183 W334	R152-W156 WeakPolarHBondContact O-CB 3.41Å; R152-W156 PolarHBondContact O-N 3.4Å; A154-W156 VanDerWaalsContact C-N 3.3Å; A154-W156 PolarHBondContact O-N 3.24Å; W156-W159 PolarHBondContact O-N 3.48Å; W156-R160 VanDerWaalsContact CH2-NH1 3.33Å; W156-R160 VanDerWaalsContact CZ2-CD 3.49Å; W156-R160 VanDerWaalsContact O-CB 3.3Å; W156-R160 WeakPolarHBondContact O-CB 3.39Å; W156-R160 PolarHBondContact O-N 3.05Å; W156-W183 HydrophobicContact CB-CD2 4.34Å; W156-W183 HydrophobicContact CB-CE3 4.18Å; W156-W183 HydrophobicContact CB-CH2 3.74Å; W156-W183 HydrophobicContact CB-CZ2 3.93Å; W156-W183 HydrophobicContact CB-CZ3 3.86Å; W156-W183 AromaticContact CD1-CD2 3.42Å; W156-W183 VanDerWaalsContact CD1-CD2 3.42Å; W156-W183 AromaticContact CD1-CE2 3.93Å; W156-W183 AromaticContact CD1-CE3 3.54Å; W156-W183 AromaticContact CD1-CG 3.62Å; W156-W183 HydrophobicContact CG-CD2 4.26Å; W156-W183 HydrophobicContact CG-CE3 4.26Å; W156-W183 HydrophobicContact CG-CZ3 4.41Å; W156-W334 HydrophobicContact CH2-CZ2 4.28Å; W156-W334 AromaticContact CH2-NE1 3.76Å; W156-W334 HydrophobicContact CZ3-CZ2 4.11Å
157	R	97.2	Very high	94.7	Very high	38 Å²	38	44.3 Å²	44.3	14%	0.143	22%	0.215	C	C	.	.	H	α-helix	trans	-63.2	-45.1	179.2	-72.7	-168.2	-55.6	-90.9	0.3	112.2	H153 A154 R160 W161 D327 G329	H153-R157 WeakPolarHBondContact O-CG 3.13Å; H153-R157 PolarHBondContact O-N 3.46Å; A154-R157 PolarHBondContact O-N 2.91Å; R157-R160 PolarHBondContact O-N 3.01Å; R157-W161 VanDerWaalsContact O-CB 3.26Å; R157-W161 WeakPolarHBondContact O-CB 3.35Å; R157-W161 PolarHBondContact O-N 2.95Å; R157-D327 WeakPolarHBondContact CB-OD1 3.38Å; R157-D327 IonicContact CZ-OD1 2.81Å; R157-D327 IonicContact CZ-OD2 3.52Å; R157-D327 IonicContact NE-OD1 3.64Å; R157-D327 PolarHBondContact NE-OD1 2.99Å; R157-D327 IonicContact NE-OD2 2.67Å; R157-D327 PolarHBondContact NE-OD2 3.13Å; R157-D327 IonicContact NH2-OD1 3.4Å; R157-D327 IonicContact NH2-OD2 3.36Å; R157-D327 PolarHBondContact NH2-OD2 2.91Å; R157-G329 VanDerWaalsContact CD-C 3.42Å; R157-G329 WeakPolarHBondContact CD-O 3.28Å
158	R	97.5	Very high	94.5	Very high	22 Å²	22	44.6 Å²	44.6	8%	0.083	23%	0.227	C	C	.	.	H	α-helix	trans	-62.4	-43.5	177.7	-68.3	175.8	174.8	-75.4	-6	111.9	A154 L155 W161 Q162 F232 E271 F324 A325 C326 D327	A154-R158 WeakPolarHBondContact O-CG 3.31Å; A154-R158 PolarHBondContact O-N 3.04Å; L155-R158 PolarHBondContact O-N 3.35Å; R158-W161 PolarHBondContact O-N 3.4Å; R158-Q162 PolarHBondContact O-N 2.9Å; R158-F232 HydrophobicContact CB-CE1 4.45Å; R158-E271 IonicContact CZ-OE1 3.35Å; R158-E271 IonicContact NE-OE1 3.93Å; R158-E271 PolarHBondContact NE-OE1 2.85Å; R158-E271 IonicContact NH2-OE1 3.01Å; R158-E271 PolarHBondContact NH2-OE1 3.32Å; R158-F324 HydrophobicContact CB-CB 4.09Å; R158-F324 WeakPolarHBondContact CD-O 3.34Å; R158-F324 PolarHBondContact NH1-O 3.45Å; R158-A325 PolarHBondContact NH1-O 3.27Å; R158-C326 WeakPolarHBondContact CG-O 3.18Å; R158-D327 HydrophobicContact CG-CB 3.72Å
159	W	97.8	Very high	94.2	Very high	6 Å²	6	45.6 Å²	45.6	2%	0.023	23%	0.233	C	C	.	.	H	α-helix	trans	-61.3	-53.1	174.4	168.2	72.7	0	0	0	111.6	L155 W156 W161 Q162 Q163 W179 E182 W183 L186 L229 F324	L155-W159 WeakPolarHBondContact O-CB 3.29Å; L155-W159 PolarHBondContact O-N 3.14Å; W156-W159 PolarHBondContact O-N 3.48Å; W159-W161 VanDerWaalsContact C-N 3.25Å; W159-W161 PolarHBondContact O-N 3.4Å; W159-Q162 PolarHBondContact O-N 3.05Å; W159-Q163 VanDerWaalsContact O-CB 3.28Å; W159-Q163 WeakPolarHBondContact O-CB 3.19Å; W159-Q163 PolarHBondContact O-N 3.08Å; W159-W179 AromaticContact CH2-CE3 3.59Å; W159-W179 HydrophobicContact CH2-CE3 3.59Å; W159-W179 AromaticContact CH2-CZ3 3.78Å; W159-W179 HydrophobicContact CH2-CZ3 3.78Å; W159-W179 HydrophobicContact CZ2-CE3 4.38Å; W159-W179 HydrophobicContact CZ2-CZ3 4.14Å; W159-W179 AromaticContact CZ3-CE3 3.7Å; W159-W179 HydrophobicContact CZ3-CE3 3.7Å; W159-W179 HydrophobicContact CZ3-CZ3 4.01Å; W159-E182 HydrophobicContact CH2-CB 3.79Å; W159-E182 HydrophobicContact CZ2-CB 4.07Å; W159-W183 HydrophobicContact CB-CZ3 4.44Å; W159-W183 HydrophobicContact CD2-CE3 4.16Å; W159-W183 HydrophobicContact CD2-CZ3 4.48Å; W159-W183 AromaticContact CE3-CE3 3.68Å; W159-W183 HydrophobicContact CE3-CE3 3.68Å; W159-W183 HydrophobicContact CE3-CZ3 4.23Å; W159-W183 HydrophobicContact CH2-CB 4.26Å; W159-W183 HydrophobicContact CZ3-CB 3.96Å; W159-W183 HydrophobicContact CZ3-CE3 4.04Å; W159-L186 HydrophobicContact CD2-CD1 4.13Å; W159-L186 HydrophobicContact CH2-CD1 4.27Å; W159-L186 HydrophobicContact CZ2-CD1 3.44Å; W159-L186 VanDerWaalsContact CZ2-CD1 3.44Å; W159-L229 HydrophobicContact CB-CD1 3.93Å; W159-L229 HydrophobicContact CB-CD2 4.37Å; W159-L229 HydrophobicContact CG-CD1 4.43Å; W159-L229 HydrophobicContact CG-CD2 4.12Å; W159-F324 HydrophobicContact CB-CE1 4.28Å
160	R	97.4	Very high	94.2	Very high	9 Å²	9	48.4 Å²	48.4	3%	0.034	25%	0.25	C	S	.	.	H	α-helix	trans	-59.6	-38	179.8	-176.2	175.1	166.3	170	2.9	111.2	W156 R157 T164 E176 W179 W334	W156-R160 VanDerWaalsContact CH2-NH1 3.33Å; W156-R160 VanDerWaalsContact CZ2-CD 3.49Å; W156-R160 VanDerWaalsContact O-CB 3.3Å; W156-R160 WeakPolarHBondContact O-CB 3.39Å; W156-R160 PolarHBondContact O-N 3.05Å; R157-R160 PolarHBondContact O-N 3.01Å; R160-T164 VanDerWaalsContact O-CB 3.24Å; R160-T164 WeakPolarHBondContact O-CB 3.33Å; R160-T164 PolarHBondContact O-N 3.23Å; R160-T164 PolarHBondContact O-OG1 3.14Å; R160-E176 IonicContact CZ-OE1 3.57Å; R160-E176 IonicContact CZ-OE2 3.29Å; R160-E176 IonicContact NH1-OE1 3.69Å; R160-E176 IonicContact NH1-OE2 2.84Å; R160-E176 PolarHBondContact NH1-OE2 3.23Å; R160-E176 IonicContact NH2-OE1 2.84Å; R160-E176 PolarHBondContact NH2-OE1 3.29Å; R160-E176 IonicContact NH2-OE2 2.72Å; R160-E176 PolarHBondContact NH2-OE2 3.45Å; R160-W179 HydrophobicContact CB-CE3 4.42Å; R160-W179 HydrophobicContact CB-CZ3 4.32Å; R160-W179 HydrophobicContact CG-CD2 3.87Å; R160-W179 HydrophobicContact CG-CE3 3.81Å; R160-W179 HydrophobicContact CG-CH2 3.99Å; R160-W179 HydrophobicContact CG-CZ2 4.03Å; R160-W179 HydrophobicContact CG-CZ3 3.88Å; R160-W334 HydrophobicContact CB-CH2 3.52Å; R160-W334 HydrophobicContact CB-CZ2 3.91Å; R160-W334 HydrophobicContact CB-CZ3 4.1Å; R160-W334 VanDerWaalsContact CD-CE2 3.48Å; R160-W334 HydrophobicContact CG-CD2 4.36Å; R160-W334 HydrophobicContact CG-CE3 4.02Å; R160-W334 HydrophobicContact CG-CH2 3.4Å; R160-W334 HydrophobicContact CG-CZ2 3.74Å; R160-W334 HydrophobicContact CG-CZ3 3.55Å; R160-W334 VanDerWaalsContact CZ-CD1 3.49Å; R160-W334 VanDerWaalsContact CZ-CD2 3.45Å; R160-W334 VanDerWaalsContact NE-CE2 3.32Å; R160-W334 VanDerWaalsContact NH2-CG 3.26Å
161	W	95.9	Very high	94.3	Very high	22 Å²	22	46 Å²	46	8%	0.083	24%	0.244	C	C	.	.	H	α-helix	trans	-60.6	-56.2	174.7	175.9	-89.2	0	0	0	111.9	R157 R158 W159 Q163 T164 H165 C326 P328 F332 W334 A344 A347	R157-W161 VanDerWaalsContact O-CB 3.26Å; R157-W161 WeakPolarHBondContact O-CB 3.35Å; R157-W161 PolarHBondContact O-N 2.95Å; R158-W161 PolarHBondContact O-N 3.4Å; W159-W161 VanDerWaalsContact C-N 3.25Å; W159-W161 PolarHBondContact O-N 3.4Å; W161-Q163 PolarHBondContact O-N 3.24Å; W161-T164 WeakPolarHBondContact O-CB 3.39Å; W161-T164 PolarHBondContact O-N 2.92Å; W161-H165 AromaticContact CD1-CD2 3.95Å; W161-H165 AromaticContact CD2-NE2 3.99Å; W161-H165 AromaticContact CE2-CD2 3.77Å; W161-H165 AromaticContact CE2-NE2 3.29Å; W161-H165 VanDerWaalsContact CE2-NE2 3.29Å; W161-H165 AromaticContact CH2-NE2 3.97Å; W161-H165 AromaticContact CZ2-NE2 3.29Å; W161-H165 VanDerWaalsContact CZ2-NE2 3.29Å; W161-H165 WeakPolarHBondContact CZ2-NE2 3.45Å; W161-H165 AromaticContact NE1-CD2 3.54Å; W161-H165 AromaticContact NE1-NE2 3.49Å; W161-H165 PolarHBondContact NE1-NE2 3.24Å; W161-H165 PolarHBondContact O-CD2 2.84Å; W161-H165 VanDerWaalsContact O-CD2 3.3Å; W161-H165 PolarHBondContact O-N 3.4Å; W161-C326 HydrophobicContact CG-CB 4.35Å; W161-P328 HydrophobicContact CD2-CG 4.43Å; W161-P328 HydrophobicContact CE3-CB 3.78Å; W161-P328 HydrophobicContact CE3-CG 3.77Å; W161-P328 HydrophobicContact CZ3-CB 3.95Å; W161-P328 HydrophobicContact CZ3-CG 4.43Å; W161-F332 HydrophobicContact CE3-CE1 4.32Å; W161-F332 HydrophobicContact CE3-CZ 4.44Å; W161-F332 HydrophobicContact CZ3-CE1 4.18Å; W161-F332 HydrophobicContact CZ3-CE2 4.26Å; W161-F332 AromaticContact CZ3-CZ 3.85Å; W161-F332 HydrophobicContact CZ3-CZ 3.85Å; W161-W334 HydrophobicContact CB-CH2 4.34Å; W161-A344 HydrophobicContact CH2-CB 3.74Å; W161-A344 HydrophobicContact CZ3-CB 4.14Å; W161-A347 HydrophobicContact CH2-CB 4.35Å; W161-A347 HydrophobicContact CZ2-CB 4.47Å
162	Q	95.9	Very high	94.4	Very high	32 Å²	32	45.5 Å²	45.5	15%	0.15	25%	0.245	C	C	.	.	H	α-helix	trans	-61	-46.4	179.8	-178.1	171.7	-46.3	0	0	111.3	R158 W159 T164 H165 E166 F324	R158-Q162 PolarHBondContact O-N 2.9Å; W159-Q162 PolarHBondContact O-N 3.05Å; Q162-T164 VanDerWaalsContact C-N 3.29Å; Q162-T164 PolarHBondContact O-N 3.47Å; Q162-H165 PolarHBondContact O-N 3.37Å; Q162-H165 VanDerWaalsContact O-N 3.14Å; Q162-E166 WeakPolarHBondContact CG-OE1 3.29Å; Q162-E166 PolarHBondContact NE2-OE1 3.49Å; Q162-E166 VanDerWaalsContact NE2-OE1 3.11Å; Q162-E166 PolarHBondContact O-N 3.41Å; Q162-F324 HydrophobicContact CB-CD1 4.05Å; Q162-F324 HydrophobicContact CB-CE1 4.19Å; Q162-F324 HydrophobicContact CG-CE1 4.48Å
163	Q	95.6	Very high	94.3	Very high	44 Å²	44	49.6 Å²	49.6	21%	0.206	27%	0.268	C	S	.	.	H	α-helix	trans	-63.2	-34	179	-169.6	64.8	68.6	0	0	112.1	W159 W161 E166 N167 W179	W159-Q163 VanDerWaalsContact O-CB 3.28Å; W159-Q163 WeakPolarHBondContact O-CB 3.19Å; W159-Q163 PolarHBondContact O-N 3.08Å; W161-Q163 PolarHBondContact O-N 3.24Å; Q163-E166 PolarHBondContact O-N 2.97Å; Q163-N167 PolarHBondContact NE2-OD1 3.05Å; Q163-N167 WeakPolarHBondContact O-CB 3.31Å; Q163-N167 PolarHBondContact O-N 2.96Å; Q163-N167 PolarHBondContact O-OD1 3.18Å; Q163-W179 HydrophobicContact CB-CH2 3.76Å; Q163-W179 HydrophobicContact CB-CZ3 3.82Å; Q163-W179 HydrophobicContact CG-CH2 3.71Å; Q163-W179 HydrophobicContact CG-CZ3 3.71Å
164	T	94.7	Very high	94.2	Very high	41 Å²	41	47.7 Å²	47.7	25%	0.252	26%	0.258	S	S	.	.	H	α-helix	trans	-61.7	-43.7	174.6	-64.2	0	0	0	0	110.9	R160 W161 Q162 G168 W179	R160-T164 VanDerWaalsContact O-CB 3.24Å; R160-T164 WeakPolarHBondContact O-CB 3.33Å; R160-T164 PolarHBondContact O-N 3.23Å; R160-T164 PolarHBondContact O-OG1 3.14Å; W161-T164 WeakPolarHBondContact O-CB 3.39Å; W161-T164 PolarHBondContact O-N 2.92Å; Q162-T164 VanDerWaalsContact C-N 3.29Å; Q162-T164 PolarHBondContact O-N 3.47Å; T164-G168 PolarHBondContact O-N 3.17Å; T164-W179 WeakPolarHBondContact OG1-CZ2 3.43Å
165	H	92.1	Very high	94.2	Very high	95 Å²	95	51.2 Å²	51.2	44%	0.44	28%	0.279	S	S	.	.	H	α-helix	trans	-67.2	-39.4	176.4	-74.9	-68.7	0	0	0	112.7	W161 Q162 Q169	W161-H165 AromaticContact CD1-CD2 3.95Å; W161-H165 AromaticContact CD2-NE2 3.99Å; W161-H165 AromaticContact CE2-CD2 3.77Å; W161-H165 AromaticContact CE2-NE2 3.29Å; W161-H165 VanDerWaalsContact CE2-NE2 3.29Å; W161-H165 AromaticContact CH2-NE2 3.97Å; W161-H165 AromaticContact CZ2-NE2 3.29Å; W161-H165 VanDerWaalsContact CZ2-NE2 3.29Å; W161-H165 WeakPolarHBondContact CZ2-NE2 3.45Å; W161-H165 AromaticContact NE1-CD2 3.54Å; W161-H165 AromaticContact NE1-NE2 3.49Å; W161-H165 PolarHBondContact NE1-NE2 3.24Å; W161-H165 PolarHBondContact O-CD2 2.84Å; W161-H165 VanDerWaalsContact O-CD2 3.3Å; W161-H165 PolarHBondContact O-N 3.4Å; Q162-H165 PolarHBondContact O-N 3.37Å; Q162-H165 VanDerWaalsContact O-N 3.14Å; H165-Q169 WeakPolarHBondContact O-CG 3.42Å; H165-Q169 PolarHBondContact O-N 3.5Å; H165-Q169 VanDerWaalsContact O-N 3.15Å
166	E	91.6	Very high	94.1	Very high	46 Å²	46	55.4 Å²	55.4	22%	0.215	30%	0.298	C	S	.	.	H	α-helix	trans	-66.2	-43.4	176.1	-69.8	177.2	-167.6	0	0	112	Q162 Q163 Q169	Q162-E166 WeakPolarHBondContact CG-OE1 3.29Å; Q162-E166 PolarHBondContact NE2-OE1 3.49Å; Q162-E166 VanDerWaalsContact NE2-OE1 3.11Å; Q162-E166 PolarHBondContact O-N 3.41Å; Q163-E166 PolarHBondContact O-N 2.97Å; E166-Q169 WeakPolarHBondContact O-CB 3.39Å; E166-Q169 PolarHBondContact O-N 2.9Å
167	N	93.5	Very high	94	Very high	14 Å²	14	55.5 Å²	55.5	8%	0.075	31%	0.311	C	S	.	.	H	α-helix	trans	-64.7	-43	176.2	-73.9	-3.4	0	0	0	111.2	Q163 Q169 C170 G171 L172 Y174	Q163-N167 PolarHBondContact NE2-OD1 3.05Å; Q163-N167 WeakPolarHBondContact O-CB 3.31Å; Q163-N167 PolarHBondContact O-N 2.96Å; Q163-N167 PolarHBondContact O-OD1 3.18Å; N167-Q169 VanDerWaalsContact C-N 3.26Å; N167-Q169 PolarHBondContact O-N 2.77Å; N167-C170 CarbonylContact O-C 3.57Å; N167-C170 WeakPolarHBondContact O-CA 3.48Å; N167-C170 PolarHBondContact O-N 3.24Å; N167-G171 PolarHBondContact O-N 2.84Å; N167-L172 CarbonylContact C-O 3.4Å; N167-L172 HydrophobicContact CB-CB 4.07Å; N167-L172 HydrophobicContact CB-CD2 4.47Å; N167-L172 HydrophobicContact CB-CG 4.35Å; N167-L172 VanDerWaalsContact CB-O 3.27Å; N167-L172 WeakPolarHBondContact CB-O 3.21Å; N167-L172 PolarHBondContact O-N 3.49Å; N167-Y174 WeakPolarHBondContact ND2-CE2 3.37Å
168	G	90.9	Very high	94	Very high	48 Å²	48	56.4 Å²	56.4	50%	0.495	32%	0.317	S	S	.	.	H	α-helix	trans	-59.2	-35.4	176.5	0	0	0	0	0	112.7	T164 C170 G171	T164-G168 PolarHBondContact O-N 3.17Å; G168-C170 PolarHBondContact O-N 3.42Å; G168-G171 PolarHBondContact O-N 3.18Å
169	Q	87.7	Confident	94	Very high	96 Å²	96	55.9 Å²	55.9	45%	0.449	32%	0.316	S	S	.	.	H	α-helix	trans	-57.1	-37.3	171.8	-70.6	168.9	38.1	0	0	110.8	H165 E166 N167 R429	H165-Q169 WeakPolarHBondContact O-CG 3.42Å; H165-Q169 PolarHBondContact O-N 3.5Å; H165-Q169 VanDerWaalsContact O-N 3.15Å; E166-Q169 WeakPolarHBondContact O-CB 3.39Å; E166-Q169 PolarHBondContact O-N 2.9Å; N167-Q169 VanDerWaalsContact C-N 3.26Å; N167-Q169 PolarHBondContact O-N 2.77Å; Q169-R429 PolarHBondContact O-NH1 2.86Å; Q169-R429 PolarHBondContact O-NH2 3.33Å
170	C	88.5	Confident	93.9	Very high	69 Å²	69	58.5 Å²	58.5	47%	0.466	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	0.8	178.4	-64.4	0	0	0	0	115.2	N167 G168 L172	N167-C170 CarbonylContact O-C 3.57Å; N167-C170 WeakPolarHBondContact O-CA 3.48Å; N167-C170 PolarHBondContact O-N 3.24Å; G168-C170 PolarHBondContact O-N 3.42Å; C170-L172 PolarHBondContact O-N 2.91Å
171	G	92.2	Very high	93.9	Very high	68 Å²	68	64.6 Å²	64.6	70%	0.701	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	29.3	-172.9	0	0	0	0	0	112.5	N167 G168	N167-G171 PolarHBondContact O-N 2.84Å; G168-G171 PolarHBondContact O-N 3.18Å
172	L	93.5	Very high	94	Very high	50 Å²	50	66.7 Å²	66.7	26%	0.262	37%	0.368	S	S	.	.			trans	-97	131.8	174.1	178.9	63.5	0	0	0	108.2	N167 C170 Y174	N167-L172 CarbonylContact C-O 3.4Å; N167-L172 HydrophobicContact CB-CB 4.07Å; N167-L172 HydrophobicContact CB-CD2 4.47Å; N167-L172 HydrophobicContact CB-CG 4.35Å; N167-L172 VanDerWaalsContact CB-O 3.27Å; N167-L172 WeakPolarHBondContact CB-O 3.21Å; N167-L172 PolarHBondContact O-N 3.49Å; C170-L172 PolarHBondContact O-N 2.91Å; L172-Y174 HydrophobicContact CD1-CD1 4.29Å; L172-Y174 HydrophobicContact CD1-CE1 4.07Å; L172-Y174 HydrophobicContact CD2-CD1 4.4Å; L172-Y174 HydrophobicContact CD2-CE1 3.66Å; L172-Y174 HydrophobicContact CG-CD1 4.21Å; L172-Y174 HydrophobicContact CG-CE1 3.94Å
173	E	92.8	Very high	94.1	Very high	176 Å²	176	66.7 Å²	66.7	82%	0.822	37%	0.367	S	S	*	.			trans	-129.4	128.2	173.7	-69.5	177.8	-172.3	0	0	107.6
174	Y	93.7	Very high	94.1	Very high	59 Å²	59	70.6 Å²	70.6	23%	0.231	39%	0.385	C	S	.	.			trans	-93.1	139.3	179	-76.6	-20	0	0	0	111	N167 L172 E178 W179 E182	N167-Y174 WeakPolarHBondContact ND2-CE2 3.37Å; L172-Y174 HydrophobicContact CD1-CD1 4.29Å; L172-Y174 HydrophobicContact CD1-CE1 4.07Å; L172-Y174 HydrophobicContact CD2-CD1 4.4Å; L172-Y174 HydrophobicContact CD2-CE1 3.66Å; L172-Y174 HydrophobicContact CG-CD1 4.21Å; L172-Y174 HydrophobicContact CG-CE1 3.94Å; Y174-E178 WeakPolarHBondContact CA-OE2 3.35Å; Y174-E178 HydrophobicContact CD1-CB 4.06Å; Y174-E178 HydrophobicContact CG-CB 3.92Å; Y174-W179 HydrophobicContact CD2-CD2 4.02Å; Y174-W179 AromaticContact CD2-CE3 3.98Å; Y174-W179 HydrophobicContact CD2-CE3 3.98Å; Y174-W179 HydrophobicContact CD2-CH2 4.05Å; Y174-W179 HydrophobicContact CD2-CZ2 4.09Å; Y174-W179 AromaticContact CD2-CZ3 4Å; Y174-W179 HydrophobicContact CD2-CZ3 4Å; Y174-W179 PolarHBondContact O-NE1 2.99Å; Y174-E182 HydrophobicContact CD2-CG 4.4Å; Y174-E182 HydrophobicContact CE2-CG 3.79Å
175	T	95.3	Very high	94.2	Very high	81 Å²	81	74.3 Å²	74.3	50%	0.497	40%	0.398	S	S	.	.			trans	-66.2	158.6	163.7	61.3	0	0	0	0	110.7	A177 E178 W179	T175-A177 PolarHBondContact O-N 2.62Å; T175-E178 WeakPolarHBondContact CB-OE2 3.37Å; T175-E178 PolarHBondContact N-OE2 2.79Å; T175-E178 WeakPolarHBondContact O-CB 3.46Å; T175-E178 PolarHBondContact O-N 3.01Å; T175-E178 VanDerWaalsContact OG1-CG 3.28Å; T175-E178 WeakPolarHBondContact OG1-CG 3.39Å; T175-E178 PolarHBondContact OG1-N 3.32Å; T175-E178 PolarHBondContact OG1-OE2 3.26Å; T175-W179 PolarHBondContact O-N 2.83Å
176	E	94.5	Very high	94.5	Very high	88 Å²	88	70.2 Å²	70.2	41%	0.411	38%	0.38	S	S	.	.	H	α-helix	trans	-56.9	-35.6	175.6	-66.5	-61.3	152	0	0	112.4	R160 E178 W179 S180	R160-E176 IonicContact CZ-OE1 3.57Å; R160-E176 IonicContact CZ-OE2 3.29Å; R160-E176 IonicContact NH1-OE1 3.69Å; R160-E176 IonicContact NH1-OE2 2.84Å; R160-E176 PolarHBondContact NH1-OE2 3.23Å; R160-E176 IonicContact NH2-OE1 2.84Å; R160-E176 PolarHBondContact NH2-OE1 3.29Å; R160-E176 IonicContact NH2-OE2 2.72Å; R160-E176 PolarHBondContact NH2-OE2 3.45Å; E176-E178 VanDerWaalsContact C-N 3.35Å; E176-W179 PolarHBondContact O-N 3.35Å; E176-S180 PolarHBondContact O-N 3.41Å; E176-S180 PolarHBondContact O-OG 2.94Å
177	A	96	Very high	94.8	Very high	61 Å²	61	69 Å²	69	50%	0.504	38%	0.375	S	S	.	.	H	α-helix	trans	-68.5	-32	176.1	0	0	0	0	0	112.9	T175 R181	T175-A177 PolarHBondContact O-N 2.62Å; A177-R181 WeakPolarHBondContact O-CB 3.17Å; A177-R181 VanDerWaalsContact O-CG 3.3Å; A177-R181 WeakPolarHBondContact O-CG 3.42Å; A177-R181 PolarHBondContact O-N 3.03Å; A177-R181 VanDerWaalsContact O-N 3.15Å; A177-R181 PolarHBondContact O-NE 3.37Å
178	E	97	Very high	94.9	Very high	57 Å²	57	73 Å²	73	27%	0.266	40%	0.396	S	S	.	.	H	α-helix	trans	-69.7	-44.4	171.6	-75.5	164.7	145.6	0	0	110.8	Y174 T175 E176 S180 R181 E182	Y174-E178 WeakPolarHBondContact CA-OE2 3.35Å; Y174-E178 HydrophobicContact CD1-CB 4.06Å; Y174-E178 HydrophobicContact CG-CB 3.92Å; T175-E178 WeakPolarHBondContact CB-OE2 3.37Å; T175-E178 PolarHBondContact N-OE2 2.79Å; T175-E178 WeakPolarHBondContact O-CB 3.46Å; T175-E178 PolarHBondContact O-N 3.01Å; T175-E178 VanDerWaalsContact OG1-CG 3.28Å; T175-E178 WeakPolarHBondContact OG1-CG 3.39Å; T175-E178 PolarHBondContact OG1-N 3.32Å; T175-E178 PolarHBondContact OG1-OE2 3.26Å; E176-E178 VanDerWaalsContact C-N 3.35Å; E178-S180 VanDerWaalsContact C-N 3.32Å; E178-S180 PolarHBondContact O-N 3.48Å; E178-R181 PolarHBondContact O-N 3.38Å; E178-R181 VanDerWaalsContact O-N 3.14Å; E178-E182 VanDerWaalsContact O-CG 3.31Å; E178-E182 WeakPolarHBondContact O-CG 3.37Å; E178-E182 PolarHBondContact O-N 3.32Å
179	W	96.4	Very high	95.1	Very high	12 Å²	12	71.3 Å²	71.3	5%	0.045	38%	0.376	C	S	.	.	H	α-helix	trans	-56.4	-44	175.1	-77.6	118.8	0	0	0	113	W159 R160 Q163 T164 Y174 T175 E176 W183	W159-W179 AromaticContact CH2-CE3 3.59Å; W159-W179 HydrophobicContact CH2-CE3 3.59Å; W159-W179 AromaticContact CH2-CZ3 3.78Å; W159-W179 HydrophobicContact CH2-CZ3 3.78Å; W159-W179 HydrophobicContact CZ2-CE3 4.38Å; W159-W179 HydrophobicContact CZ2-CZ3 4.14Å; W159-W179 AromaticContact CZ3-CE3 3.7Å; W159-W179 HydrophobicContact CZ3-CE3 3.7Å; W159-W179 HydrophobicContact CZ3-CZ3 4.01Å; R160-W179 HydrophobicContact CB-CE3 4.42Å; R160-W179 HydrophobicContact CB-CZ3 4.32Å; R160-W179 HydrophobicContact CG-CD2 3.87Å; R160-W179 HydrophobicContact CG-CE3 3.81Å; R160-W179 HydrophobicContact CG-CH2 3.99Å; R160-W179 HydrophobicContact CG-CZ2 4.03Å; R160-W179 HydrophobicContact CG-CZ3 3.88Å; Q163-W179 HydrophobicContact CB-CH2 3.76Å; Q163-W179 HydrophobicContact CB-CZ3 3.82Å; Q163-W179 HydrophobicContact CG-CH2 3.71Å; Q163-W179 HydrophobicContact CG-CZ3 3.71Å; T164-W179 WeakPolarHBondContact OG1-CZ2 3.43Å; Y174-W179 HydrophobicContact CD2-CD2 4.02Å; Y174-W179 AromaticContact CD2-CE3 3.98Å; Y174-W179 HydrophobicContact CD2-CE3 3.98Å; Y174-W179 HydrophobicContact CD2-CH2 4.05Å; Y174-W179 HydrophobicContact CD2-CZ2 4.09Å; Y174-W179 AromaticContact CD2-CZ3 4Å; Y174-W179 HydrophobicContact CD2-CZ3 4Å; Y174-W179 PolarHBondContact O-NE1 2.99Å; T175-W179 PolarHBondContact O-N 2.83Å; E176-W179 PolarHBondContact O-N 3.35Å; W179-W183 WeakPolarHBondContact O-CB 3.45Å; W179-W183 PolarHBondContact O-N 3.1Å; W179-W183 VanDerWaalsContact O-N 3.08Å
180	S	96.7	Very high	95.5	Very high	60 Å²	60	66.8 Å²	66.8	42%	0.42	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-45.5	175.2	-65.5	0	0	0	0	112.1	E176 E178 W183 E184	E176-S180 PolarHBondContact O-N 3.41Å; E176-S180 PolarHBondContact O-OG 2.94Å; E178-S180 VanDerWaalsContact C-N 3.32Å; E178-S180 PolarHBondContact O-N 3.48Å; S180-W183 PolarHBondContact O-N 3.25Å; S180-E184 WeakPolarHBondContact O-CB 3.4Å; S180-E184 VanDerWaalsContact O-CG 3.29Å; S180-E184 WeakPolarHBondContact O-CG 3.4Å; S180-E184 PolarHBondContact O-N 3.27Å
181	R	97.6	Very high	95.9	Very high	137 Å²	137	63.8 Å²	63.8	52%	0.517	34%	0.335	S	S	.	.	H	α-helix	trans	-63.1	-45.2	179.5	-78.3	-175.6	-72	131.8	-15.6	112.9	A177 E178 W183 E184 F185	A177-R181 WeakPolarHBondContact O-CB 3.17Å; A177-R181 VanDerWaalsContact O-CG 3.3Å; A177-R181 WeakPolarHBondContact O-CG 3.42Å; A177-R181 PolarHBondContact O-N 3.03Å; A177-R181 VanDerWaalsContact O-N 3.15Å; A177-R181 PolarHBondContact O-NE 3.37Å; E178-R181 PolarHBondContact O-N 3.38Å; E178-R181 VanDerWaalsContact O-N 3.14Å; R181-W183 VanDerWaalsContact C-N 3.35Å; R181-E184 PolarHBondContact O-N 3.44Å; R181-F185 WeakPolarHBondContact O-CB 3.07Å; R181-F185 PolarHBondContact O-N 3.42Å
182	E	97.3	Very high	96	Very high	67 Å²	67	62.2 Å²	62.2	31%	0.313	31%	0.312	S	S	.	.	H	α-helix	trans	-64.5	-40.5	178.1	-66.5	-61.7	131.9	0	0	111.2	W159 Y174 E178 F185 L186	W159-E182 HydrophobicContact CH2-CB 3.79Å; W159-E182 HydrophobicContact CZ2-CB 4.07Å; Y174-E182 HydrophobicContact CD2-CG 4.4Å; Y174-E182 HydrophobicContact CE2-CG 3.79Å; E178-E182 VanDerWaalsContact O-CG 3.31Å; E178-E182 WeakPolarHBondContact O-CG 3.37Å; E178-E182 PolarHBondContact O-N 3.32Å; E182-F185 PolarHBondContact O-N 3.31Å; E182-L186 WeakPolarHBondContact O-CG 3.38Å; E182-L186 PolarHBondContact O-N 3.1Å
183	W	97.4	Very high	96	Very high	31 Å²	31	67.6 Å²	67.6	12%	0.117	33%	0.329	C	S	.	.	H	α-helix	trans	-64.6	-46.8	174.6	177.2	-103.2	0	0	0	112.4	L146 L155 W156 W159 W179 S180 R181 F185 L186 V187 L229	L146-W183 HydrophobicContact CD2-CH2 4.18Å; L155-W183 HydrophobicContact CB-CH2 4.37Å; W156-W183 HydrophobicContact CB-CD2 4.34Å; W156-W183 HydrophobicContact CB-CE3 4.18Å; W156-W183 HydrophobicContact CB-CH2 3.74Å; W156-W183 HydrophobicContact CB-CZ2 3.93Å; W156-W183 HydrophobicContact CB-CZ3 3.86Å; W156-W183 AromaticContact CD1-CD2 3.42Å; W156-W183 VanDerWaalsContact CD1-CD2 3.42Å; W156-W183 AromaticContact CD1-CE2 3.93Å; W156-W183 AromaticContact CD1-CE3 3.54Å; W156-W183 AromaticContact CD1-CG 3.62Å; W156-W183 HydrophobicContact CG-CD2 4.26Å; W156-W183 HydrophobicContact CG-CE3 4.26Å; W156-W183 HydrophobicContact CG-CZ3 4.41Å; W159-W183 HydrophobicContact CB-CZ3 4.44Å; W159-W183 HydrophobicContact CD2-CE3 4.16Å; W159-W183 HydrophobicContact CD2-CZ3 4.48Å; W159-W183 AromaticContact CE3-CE3 3.68Å; W159-W183 HydrophobicContact CE3-CE3 3.68Å; W159-W183 HydrophobicContact CE3-CZ3 4.23Å; W159-W183 HydrophobicContact CH2-CB 4.26Å; W159-W183 HydrophobicContact CZ3-CB 3.96Å; W159-W183 HydrophobicContact CZ3-CE3 4.04Å; W179-W183 WeakPolarHBondContact O-CB 3.45Å; W179-W183 PolarHBondContact O-N 3.1Å; W179-W183 VanDerWaalsContact O-N 3.08Å; S180-W183 PolarHBondContact O-N 3.25Å; R181-W183 VanDerWaalsContact C-N 3.35Å; W183-F185 VanDerWaalsContact C-N 3.28Å; W183-F185 PolarHBondContact O-N 2.96Å; W183-L186 PolarHBondContact O-N 3.47Å; W183-V187 HydrophobicContact CD2-CG2 4.19Å; W183-V187 HydrophobicContact CG-CG2 4.45Å; W183-V187 HydrophobicContact CZ2-CG2 4.08Å; W183-V187 VanDerWaalsContact O-CG2 3.31Å; W183-V187 WeakPolarHBondContact O-CG2 3.21Å; W183-V187 PolarHBondContact O-N 3.41Å; W183-L229 HydrophobicContact CE3-CD2 4.03Å; W183-L229 HydrophobicContact CH2-CD2 4.19Å; W183-L229 HydrophobicContact CZ3-CD2 3.43Å; W183-L229 VanDerWaalsContact CZ3-CD2 3.43Å
184	E	97.3	Very high	95.9	Very high	127 Å²	127	61.6 Å²	61.6	59%	0.593	31%	0.305	S	S	*	.	H	α-helix	trans	-58.9	-41.3	177.3	-76	170.5	-170.4	0	0	111.5	S180 R181 V187 D188	S180-E184 WeakPolarHBondContact O-CB 3.4Å; S180-E184 VanDerWaalsContact O-CG 3.29Å; S180-E184 WeakPolarHBondContact O-CG 3.4Å; S180-E184 PolarHBondContact O-N 3.27Å; R181-E184 PolarHBondContact O-N 3.44Å; E184-V187 PolarHBondContact O-N 3.19Å; E184-D188 WeakPolarHBondContact O-CB 3.46Å; E184-D188 PolarHBondContact O-N 3.1Å
185	F	97.1	Very high	95.6	Very high	118 Å²	118	64 Å²	64	52%	0.518	31%	0.314	S	S	.	.	H	α-helix	trans	-60.5	-47.8	173.9	174.7	-103.3	0	0	0	112.2	R181 E182 W183 V187 D188 I189	R181-F185 WeakPolarHBondContact O-CB 3.07Å; R181-F185 PolarHBondContact O-N 3.42Å; E182-F185 PolarHBondContact O-N 3.31Å; W183-F185 VanDerWaalsContact C-N 3.28Å; W183-F185 PolarHBondContact O-N 2.96Å; F185-V187 VanDerWaalsContact C-N 3.32Å; F185-V187 PolarHBondContact O-N 3.34Å; F185-D188 PolarHBondContact O-N 2.92Å; F185-D188 VanDerWaalsContact O-N 3.17Å; F185-I189 HydrophobicContact CD2-CG2 4.32Å; F185-I189 HydrophobicContact CE1-CD1 4.27Å; F185-I189 HydrophobicContact CE1-CG2 4.24Å; F185-I189 HydrophobicContact CE2-CG2 3.8Å; F185-I189 HydrophobicContact CZ-CG2 3.76Å; F185-I189 PolarHBondContact O-N 3.48Å
186	L	97.2	Very high	94.4	Very high	10 Å²	10	66.6 Å²	66.6	5%	0.052	33%	0.325	C	S	.	.	H	α-helix	trans	-59.8	-41.9	176.6	-72.1	169.3	0	0	0	111.8	W159 E182 W183 D188 I189 D227 L229 H230	W159-L186 HydrophobicContact CD2-CD1 4.13Å; W159-L186 HydrophobicContact CH2-CD1 4.27Å; W159-L186 HydrophobicContact CZ2-CD1 3.44Å; W159-L186 VanDerWaalsContact CZ2-CD1 3.44Å; E182-L186 WeakPolarHBondContact O-CG 3.38Å; E182-L186 PolarHBondContact O-N 3.1Å; W183-L186 PolarHBondContact O-N 3.47Å; L186-D188 VanDerWaalsContact C-N 3.33Å; L186-D188 PolarHBondContact O-N 3.2Å; L186-I189 HydrophobicContact CD2-CD1 4.24Å; L186-I189 VanDerWaalsContact O-CG1 3.29Å; L186-I189 WeakPolarHBondContact O-CG1 3.28Å; L186-D227 HydrophobicContact CD2-CB 3.99Å; L186-L229 HydrophobicContact CB-CD2 4.27Å; L186-L229 HydrophobicContact CD1-CD2 3.88Å; L186-H230 PolarHBondContact O-CE1 3.06Å; L186-H230 PolarHBondContact O-NE2 3.17Å
187	V	97.1	Very high	92.8	Very high	19 Å²	19	69.5 Å²	69.5	12%	0.115	34%	0.336	C	S	.	.	H	α-helix	trans	-65	-37.7	176.8	175.8	0	0	0	0	111.8	H143 L146 T147 W183 E184 F185 A190	H143-V187 PolarHBondContact CE1-O 2.98Å; H143-V187 VanDerWaalsContact CE1-O 3.25Å; H143-V187 PolarHBondContact ND1-O 2.93Å; L146-V187 HydrophobicContact CB-CG2 4.29Å; T147-V187 HydrophobicContact CG2-CG1 3.44Å; T147-V187 VanDerWaalsContact CG2-CG1 3.44Å; W183-V187 HydrophobicContact CD2-CG2 4.19Å; W183-V187 HydrophobicContact CG-CG2 4.45Å; W183-V187 HydrophobicContact CZ2-CG2 4.08Å; W183-V187 VanDerWaalsContact O-CG2 3.31Å; W183-V187 WeakPolarHBondContact O-CG2 3.21Å; W183-V187 PolarHBondContact O-N 3.41Å; E184-V187 PolarHBondContact O-N 3.19Å; F185-V187 VanDerWaalsContact C-N 3.32Å; F185-V187 PolarHBondContact O-N 3.34Å; V187-A190 WeakPolarHBondContact O-CB 3.4Å; V187-A190 PolarHBondContact O-N 2.88Å
188	D	96.2	Very high	90.8	Very high	98 Å²	98	74.9 Å²	74.9	52%	0.524	35%	0.348	S	S	.	.	H	α-helix	trans	-69.8	-42.8	-178.8	-168.6	52.7	0	0	0	112.6	E184 F185 L186 A190 S191	E184-D188 WeakPolarHBondContact O-CB 3.46Å; E184-D188 PolarHBondContact O-N 3.1Å; F185-D188 PolarHBondContact O-N 2.92Å; F185-D188 VanDerWaalsContact O-N 3.17Å; L186-D188 VanDerWaalsContact C-N 3.33Å; L186-D188 PolarHBondContact O-N 3.2Å; D188-A190 PolarHBondContact O-N 3.17Å; D188-S191 WeakPolarHBondContact O-CB 3.43Å; D188-S191 PolarHBondContact O-N 3.29Å
189	I	96	Very high	88.3	Confident	14 Å²	14	76.4 Å²	76.4	7%	0.072	36%	0.364	C	S	.	.	H	α-helix	trans	-66.4	-19.6	178.4	65.1	174.5	0	0	0	113.4	R139 F185 L186 S191 E224	R139-I189 PolarHBondContact NH1-O 3.45Å; F185-I189 HydrophobicContact CD2-CG2 4.32Å; F185-I189 HydrophobicContact CE1-CD1 4.27Å; F185-I189 HydrophobicContact CE1-CG2 4.24Å; F185-I189 HydrophobicContact CE2-CG2 3.8Å; F185-I189 HydrophobicContact CZ-CG2 3.76Å; F185-I189 PolarHBondContact O-N 3.48Å; L186-I189 HydrophobicContact CD2-CD1 4.24Å; L186-I189 VanDerWaalsContact O-CG1 3.29Å; L186-I189 WeakPolarHBondContact O-CG1 3.28Å; I189-S191 PolarHBondContact O-N 2.96Å; I189-E224 HydrophobicContact CB-CB 3.85Å; I189-E224 HydrophobicContact CB-CG 4.42Å; I189-E224 HydrophobicContact CG2-CB 4.13Å; I189-E224 HydrophobicContact CG2-CG 4.25Å
190	A	96.4	Very high	86.2	Confident	0 Å²	0	81.9 Å²	81.9	0%	0	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-17	171	0	0	0	0	0	113.3	R139 L142 H143 L146 V187 D188	R139-A190 WeakPolarHBondContact CG-O 3.46Å; L142-A190 HydrophobicContact CD2-CB 4.2Å; H143-A190 HydrophobicContact CB-CB 4.28Å; L146-A190 HydrophobicContact CD1-CB 3.95Å; V187-A190 WeakPolarHBondContact O-CB 3.4Å; V187-A190 PolarHBondContact O-N 2.88Å; D188-A190 PolarHBondContact O-N 3.17Å
191	S	95.8	Very high	84	Confident	7 Å²	7	86.8 Å²	86.8	5%	0.049	41%	0.411	C	S	.	.	S	Bend	trans	-54.2	144.9	-175.3	-179.4	0	0	0	0	112.6	R139 H143 D188 I189 R193	R139-S191 PolarHBondContact NH1-O 3.12Å; H143-S191 PolarHBondContact ND1-N 3.21Å; D188-S191 WeakPolarHBondContact O-CB 3.43Å; D188-S191 PolarHBondContact O-N 3.29Å; I189-S191 PolarHBondContact O-N 2.96Å; S191-R193 PolarHBondContact O-N 3.08Å; S191-R193 WeakPolarHBondContact OG-CB 3.45Å; S191-R193 WeakPolarHBondContact OG-CG 3.23Å; S191-R193 PolarHBondContact OG-N 3.1Å
192	P	94.2	Very high	81.5	Confident	34 Å²	34	87.3 Å²	87.3	22%	0.221	42%	0.424	C	S	.	.	S	Bend	trans	-75.6	5.3	171.5	34	-36.9	0	0	0	113.4	L136 R139 K140 Y223	L136-P192 HydrophobicContact CB-CB 4.46Å; L136-P192 HydrophobicContact CD1-CB 3.94Å; R139-P192 HydrophobicContact CG-CB 4.26Å; K140-P192 HydrophobicContact CG-CB 3.95Å; K140-P192 HydrophobicContact CG-CG 4.01Å; P192-Y223 WeakPolarHBondContact O-CE1 3.43Å
193	R	93.4	Very high	79.2	Confident	164 Å²	164	94.3 Å²	94.3	62%	0.619	45%	0.448	S	S	*	.	S	Bend	trans	-77.8	128.7	178.8	-66.9	177	-170.7	150.5	2.3	110.2	S191	S191-R193 PolarHBondContact O-N 3.08Å; S191-R193 WeakPolarHBondContact OG-CB 3.45Å; S191-R193 WeakPolarHBondContact OG-CG 3.23Å; S191-R193 PolarHBondContact OG-N 3.1Å
194	P	90.9	Very high	76.6	Confident	49 Å²	49	100.8 Å²	100.8	32%	0.318	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-60.5	149.6	170.4	-21.6	32.8	0	0	0	111.3	N196 D221 I222 Y223	P194-N196 PolarHBondContact O-N 2.92Å; P194-D221 HydrophobicContact CB-CB 4.01Å; P194-D221 HydrophobicContact CG-CB 3.8Å; P194-I222 CarbonylContact C-O 3.54Å; P194-I222 WeakPolarHBondContact CA-O 3.49Å; P194-Y223 HydrophobicContact CG-CE1 4Å
195	R	87.2	Confident	73.8	Confident	111 Å²	111	100 Å²	100	42%	0.419	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-62.6	117.5	173.8	-175.9	177	176.4	142.3	-6.1	109.5	K197 I222 E224	R195-K197 PolarHBondContact O-N 3.45Å; R195-K197 VanDerWaalsContact O-N 3.14Å; R195-I222 WeakPolarHBondContact CB-O 3.46Å; R195-I222 PolarHBondContact N-O 3.27Å; R195-E224 VanDerWaalsContact CD-OE1 3.23Å; R195-E224 WeakPolarHBondContact CD-OE1 3.23Å; R195-E224 VanDerWaalsContact CG-OE1 3.31Å; R195-E224 WeakPolarHBondContact CG-OE1 3.22Å; R195-E224 IonicContact CZ-OE1 3.72Å; R195-E224 IonicContact NE-OE1 2.77Å; R195-E224 IonicContact NH1-OE1 2.8Å; R195-E224 IonicContact NH1-OE2 3.49Å; R195-E224 PolarHBondContact NH1-OE2 3.39Å
196	N	70.7	Confident	70.9	Confident	135 Å²	135	103.9 Å²	103.9	72%	0.722	51%	0.507	S	S	*	.			trans	-65.7	112.5	178.8	-86.5	-31.4	0	0	0	110.6	P194 K198	P194-N196 PolarHBondContact O-N 2.92Å; N196-K198 PolarHBondContact O-N 3.08Å
197	K	60.5	Low	68.2	Low	148 Å²	148	107.8 Å²	107.8	64%	0.643	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-68.7	9.7	174.3	-69.9	-171.8	176.7	-178.5	0	115	R195 S199	R195-K197 PolarHBondContact O-N 3.45Å; R195-K197 VanDerWaalsContact O-N 3.14Å; K197-S199 PolarHBondContact O-N 2.99Å; K197-S199 VanDerWaalsContact O-N 3.12Å
198	K	54.2	Low	65.4	Low	175 Å²	175	113.2 Å²	113.2	76%	0.761	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-72.6	-0.1	-172.6	-77.9	-170.3	175	-176.4	0	115.3	N196	N196-K198 PolarHBondContact O-N 3.08Å
199	S	45.6	Very low	62.7	Low	88 Å²	88	112.9 Å²	112.9	62%	0.615	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-101.5	-12.7	177.5	57.8	0	0	0	0	115.3	K197	K197-S199 PolarHBondContact O-N 2.99Å; K197-S199 VanDerWaalsContact O-N 3.12Å
200	D	50.4	Low	60	Low	128 Å²	128	123 Å²	123	68%	0.684	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	-19.5	-172.6	-70.1	-29	0	0	0	114.6
201	E	51	Low	57.4	Low	163 Å²	163	130.9 Å²	130.9	76%	0.762	66%	0.659	S	S	*	*	S	Bend	trans	-90.7	-13.3	178.9	-64.9	-152.2	143.1	0	0	114.8	R203	E201-R203 PolarHBondContact O-N 3.08Å
202	D	46.3	Very low	54.4	Low	148 Å²	148	134.3 Å²	134.3	79%	0.791	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	10.6	-180	-76.9	-20.1	0	0	0	114.2
203	R	48.3	Very low	52	Low	213 Å²	213	139.7 Å²	139.7	80%	0.804	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	-6.3	179.2	-76.2	-173.5	174.8	-175.6	0	116.1	E201	E201-R203 PolarHBondContact O-N 3.08Å
204	H	43.3	Very low	49.1	Very low	168 Å²	168	143.8 Å²	143.8	78%	0.778	74%	0.736	S	S	*	*	S	Bend	trans	-151	90	176.3	-70.8	-65.7	0	0	0	111.5
205	S	38.4	Very low	46.5	Very low	109 Å²	109	148.8 Å²	148.8	76%	0.762	76%	0.755	S	S	*	*			trans	159.4	76.4	135.8	-72.9	0	0	0	0	111.4	S207	S205-S207 PolarHBondContact O-N 3.15Å; S205-S207 VanDerWaalsContact O-N 3.12Å
206	E	36.2	Very low	44	Very low	201 Å²	201	153.2 Å²	153.2	94%	0.939	78%	0.781	S	S	*	*			trans	-79.5	69.1	154.9	-165.4	169.2	-156.1	0	0	108.5
207	S	38.9	Very low	42.3	Very low	92 Å²	92	150.8 Å²	150.8	64%	0.643	77%	0.774	S	S	*	*			trans	-178.6	98.8	162.3	56.7	0	0	0	0	109.7	S205	S205-S207 PolarHBondContact O-N 3.15Å; S205-S207 VanDerWaalsContact O-N 3.12Å
208	T	39.8	Very low	41.5	Very low	133 Å²	133	150 Å²	150	82%	0.816	78%	0.777	S	S	*	*				163.3	85.1	127.6	-57.7	0	0	0	0	107.3
209	A	38.6	Very low	41.3	Very low	91 Å²	91	152.8 Å²	152.8	75%	0.752	78%	0.783	S	S	*	*			trans	-63.1	147.3	158	0	0	0	0	0	109.4
210	R	40.7	Very low	42.2	Very low	226 Å²	226	151.9 Å²	151.9	85%	0.853	78%	0.775	S	S	*	*			trans	87.2	87.4	174.1	-61.1	172.3	144.4	174.4	-6.6	116.4
211	N	40.2	Very low	43.7	Very low	165 Å²	165	149.2 Å²	149.2	88%	0.882	76%	0.761	S	S	*	*				177.2	128.4	106.5	-88.9	-17.3	0	0	0	109.9
212	G	33.1	Very low	45.6	Very low	79 Å²	79	145 Å²	145	81%	0.814	74%	0.743	S	S	*	*			trans	-80.2	121.6	-179.2	0	0	0	0	0	112.3
213	I	43.1	Very low	47.8	Very low	147 Å²	147	139 Å²	139	75%	0.754	71%	0.71	S	S	*	*			trans	-143.7	103	142.5	-56.9	-176.5	0	0	0	104.8	E215	I213-E215 VanDerWaalsContact C-N 3.32Å; I213-E215 HydrophobicContact CG2-CG 4.02Å; I213-E215 PolarHBondContact O-N 3.24Å; I213-E215 VanDerWaalsContact O-N 3.09Å
214	R	33.2	Very low	50.1	Low	251 Å²	251	131.8 Å²	131.8	95%	0.947	69%	0.685	S	S	*	*			trans	-76.8	88.8	169.6	-95.3	178.2	152.8	-174.9	-5.5	107.2	Q216	R214-Q216 PolarHBondContact O-N 2.75Å
215	E	37.2	Very low	52.6	Low	154 Å²	154	127.8 Å²	127.8	72%	0.72	68%	0.676	S	S	*	*			trans	-67.5	114.4	163.2	-71.8	-172.9	164.1	0	0	108.1	I213 S217	I213-E215 VanDerWaalsContact C-N 3.32Å; I213-E215 HydrophobicContact CG2-CG 4.02Å; I213-E215 PolarHBondContact O-N 3.24Å; I213-E215 VanDerWaalsContact O-N 3.09Å; E215-S217 PolarHBondContact O-N 3.09Å
216	Q	35	Very low	55.3	Low	203 Å²	203	123.1 Å²	123.1	95%	0.949	64%	0.643	S	S	*	*			trans	-80.4	38.4	178.7	-132.1	167.5	25	0	0	110.5	R214 D218	R214-Q216 PolarHBondContact O-N 2.75Å; Q216-D218 PolarHBondContact O-N 2.85Å
217	S	35	Very low	58.1	Low	84 Å²	84	115.9 Å²	115.9	59%	0.587	61%	0.61	S	S	*	*			trans	-84.8	103	-175.6	42.2	0	0	0	0	110.6	E215 R219	E215-S217 PolarHBondContact O-N 3.09Å; S217-R219 PolarHBondContact O-N 3.02Å
218	D	42.5	Very low	60.9	Low	131 Å²	131	112.2 Å²	112.2	70%	0.701	58%	0.583	S	S	*	*			trans	52.8	67.6	143.7	-138.9	14.9	0	0	0	116.2	Q216 C220	Q216-D218 PolarHBondContact O-N 2.85Å; D218-C220 VanDerWaalsContact C-N 3.34Å; D218-C220 PolarHBondContact O-N 3.27Å
219	R	50.8	Low	63.7	Low	235 Å²	235	105.9 Å²	105.9	89%	0.887	54%	0.544	S	S	*	.			trans	-65.3	97.6	165	-79.3	-173.3	171.1	-172.6	-4.1	108.5	S217 D221	S217-R219 PolarHBondContact O-N 3.02Å; R219-D221 PolarHBondContact O-N 2.94Å
220	C	65	Low	66.5	Low	68 Å²	68	101.6 Å²	101.6	46%	0.459	51%	0.508	S	S	.	.			trans	-69.9	100.1	168.7	-161	0	0	0	0	108	K114 D218 I222	K114-C220 VanDerWaalsContact CE-SG 3.59Å; K114-C220 PolarHBondContact NZ-SG 3.12Å; K114-C220 VanDerWaalsContact NZ-SG 3.38Å; D218-C220 VanDerWaalsContact C-N 3.34Å; D218-C220 PolarHBondContact O-N 3.27Å; C220-I222 PolarHBondContact O-N 2.97Å
221	D	81.3	Confident	69.3	Low	73 Å²	73	90.8 Å²	90.8	39%	0.39	47%	0.468	S	S	.	.			trans	-62.2	124.2	175.8	-71.8	-30.6	0	0	0	109.6	P194 R219 Y223	P194-D221 HydrophobicContact CB-CB 4.01Å; P194-D221 HydrophobicContact CG-CB 3.8Å; R219-D221 PolarHBondContact O-N 2.94Å; D221-Y223 HydrophobicContact CB-CE2 4.05Å; D221-Y223 WeakPolarHBondContact CB-OH 3.31Å; D221-Y223 WeakPolarHBondContact O-CE2 3.49Å
222	I	90.2	Very high	72	Confident	74 Å²	74	83 Å²	83	38%	0.379	43%	0.426	S	S	.	.			trans	-102.6	129.2	177.1	-59.1	173.5	0	0	0	107.4	P194 R195 C220	P194-I222 CarbonylContact C-O 3.54Å; P194-I222 WeakPolarHBondContact CA-O 3.49Å; R195-I222 WeakPolarHBondContact CB-O 3.46Å; R195-I222 PolarHBondContact N-O 3.27Å; C220-I222 PolarHBondContact O-N 2.97Å
223	Y	94	Very high	75.1	Confident	22 Å²	22	79.2 Å²	79.2	9%	0.086	39%	0.387	C	S	.	.			trans	-105.8	162.9	180	-55.5	-83.3	0	0	0	111.1	D116 N118 L136 P192 P194 D221	D116-Y223 PolarHBondContact O-N 3.44Å; N118-Y223 HydrophobicContact CB-CD2 4Å; L136-Y223 HydrophobicContact CD1-CE1 3.56Å; L136-Y223 WeakPolarHBondContact CD1-OH 2.95Å; L136-Y223 HydrophobicContact CD2-CE1 4.1Å; L136-Y223 HydrophobicContact CD2-CE2 4.09Å; L136-Y223 HydrophobicContact CG-CE1 4.46Å; P192-Y223 WeakPolarHBondContact O-CE1 3.43Å; P194-Y223 HydrophobicContact CG-CE1 4Å; D221-Y223 HydrophobicContact CB-CE2 4.05Å; D221-Y223 WeakPolarHBondContact CB-OH 3.31Å; D221-Y223 WeakPolarHBondContact O-CE2 3.49Å
224	E	95.5	Very high	77.7	Confident	62 Å²	62	72.2 Å²	72.2	29%	0.29	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-70.3	141.1	172.3	-64.6	-60.3	157.2	0	0	111.2	R139 I189 R195	R139-E224 PolarHBondContact NH2-O 3.44Å; I189-E224 HydrophobicContact CB-CB 3.85Å; I189-E224 HydrophobicContact CB-CG 4.42Å; I189-E224 HydrophobicContact CG2-CB 4.13Å; I189-E224 HydrophobicContact CG2-CG 4.25Å; R195-E224 VanDerWaalsContact CD-OE1 3.23Å; R195-E224 WeakPolarHBondContact CD-OE1 3.23Å; R195-E224 VanDerWaalsContact CG-OE1 3.31Å; R195-E224 WeakPolarHBondContact CG-OE1 3.22Å; R195-E224 IonicContact CZ-OE1 3.72Å; R195-E224 IonicContact NE-OE1 2.77Å; R195-E224 IonicContact NH1-OE1 2.8Å; R195-E224 IonicContact NH1-OE2 3.49Å; R195-E224 PolarHBondContact NH1-OE2 3.39Å
225	S	95	Very high	80.8	Confident	83 Å²	83	60.2 Å²	60.2	58%	0.58	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-67.2	146.7	173.9	-58.2	0	0	0	0	110.9
226	L	96.9	Very high	83.7	Confident	12 Å²	12	53.1 Å²	53.1	6%	0.063	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-101.4	144.6	-174.4	-60.3	179.2	0	0	0	111.8	L120 L121 L142 H230	L120-L226 HydrophobicContact CB-CD1 4.29Å; L120-L226 HydrophobicContact CD2-CB 4.02Å; L120-L226 HydrophobicContact CD2-CD1 3.87Å; L121-L226 HydrophobicContact CD1-CD1 4.06Å; L121-L226 HydrophobicContact CD2-CD1 4.32Å; L121-L226 HydrophobicContact CG-CD1 3.97Å; L142-L226 HydrophobicContact CD2-CD1 3.92Å; L142-L226 HydrophobicContact CD2-CD2 4.44Å; L226-H230 HydrophobicContact CB-CB 3.83Å; L226-H230 HydrophobicContact CD1-CB 4.36Å; L226-H230 HydrophobicContact CD2-CB 4.44Å; L226-H230 HydrophobicContact CG-CB 4.43Å
227	D	95.2	Very high	86.6	Confident	48 Å²	48	43.5 Å²	43.5	26%	0.257	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-93.7	172.3	178.4	-172.1	28.6	0	0	0	113.9	L186 L229 H230 V231	L186-D227 HydrophobicContact CD2-CB 3.99Å; D227-L229 VanDerWaalsContact C-N 3.25Å; D227-L229 PolarHBondContact O-N 3.25Å; D227-H230 PolarHBondContact N-ND1 3.1Å; D227-H230 WeakPolarHBondContact O-CA 3.45Å; D227-H230 WeakPolarHBondContact O-CB 3.33Å; D227-H230 PolarHBondContact O-N 2.97Å; D227-H230 PolarHBondContact O-ND1 3.45Å; D227-V231 PolarHBondContact O-N 3.43Å
228	Q	96.7	Very high	89.5	Confident	15 Å²	15	39.5 Å²	39.5	7%	0.07	20%	0.2	C	C	.	.	H	α-helix	trans	-54	-36.9	-179	-66.8	165.4	67.9	0	0	113.4	H230 V231 F232 L262 F263 Y267 H323 F324	Q228-H230 PolarHBondContact O-N 3.06Å; Q228-V231 WeakPolarHBondContact O-CB 3.41Å; Q228-V231 PolarHBondContact O-N 2.8Å; Q228-V231 VanDerWaalsContact O-N 3.1Å; Q228-F232 PolarHBondContact O-N 3.33Å; Q228-F232 VanDerWaalsContact O-N 3.08Å; Q228-L262 VanDerWaalsContact CD-CB 3.41Å; Q228-L262 HydrophobicContact CG-CB 4.49Å; Q228-L262 PolarHBondContact OE1-O 2.7Å; Q228-L262 VanDerWaalsContact OE1-O 3.14Å; Q228-F263 HydrophobicContact CB-CD1 4.43Å; Q228-F263 HydrophobicContact CB-CE1 4.39Å; Q228-F263 HydrophobicContact CG-CD1 3.63Å; Q228-F263 HydrophobicContact CG-CE1 3.81Å; Q228-F263 HydrophobicContact CG-CG 4.18Å; Q228-F263 HydrophobicContact CG-CZ 4.46Å; Q228-F263 VanDerWaalsContact N-CE1 3.33Å; Q228-Y267 HydrophobicContact CB-CE1 4.46Å; Q228-H323 PolarHBondContact OE1-CE1 2.72Å; Q228-F324 HydrophobicContact CB-CE2 4.18Å; Q228-F324 HydrophobicContact CB-CZ 4.13Å
229	L	97.8	Very high	92	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-57.7	-35.5	174.7	175.8	61.1	0	0	0	111.7	W159 W183 L186 D227 F232 A233 F324	W159-L229 HydrophobicContact CB-CD1 3.93Å; W159-L229 HydrophobicContact CB-CD2 4.37Å; W159-L229 HydrophobicContact CG-CD1 4.43Å; W159-L229 HydrophobicContact CG-CD2 4.12Å; W183-L229 HydrophobicContact CE3-CD2 4.03Å; W183-L229 HydrophobicContact CH2-CD2 4.19Å; W183-L229 HydrophobicContact CZ3-CD2 3.43Å; W183-L229 VanDerWaalsContact CZ3-CD2 3.43Å; L186-L229 HydrophobicContact CB-CD2 4.27Å; L186-L229 HydrophobicContact CD1-CD2 3.88Å; D227-L229 VanDerWaalsContact C-N 3.25Å; D227-L229 PolarHBondContact O-N 3.25Å; L229-F232 WeakPolarHBondContact O-CB 3.37Å; L229-F232 PolarHBondContact O-N 3.09Å; L229-A233 WeakPolarHBondContact O-CB 3.31Å; L229-A233 PolarHBondContact O-N 2.91Å; L229-F324 HydrophobicContact CB-CZ 4.32Å
230	H	98.4	Very high	94.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-71.5	-32.8	178.6	-57.5	92.4	0	0	0	111.9	L120 L142 L186 L226 D227 Q228 F232 A233 L234	L120-H230 HydrophobicContact CD2-CB 4.41Å; L142-H230 HydrophobicContact CD1-CB 4.45Å; L142-H230 VanDerWaalsContact CD1-O 3.26Å; L142-H230 WeakPolarHBondContact CD1-O 3.46Å; L142-H230 HydrophobicContact CD2-CB 4.08Å; L186-H230 PolarHBondContact O-CE1 3.06Å; L186-H230 PolarHBondContact O-NE2 3.17Å; L226-H230 HydrophobicContact CB-CB 3.83Å; L226-H230 HydrophobicContact CD1-CB 4.36Å; L226-H230 HydrophobicContact CD2-CB 4.44Å; L226-H230 HydrophobicContact CG-CB 4.43Å; D227-H230 PolarHBondContact N-ND1 3.1Å; D227-H230 WeakPolarHBondContact O-CA 3.45Å; D227-H230 WeakPolarHBondContact O-CB 3.33Å; D227-H230 PolarHBondContact O-N 2.97Å; D227-H230 PolarHBondContact O-ND1 3.45Å; Q228-H230 PolarHBondContact O-N 3.06Å; H230-F232 VanDerWaalsContact C-N 3.33Å; H230-A233 PolarHBondContact O-N 3.33Å; H230-L234 WeakPolarHBondContact O-CB 3.47Å; H230-L234 PolarHBondContact O-N 2.79Å
231	V	98.6	Very high	95.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.7	-45.4	170.5	-176.2	0	0	0	0	109.9	L120 D227 Q228 L234 A235 I242 I244 F263 Y267 F291	L120-V231 HydrophobicContact CD1-CG2 4.08Å; L120-V231 HydrophobicContact CD2-CG2 3.87Å; D227-V231 PolarHBondContact O-N 3.43Å; Q228-V231 WeakPolarHBondContact O-CB 3.41Å; Q228-V231 PolarHBondContact O-N 2.8Å; Q228-V231 VanDerWaalsContact O-N 3.1Å; V231-L234 WeakPolarHBondContact O-CB 3.23Å; V231-L234 PolarHBondContact O-N 3.13Å; V231-A235 PolarHBondContact O-N 3.27Å; V231-I242 HydrophobicContact CG1-CB 4.41Å; V231-I242 HydrophobicContact CG1-CD1 4.31Å; V231-I242 HydrophobicContact CG1-CG2 4.08Å; V231-I244 HydrophobicContact CB-CD1 4.38Å; V231-I244 HydrophobicContact CG1-CD1 3.56Å; V231-I244 HydrophobicContact CG1-CG1 4.38Å; V231-I244 HydrophobicContact CG2-CD1 3.95Å; V231-F263 HydrophobicContact CG2-CD1 4.21Å; V231-F263 HydrophobicContact CG2-CE1 4.37Å; V231-Y267 HydrophobicContact CB-CD1 4.02Å; V231-Y267 HydrophobicContact CB-CD2 4.43Å; V231-Y267 HydrophobicContact CB-CE1 3.89Å; V231-Y267 HydrophobicContact CB-CE2 4.31Å; V231-Y267 HydrophobicContact CB-CG 4.29Å; V231-Y267 HydrophobicContact CG1-CD1 3.82Å; V231-Y267 HydrophobicContact CG1-CD2 3.5Å; V231-Y267 VanDerWaalsContact CG1-CD2 3.5Å; V231-Y267 HydrophobicContact CG1-CE1 4Å; V231-Y267 HydrophobicContact CG1-CE2 3.68Å; V231-Y267 HydrophobicContact CG1-CG 3.57Å; V231-F291 HydrophobicContact CG2-CZ 4.49Å
232	F	98.4	Very high	96.6	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.7	-45.2	177.1	-172.1	-119.9	0	0	0	112.3	L155 R158 Q228 L229 H230 L234 A235 H236 Y267 L268 L270 F324	L155-F232 HydrophobicContact CD2-CD1 3.65Å; L155-F232 HydrophobicContact CD2-CE1 3.41Å; L155-F232 VanDerWaalsContact CD2-CE1 3.41Å; L155-F232 HydrophobicContact CD2-CZ 4.46Å; R158-F232 HydrophobicContact CB-CE1 4.45Å; Q228-F232 PolarHBondContact O-N 3.33Å; Q228-F232 VanDerWaalsContact O-N 3.08Å; L229-F232 WeakPolarHBondContact O-CB 3.37Å; L229-F232 PolarHBondContact O-N 3.09Å; H230-F232 VanDerWaalsContact C-N 3.33Å; F232-L234 VanDerWaalsContact C-N 3.32Å; F232-L234 PolarHBondContact O-N 2.96Å; F232-A235 WeakPolarHBondContact O-CB 3.26Å; F232-A235 PolarHBondContact O-N 3.32Å; F232-H236 AromaticContact CD1-CE1 3.96Å; F232-H236 AromaticContact CE1-CE1 3.56Å; F232-H236 AromaticContact CE2-CE1 3.66Å; F232-H236 AromaticContact CZ-CE1 3.4Å; F232-H236 VanDerWaalsContact CZ-CE1 3.4Å; F232-H236 WeakPolarHBondContact CZ-CE1 3.28Å; F232-H236 PolarHBondContact O-N 3.46Å; F232-H236 PolarHBondContact O-ND1 3.29Å; F232-Y267 HydrophobicContact CB-CD1 3.96Å; F232-Y267 HydrophobicContact CD2-CD1 4.4Å; F232-L268 WeakPolarHBondContact CE2-O 3.4Å; F232-L270 HydrophobicContact CE2-CD1 4.42Å; F232-L270 HydrophobicContact CZ-CD1 4.49Å; F232-F324 HydrophobicContact CB-CD2 3.43Å; F232-F324 VanDerWaalsContact CB-CD2 3.43Å; F232-F324 HydrophobicContact CB-CE2 3.75Å; F232-F324 HydrophobicContact CB-CG 4.35Å; F232-F324 HydrophobicContact CD1-CB 3.85Å; F232-F324 AromaticContact CD1-CD2 3.9Å; F232-F324 HydrophobicContact CD1-CD2 3.9Å; F232-F324 AromaticContact CD1-CG 3.98Å; F232-F324 HydrophobicContact CD1-CG 3.98Å; F232-F324 HydrophobicContact CD2-CB 3.93Å; F232-F324 AromaticContact CD2-CD2 3.85Å; F232-F324 HydrophobicContact CD2-CD2 3.85Å; F232-F324 HydrophobicContact CD2-CG 4.32Å; F232-F324 HydrophobicContact CE1-CB 3.7Å; F232-F324 HydrophobicContact CE1-CG 4.32Å; F232-F324 HydrophobicContact CE2-CB 3.76Å; F232-F324 HydrophobicContact CG-CB 3.96Å; F232-F324 AromaticContact CG-CD2 3.47Å; F232-F324 HydrophobicContact CG-CD2 3.47Å; F232-F324 VanDerWaalsContact CG-CD2 3.47Å; F232-F324 HydrophobicContact CG-CE2 4.27Å; F232-F324 AromaticContact CG-CG 3.98Å; F232-F324 HydrophobicContact CG-CG 3.98Å; F232-F324 HydrophobicContact CZ-CB 3.65Å
233	A	98	Very high	97	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-63	-39.1	174.8	0	0	0	0	0	111.6	L142 L145 L146 L155 L229 H230 A235 H236 V237	L142-A233 HydrophobicContact CD1-CB 3.67Å; L145-A233 HydrophobicContact CD2-CB 4.07Å; L145-A233 VanDerWaalsContact CD2-O 3.27Å; L145-A233 WeakPolarHBondContact CD2-O 3.11Å; L146-A233 HydrophobicContact CD2-CB 3.95Å; L146-A233 HydrophobicContact CG-CB 4.27Å; L155-A233 HydrophobicContact CD1-CB 4.34Å; L229-A233 WeakPolarHBondContact O-CB 3.31Å; L229-A233 PolarHBondContact O-N 2.91Å; H230-A233 PolarHBondContact O-N 3.33Å; A233-A235 PolarHBondContact O-N 2.81Å; A233-H236 WeakPolarHBondContact O-CB 3.47Å; A233-H236 PolarHBondContact O-N 2.97Å; A233-H236 VanDerWaalsContact O-N 3.11Å; A233-V237 PolarHBondContact O-N 2.89Å
234	L	98.1	Very high	97.3	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61	-43.5	175.1	-177.3	62.1	0	0	0	111.4	L120 L121 A124 L142 H230 V231 F232 H236 V237 L238 I242	L120-L234 HydrophobicContact CD1-CD2 4.31Å; L120-L234 HydrophobicContact CD2-CD2 4.46Å; L120-L234 HydrophobicContact CG-CD2 4.14Å; L121-L234 HydrophobicContact CD2-CD1 3.8Å; L121-L234 HydrophobicContact CD2-CD2 3.72Å; L121-L234 HydrophobicContact CD2-CG 4.32Å; A124-L234 HydrophobicContact CB-CD2 3.84Å; L142-L234 HydrophobicContact CD1-CB 3.99Å; H230-L234 WeakPolarHBondContact O-CB 3.47Å; H230-L234 PolarHBondContact O-N 2.79Å; V231-L234 WeakPolarHBondContact O-CB 3.23Å; V231-L234 PolarHBondContact O-N 3.13Å; F232-L234 VanDerWaalsContact C-N 3.32Å; F232-L234 PolarHBondContact O-N 2.96Å; L234-H236 PolarHBondContact O-N 2.9Å; L234-H236 VanDerWaalsContact O-N 3.16Å; L234-V237 WeakPolarHBondContact O-CB 3.38Å; L234-V237 PolarHBondContact O-N 3.48Å; L234-L238 HydrophobicContact CD1-CD1 4.08Å; L234-L238 HydrophobicContact CD1-CD2 4.22Å; L234-L238 HydrophobicContact CD1-CG 3.98Å; L234-L238 HydrophobicContact CG-CD1 3.91Å; L234-L238 HydrophobicContact CG-CG 4.19Å; L234-L238 VanDerWaalsContact O-CG 3.31Å; L234-L238 WeakPolarHBondContact O-CG 3.43Å; L234-L238 PolarHBondContact O-N 2.97Å; L234-I242 HydrophobicContact CB-CD1 4.12Å; L234-I242 HydrophobicContact CD2-CD1 3.96Å; L234-I242 HydrophobicContact CG-CD1 3.9Å
235	A	98	Very high	97.4	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-54.7	-36.8	175.2	0	0	0	0	0	111.8	V231 F232 A233 K239 R240 I242 P269	V231-A235 PolarHBondContact O-N 3.27Å; F232-A235 WeakPolarHBondContact O-CB 3.26Å; F232-A235 PolarHBondContact O-N 3.32Å; A233-A235 PolarHBondContact O-N 2.81Å; A235-K239 WeakPolarHBondContact O-CA 3.36Å; A235-K239 PolarHBondContact O-N 3.46Å; A235-R240 WeakPolarHBondContact CA-O 3.32Å; A235-R240 PolarHBondContact O-N 2.88Å; A235-R240 VanDerWaalsContact O-N 3.09Å; A235-I242 HydrophobicContact CB-CD1 4.01Å; A235-I242 HydrophobicContact CB-CG1 4.02Å; A235-P269 WeakPolarHBondContact O-CB 3.46Å
236	H	96.7	Very high	97.5	Very high	4 Å²	4	6.3 Å²	6.3	2%	0.019	3%	0.032	C	C	.	.	H	α-helix	trans	-73.2	-37.6	175	-67.1	81.4	0	0	0	113.7	L145 F232 A233 L234 L238 K239 P269 L270 E271	L145-H236 HydrophobicContact CD2-CB 3.83Å; F232-H236 AromaticContact CD1-CE1 3.96Å; F232-H236 AromaticContact CE1-CE1 3.56Å; F232-H236 AromaticContact CE2-CE1 3.66Å; F232-H236 AromaticContact CZ-CE1 3.4Å; F232-H236 VanDerWaalsContact CZ-CE1 3.4Å; F232-H236 WeakPolarHBondContact CZ-CE1 3.28Å; F232-H236 PolarHBondContact O-N 3.46Å; F232-H236 PolarHBondContact O-ND1 3.29Å; A233-H236 WeakPolarHBondContact O-CB 3.47Å; A233-H236 PolarHBondContact O-N 2.97Å; A233-H236 VanDerWaalsContact O-N 3.11Å; L234-H236 PolarHBondContact O-N 2.9Å; L234-H236 VanDerWaalsContact O-N 3.16Å; H236-L238 VanDerWaalsContact C-N 3.28Å; H236-L238 PolarHBondContact O-N 3.23Å; H236-K239 PolarHBondContact O-N 3.07Å; H236-P269 VanDerWaalsContact NE2-C 3.32Å; H236-L270 PolarHBondContact NE2-N 3.03Å; H236-E271 WeakPolarHBondContact NE2-CB 3.44Å; H236-E271 PolarHBondContact NE2-N 2.84Å
237	V	96	Very high	97.3	Very high	1 Å²	1	6.6 Å²	6.6	1%	0.006	3%	0.033	C	C	.	.	H	α-helix	trans	-60.3	-42.3	173.9	171.7	0	0	0	0	110.4	V54 A141 L145 A233 L234	V54-V237 HydrophobicContact CB-CG1 4.39Å; V54-V237 HydrophobicContact CG2-CG1 3.94Å; A141-V237 HydrophobicContact CB-CG1 3.7Å; L145-V237 HydrophobicContact CB-CG2 4.24Å; L145-V237 HydrophobicContact CD2-CG2 3.79Å; A233-V237 PolarHBondContact O-N 2.89Å; L234-V237 WeakPolarHBondContact O-CB 3.38Å; L234-V237 PolarHBondContact O-N 3.48Å
238	L	95.6	Very high	97	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-10.5	-178.5	-54.5	-179.3	0	0	0	113.5	T56 M128 L138 L234 H236 R240 I242 L282	T56-L238 HydrophobicContact CG2-CB 4.17Å; T56-L238 HydrophobicContact CG2-CD2 3.61Å; T56-L238 HydrophobicContact CG2-CG 4.46Å; T56-L238 PolarHBondContact OG1-O 2.88Å; T56-L238 VanDerWaalsContact OG1-O 3.12Å; M128-L238 HydrophobicContact CE-CD1 3.98Å; M128-L238 HydrophobicContact CE-CD2 3.62Å; M128-L238 HydrophobicContact CE-CG 4.44Å; M128-L238 HydrophobicContact SD-CD1 4.06Å; M128-L238 HydrophobicContact SD-CD2 4.01Å; L138-L238 HydrophobicContact CD2-CD2 3.83Å; L234-L238 HydrophobicContact CD1-CD1 4.08Å; L234-L238 HydrophobicContact CD1-CD2 4.22Å; L234-L238 HydrophobicContact CD1-CG 3.98Å; L234-L238 HydrophobicContact CG-CD1 3.91Å; L234-L238 HydrophobicContact CG-CG 4.19Å; L234-L238 VanDerWaalsContact O-CG 3.31Å; L234-L238 WeakPolarHBondContact O-CG 3.43Å; L234-L238 PolarHBondContact O-N 2.97Å; H236-L238 VanDerWaalsContact C-N 3.28Å; H236-L238 PolarHBondContact O-N 3.23Å; L238-R240 HydrophobicContact CB-CB 3.94Å; L238-R240 WeakPolarHBondContact O-CB 3.18Å; L238-R240 PolarHBondContact O-N 2.91Å; L238-I242 HydrophobicContact CD1-CD1 4.34Å; L238-L282 HydrophobicContact CD1-CD2 3.88Å
239	K	96.4	Very high	96.7	Very high	35 Å²	35	7.6 Å²	7.6	15%	0.152	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	42.1	41.1	-165.3	-62.8	-166.7	179.3	-174.1	0	112.4	H53 A235 H236 E276 C277 H278	H53-K239 VanDerWaalsContact CD2-CE 3.41Å; H53-K239 WeakPolarHBondContact CD2-CE 3.33Å; H53-K239 WeakPolarHBondContact NE2-CD 3.46Å; A235-K239 WeakPolarHBondContact O-CA 3.36Å; A235-K239 PolarHBondContact O-N 3.46Å; H236-K239 PolarHBondContact O-N 3.07Å; K239-E276 HydrophobicContact CD-CB 4.31Å; K239-E276 WeakPolarHBondContact CD-O 3.39Å; K239-E276 IonicContact NZ-OE2 3.62Å; K239-E276 PolarHBondContact NZ-OE2 3.29Å; K239-C277 CarbonylContact O-C 3.58Å; K239-C277 WeakPolarHBondContact O-CA 3.28Å; K239-C277 VanDerWaalsContact O-CB 3.28Å; K239-C277 WeakPolarHBondContact O-CB 3.41Å; K239-H278 PolarHBondContact O-N 2.96Å
240	R	97.1	Very high	96.1	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.062	C	C	.	.	S	Bend	trans	-138.8	130.2	-172.6	-173.9	166.6	-179.5	-176.3	-9.4	109.4	P57 Y59 T60 A235 L238 H278 S280 P281	P57-R240 PolarHBondContact O-NH1 3.48Å; Y59-R240 PolarHBondContact O-NH1 3.3Å; T60-R240 PolarHBondContact OG1-NH2 3.01Å; A235-R240 WeakPolarHBondContact CA-O 3.32Å; A235-R240 PolarHBondContact O-N 2.88Å; A235-R240 VanDerWaalsContact O-N 3.09Å; L238-R240 HydrophobicContact CB-CB 3.94Å; L238-R240 WeakPolarHBondContact O-CB 3.18Å; L238-R240 PolarHBondContact O-N 2.91Å; R240-H278 HydrophobicContact CB-CB 4.18Å; R240-H278 HydrophobicContact CG-CB 3.95Å; R240-S280 WeakPolarHBondContact CG-O 3.24Å; R240-S280 PolarHBondContact NE-O 2.94Å; R240-S280 PolarHBondContact NH2-OG 2.96Å; R240-P281 PolarHBondContact NH2-O 3.46Å
241	P	98.3	Very high	95.4	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.089	C	C	.	.			trans	-53.7	140.4	171.2	-28.2	36.6	0	0	0	111.5	Y267 L268 H278 P281 L282 Y361 M362	P241-Y267 WeakPolarHBondContact CA-O 3.41Å; P241-L268 HydrophobicContact CB-CD2 3.8Å; P241-L268 HydrophobicContact CG-CD2 4.04Å; P241-H278 WeakPolarHBondContact CD-O 3.34Å; P241-P281 HydrophobicContact CB-CB 4.2Å; P241-P281 CarbonylContact O-C 3.48Å; P241-P281 VanDerWaalsContact O-CA 3.28Å; P241-P281 WeakPolarHBondContact O-CA 3.44Å; P241-L282 PolarHBondContact O-N 2.97Å; P241-Y361 WeakPolarHBondContact CG-O 3.35Å; P241-M362 HydrophobicContact CB-CG 3.76Å; P241-M362 HydrophobicContact CB-SD 3.77Å; P241-M362 HydrophobicContact CG-CG 3.7Å; P241-M362 HydrophobicContact CG-SD 4.4Å
242	I	98.7	Very high	94.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	128.3	173.2	-55.4	179.1	0	0	0	108.3	V231 L234 A235 L238 I244 Y267 L282 L284	V231-I242 HydrophobicContact CG1-CB 4.41Å; V231-I242 HydrophobicContact CG1-CD1 4.31Å; V231-I242 HydrophobicContact CG1-CG2 4.08Å; L234-I242 HydrophobicContact CB-CD1 4.12Å; L234-I242 HydrophobicContact CD2-CD1 3.96Å; L234-I242 HydrophobicContact CG-CD1 3.9Å; A235-I242 HydrophobicContact CB-CD1 4.01Å; A235-I242 HydrophobicContact CB-CG1 4.02Å; L238-I242 HydrophobicContact CD1-CD1 4.34Å; I242-I244 HydrophobicContact CG2-CD1 4.39Å; I242-I244 HydrophobicContact CG2-CG1 3.97Å; I242-Y267 PolarHBondContact N-O 2.89Å; I242-Y267 PolarHBondContact O-N 3.35Å; I242-L282 WeakPolarHBondContact CA-O 3.29Å; I242-L282 HydrophobicContact CD1-CD2 4.41Å; I242-L282 HydrophobicContact CG1-CB 4.39Å; I242-L282 HydrophobicContact CG1-CD2 4.34Å; I242-L284 HydrophobicContact CG2-CD1 3.89Å; I242-L284 HydrophobicContact CG2-CG 4.16Å
243	V	98.6	Very high	94.1	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.006	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	123.8	174.4	-178.6	0	0	0	0	108.2	I245 I266 P281 L282 V283 L284 I310 L320 M362	V243-I245 HydrophobicContact CG1-CD1 4.42Å; V243-I266 HydrophobicContact CG2-CG1 4.4Å; V243-P281 HydrophobicContact CG2-CB 3.8Å; V243-P281 HydrophobicContact CG2-CG 4.32Å; V243-L282 PolarHBondContact N-O 3Å; V243-V283 WeakPolarHBondContact O-CA 3.08Å; V243-L284 PolarHBondContact O-N 2.95Å; V243-I310 HydrophobicContact CB-CG1 4.48Å; V243-I310 HydrophobicContact CG1-CG1 3.78Å; V243-I310 HydrophobicContact CG1-CG2 4.47Å; V243-I310 HydrophobicContact CG2-CG2 4.37Å; V243-L320 HydrophobicContact CG1-CD1 4.2Å; V243-M362 HydrophobicContact CG2-SD 4.07Å
244	I	98.6	Very high	93.6	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	122.2	-179.4	-55.1	-162.6	0	0	0	110.1	V231 I242 F263 G264 G265 Y267 L284 F286 F291	V231-I244 HydrophobicContact CB-CD1 4.38Å; V231-I244 HydrophobicContact CG1-CD1 3.56Å; V231-I244 HydrophobicContact CG1-CG1 4.38Å; V231-I244 HydrophobicContact CG2-CD1 3.95Å; I242-I244 HydrophobicContact CG2-CD1 4.39Å; I242-I244 HydrophobicContact CG2-CG1 3.97Å; I244-F263 WeakPolarHBondContact CB-O 3.48Å; I244-F263 HydrophobicContact CG2-CB 4.41Å; I244-G264 WeakPolarHBondContact O-CA 3.4Å; I244-G265 PolarHBondContact N-O 3.39Å; I244-G265 PolarHBondContact O-N 3.27Å; I244-Y267 HydrophobicContact CB-CE2 4.4Å; I244-Y267 HydrophobicContact CD1-CD2 4.39Å; I244-Y267 HydrophobicContact CD1-CE2 3.89Å; I244-Y267 HydrophobicContact CG1-CD2 4.22Å; I244-Y267 HydrophobicContact CG1-CE2 3.95Å; I244-L284 WeakPolarHBondContact CA-O 3.36Å; I244-L284 HydrophobicContact CD1-CD1 4.39Å; I244-L284 HydrophobicContact CG1-CB 4.25Å; I244-F286 HydrophobicContact CG2-CB 4.01Å; I244-F291 HydrophobicContact CD1-CD1 4.46Å; I244-F291 HydrophobicContact CD1-CE1 3.87Å
245	I	98.1	Very high	92.8	Very high	12 Å²	12	32.9 Å²	32.9	6%	0.062	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	125.6	171.3	-56.8	-54.3	0	0	0	109.6	H95 L96 V243 L284 C285 F286 L294 I310 L320	H95-I245 HydrophobicContact CB-CG2 4.07Å; H95-I245 VanDerWaalsContact O-CG2 3.31Å; H95-I245 WeakPolarHBondContact O-CG2 3.48Å; L96-I245 HydrophobicContact CB-CG2 4.37Å; V243-I245 HydrophobicContact CG1-CD1 4.42Å; I245-L284 PolarHBondContact N-O 3.08Å; I245-C285 HydrophobicContact CB-CB 4.48Å; I245-C285 CarbonylContact O-C 3.59Å; I245-C285 WeakPolarHBondContact O-CA 3.26Å; I245-C285 VanDerWaalsContact O-CB 3.29Å; I245-C285 WeakPolarHBondContact O-CB 3.27Å; I245-F286 PolarHBondContact O-N 3.3Å; I245-L294 HydrophobicContact CB-CD1 4.12Å; I245-L294 HydrophobicContact CG1-CD1 4.02Å; I245-I310 HydrophobicContact CD1-CD1 3.84Å; I245-I310 HydrophobicContact CD1-CG1 4.37Å; I245-I310 HydrophobicContact CG1-CD1 3.82Å; I245-L320 HydrophobicContact CD1-CD1 4.43Å
246	A	96.7	Very high	92.2	Very high	3 Å²	3	37.7 Å²	37.7	3%	0.025	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	160.3	178.3	0	0	0	0	0	109.4	H95 I261 F286	H95-A246 PolarHBondContact CD2-O 3.19Å; A246-I261 HydrophobicContact CB-CG2 4.07Å; A246-F286 HydrophobicContact CB-CB 4.1Å; A246-F286 HydrophobicContact CB-CD1 4.43Å; A246-F286 WeakPolarHBondContact CB-O 3.48Å
247	D	92.5	Very high	91.7	Very high	18 Å²	18	39.1 Å²	39.1	10%	0.096	23%	0.227	C	C	.	.			trans	-60.7	158.4	159.3	-162.6	-14.9	0	0	0	108.8	H95 V249 I261	H95-D247 IonicContact CE1-OD1 3.12Å; H95-D247 PolarHBondContact CE1-OD1 3.25Å; H95-D247 IonicContact ND1-OD1 2.79Å; H95-D247 IonicContact NE2-OD1 3.33Å; D247-V249 PolarHBondContact OD1-N 3.11Å; D247-I261 HydrophobicContact CB-CD1 4Å; D247-I261 VanDerWaalsContact O-CB 3.31Å; D247-I261 WeakPolarHBondContact O-CB 3.37Å
248	T	90.4	Very high	91	Very high	57 Å²	57	42.3 Å²	42.3	35%	0.35	24%	0.241	S	C	.	.	S	Bend	trans	-90.5	-21.2	-178.7	54.7	0	0	0	0	112.6	P260 I261 Y314	T248-P260 WeakPolarHBondContact O-CA 3.49Å; T248-I261 PolarHBondContact O-N 3.43Å; T248-Y314 HydrophobicContact CG2-CE1 3.94Å
249	V	89.1	Confident	90.5	Very high	26 Å²	26	43.8 Å²	43.8	16%	0.158	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	134.1	-176.1	-67.7	0	0	0	0	112.2	D247 R251 A257 S259	D247-V249 PolarHBondContact OD1-N 3.11Å; V249-R251 HydrophobicContact CG2-CG 4.46Å; V249-A257 HydrophobicContact CB-CB 4.23Å; V249-A257 HydrophobicContact CG1-CB 4.36Å; V249-A257 HydrophobicContact CG2-CB 4.32Å; V249-S259 CarbonylContact C-O 3.57Å; V249-S259 WeakPolarHBondContact CA-O 3.46Å
250	L	85.2	Confident	90.1	Very high	81 Å²	81	43.8 Å²	43.8	42%	0.424	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	135	161.7	-67.9	173.7	0	0	0	108.7	F258 S259 I261	L250-F258 WeakPolarHBondContact O-CB 3.3Å; L250-F258 PolarHBondContact O-N 2.87Å; L250-S259 PolarHBondContact N-O 3.41Å; L250-S259 PolarHBondContact O-N 2.85Å; L250-I261 HydrophobicContact CD2-CD1 3.8Å; L250-I261 HydrophobicContact CD2-CG1 3.82Å; L250-I261 HydrophobicContact CG-CD1 4.09Å; L250-I261 HydrophobicContact CG-CG1 3.62Å
251	R	84.1	Confident	89.7	Confident	148 Å²	148	44.9 Å²	44.9	56%	0.558	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	141.9	178.2	-62.5	174.5	-172.3	-85.3	-2.8	110.1	V249 G255 E256	V249-R251 HydrophobicContact CG2-CG 4.46Å; R251-G255 PolarHBondContact NH1-O 2.91Å; R251-E256 CarbonylContact C-O 3.59Å; R251-E256 VanDerWaalsContact CA-O 3.29Å; R251-E256 WeakPolarHBondContact CA-O 3.42Å
252	D	84.8	Confident	89.4	Confident	44 Å²	44	48 Å²	48	24%	0.235	28%	0.276	C	S	.	.			trans	-78.4	178.1	172.4	70	22.2	0	0	0	111.6	S254 G255 E256 F258 R427	D252-S254 PolarHBondContact O-N 3.12Å; D252-S254 VanDerWaalsContact OD1-CA 3.32Å; D252-S254 WeakPolarHBondContact OD1-CA 3.45Å; D252-S254 WeakPolarHBondContact OD1-CB 3.47Å; D252-S254 PolarHBondContact OD1-N 3.14Å; D252-S254 PolarHBondContact OD1-OG 2.99Å; D252-S254 PolarHBondContact OD2-OG 3.22Å; D252-G255 PolarHBondContact O-N 3.4Å; D252-G255 PolarHBondContact OD1-N 2.6Å; D252-E256 PolarHBondContact N-O 3.36Å; D252-E256 PolarHBondContact OD1-N 3.12Å; D252-F258 HydrophobicContact CB-CB 4.42Å; D252-R427 IonicContact OD2-NH2 3.9Å
253	S	85.9	Confident	89.3	Confident	138 Å²	138	49.3 Å²	49.3	97%	0.965	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-16.3	178.6	62.4	0	0	0	0	114.8
254	S	86.7	Confident	89.2	Confident	85 Å²	85	49.6 Å²	49.6	59%	0.594	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-4.7	175	72.1	0	0	0	0	113.3	D252 E256	D252-S254 PolarHBondContact O-N 3.12Å; D252-S254 VanDerWaalsContact OD1-CA 3.32Å; D252-S254 WeakPolarHBondContact OD1-CA 3.45Å; D252-S254 WeakPolarHBondContact OD1-CB 3.47Å; D252-S254 PolarHBondContact OD1-N 3.14Å; D252-S254 PolarHBondContact OD1-OG 2.99Å; D252-S254 PolarHBondContact OD2-OG 3.22Å; S254-E256 VanDerWaalsContact C-N 3.31Å; S254-E256 WeakPolarHBondContact OG-CG 3.31Å
255	G	80.9	Confident	89.2	Confident	36 Å²	36	49.5 Å²	49.5	37%	0.371	29%	0.285	S	S	.	.	S	Bend	trans	87.1	-2.6	-176.7	0	0	0	0	0	114.1	R251 D252	R251-G255 PolarHBondContact NH1-O 2.91Å; D252-G255 PolarHBondContact O-N 3.4Å; D252-G255 PolarHBondContact OD1-N 2.6Å
256	E	85.3	Confident	89.2	Confident	102 Å²	102	49 Å²	49	48%	0.477	28%	0.282	S	S	.	.			trans	-75.5	142.5	-179.3	-69.8	-74.1	121.3	0	0	110.8	R251 D252 S254 F258	R251-E256 CarbonylContact C-O 3.59Å; R251-E256 VanDerWaalsContact CA-O 3.29Å; R251-E256 WeakPolarHBondContact CA-O 3.42Å; D252-E256 PolarHBondContact N-O 3.36Å; D252-E256 PolarHBondContact OD1-N 3.12Å; S254-E256 VanDerWaalsContact C-N 3.31Å; S254-E256 WeakPolarHBondContact OG-CG 3.31Å; E256-F258 PolarHBondContact O-N 3.18Å
257	A	86.2	Confident	89.3	Confident	33 Å²	33	48.8 Å²	48.8	27%	0.273	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	122.8	177.7	0	0	0	0	0	111	V249	V249-A257 HydrophobicContact CB-CB 4.23Å; V249-A257 HydrophobicContact CG1-CB 4.36Å; V249-A257 HydrophobicContact CG2-CB 4.32Å
258	F	82.5	Confident	89.6	Confident	69 Å²	69	48 Å²	48	30%	0.303	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-48.8	-175.5	178.3	-106.5	0	0	0	113	L250 D252 E256 L423 L430	L250-F258 WeakPolarHBondContact O-CB 3.3Å; L250-F258 PolarHBondContact O-N 2.87Å; D252-F258 HydrophobicContact CB-CB 4.42Å; E256-F258 PolarHBondContact O-N 3.18Å; F258-L423 HydrophobicContact CE2-CD2 3.62Å; F258-L423 HydrophobicContact CZ-CD2 3.65Å; F258-L430 VanDerWaalsContact C-CD1 3.45Å; F258-L430 WeakPolarHBondContact O-CD1 3.41Å
259	S	85.1	Confident	89.9	Confident	31 Å²	31	45.2 Å²	45.2	22%	0.217	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	147.4	-176.1	-176.7	0	0	0	0	110.2	V249 L250	V249-S259 CarbonylContact C-O 3.57Å; V249-S259 WeakPolarHBondContact CA-O 3.46Å; L250-S259 PolarHBondContact N-O 3.41Å; L250-S259 PolarHBondContact O-N 2.85Å
260	P	87.8	Confident	90.3	Very high	34 Å²	34	45 Å²	45	22%	0.221	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	149	173.9	30.5	-32.4	0	0	0	111	T248 L262 L430	T248-P260 WeakPolarHBondContact O-CA 3.49Å; P260-L262 HydrophobicContact CB-CD2 4.05Å; P260-L262 HydrophobicContact CG-CD2 4.15Å; P260-L430 HydrophobicContact CB-CD2 4.43Å
261	I	89.2	Confident	90.8	Very high	23 Å²	23	43.6 Å²	43.6	12%	0.118	25%	0.248	C	C	.	.			trans	-98.1	120.7	167.4	-61.7	168.1	0	0	0	107	A246 D247 T248 L250 F286	A246-I261 HydrophobicContact CB-CG2 4.07Å; D247-I261 HydrophobicContact CB-CD1 4Å; D247-I261 VanDerWaalsContact O-CB 3.31Å; D247-I261 WeakPolarHBondContact O-CB 3.37Å; T248-I261 PolarHBondContact O-N 3.43Å; L250-I261 HydrophobicContact CD2-CD1 3.8Å; L250-I261 HydrophobicContact CD2-CG1 3.82Å; L250-I261 HydrophobicContact CG-CD1 4.09Å; L250-I261 HydrophobicContact CG-CG1 3.62Å; I261-F286 HydrophobicContact CG2-CD1 3.74Å; I261-F286 HydrophobicContact CG2-CE1 3.84Å
262	L	91.2	Very high	91.2	Very high	66 Å²	66	36.8 Å²	36.8	35%	0.346	22%	0.223	S	C	.	.			trans	-100.7	-8.4	-169.4	-60.3	178.7	0	0	0	113.6	Q228 P260 G264 H323	Q228-L262 VanDerWaalsContact CD-CB 3.41Å; Q228-L262 HydrophobicContact CG-CB 4.49Å; Q228-L262 PolarHBondContact OE1-O 2.7Å; Q228-L262 VanDerWaalsContact OE1-O 3.14Å; P260-L262 HydrophobicContact CB-CD2 4.05Å; P260-L262 HydrophobicContact CG-CD2 4.15Å; L262-G264 VanDerWaalsContact C-N 3.34Å; L262-G264 PolarHBondContact O-N 2.86Å; L262-H323 PolarHBondContact O-CE1 3.49Å; L262-H323 PolarHBondContact O-NE2 3.04Å
263	F	96	Very high	91.7	Very high	28 Å²	28	36.7 Å²	36.7	12%	0.123	23%	0.226	C	C	.	.			trans	-70.7	-25.3	-179.9	-72.5	-75	0	0	0	114.5	Q228 V231 I244 G265 Y267 F286 F291	Q228-F263 HydrophobicContact CB-CD1 4.43Å; Q228-F263 HydrophobicContact CB-CE1 4.39Å; Q228-F263 HydrophobicContact CG-CD1 3.63Å; Q228-F263 HydrophobicContact CG-CE1 3.81Å; Q228-F263 HydrophobicContact CG-CG 4.18Å; Q228-F263 HydrophobicContact CG-CZ 4.46Å; Q228-F263 VanDerWaalsContact N-CE1 3.33Å; V231-F263 HydrophobicContact CG2-CD1 4.21Å; V231-F263 HydrophobicContact CG2-CE1 4.37Å; I244-F263 WeakPolarHBondContact CB-O 3.48Å; I244-F263 HydrophobicContact CG2-CB 4.41Å; F263-G265 PolarHBondContact O-N 3.25Å; F263-Y267 WeakPolarHBondContact O-CE2 3.2Å; F263-Y267 PolarHBondContact O-OH 3.04Å; F263-Y267 VanDerWaalsContact O-OH 3.1Å; F263-F286 HydrophobicContact CB-CB 4.25Å; F263-F286 HydrophobicContact CB-CD1 4.23Å; F263-F286 HydrophobicContact CB-CG 4.11Å; F263-F286 AromaticContact CD2-CD1 3.89Å; F263-F286 HydrophobicContact CD2-CD1 3.89Å; F263-F286 AromaticContact CD2-CD2 3.99Å; F263-F286 HydrophobicContact CD2-CD2 3.99Å; F263-F286 AromaticContact CD2-CE1 3.62Å; F263-F286 HydrophobicContact CD2-CE1 3.62Å; F263-F286 AromaticContact CD2-CE2 3.71Å; F263-F286 HydrophobicContact CD2-CE2 3.71Å; F263-F286 HydrophobicContact CD2-CG 4.05Å; F263-F286 AromaticContact CD2-CZ 3.5Å; F263-F286 HydrophobicContact CD2-CZ 3.5Å; F263-F286 VanDerWaalsContact CD2-CZ 3.5Å; F263-F286 HydrophobicContact CE2-CD2 4.41Å; F263-F286 HydrophobicContact CE2-CE1 4.17Å; F263-F286 AromaticContact CE2-CE2 3.75Å; F263-F286 HydrophobicContact CE2-CE2 3.75Å; F263-F286 AromaticContact CE2-CZ 3.59Å; F263-F286 HydrophobicContact CE2-CZ 3.59Å; F263-F286 HydrophobicContact CG-CD1 4.42Å; F263-F286 HydrophobicContact CG-CD2 4.31Å; F263-F286 HydrophobicContact CG-CE2 4.43Å; F263-F286 HydrophobicContact CG-CG 4.27Å; F263-F286 HydrophobicContact CZ-CE2 4.49Å; F263-F291 HydrophobicContact CD1-CE1 4.14Å; F263-F291 AromaticContact CD1-CZ 3.61Å; F263-F291 HydrophobicContact CD1-CZ 3.61Å; F263-F291 HydrophobicContact CD2-CZ 4.47Å; F263-F291 HydrophobicContact CE1-CE2 4.41Å; F263-F291 AromaticContact CE1-CZ 3.63Å; F263-F291 HydrophobicContact CE1-CZ 3.63Å; F263-F291 HydrophobicContact CE2-CZ 4.5Å; F263-F291 HydrophobicContact CG-CE1 4.39Å; F263-F291 HydrophobicContact CG-CZ 4.04Å; F263-F291 HydrophobicContact CZ-CZ 4.1Å
264	G	96.8	Very high	92.1	Very high	6 Å²	6	31.9 Å²	31.9	6%	0.062	19%	0.193	C	C	.	.			trans	-64.4	131.1	-178.7	0	0	0	0	0	111.5	I244 L262 H323	I244-G264 WeakPolarHBondContact O-CA 3.4Å; L262-G264 VanDerWaalsContact C-N 3.34Å; L262-G264 PolarHBondContact O-N 2.86Å; G264-H323 PolarHBondContact O-NE2 3.48Å
265	G	98	Very high	92.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	144.9	-164.5	179.3	0	0	0	0	0	114.8	I244 F263 P321	I244-G265 PolarHBondContact N-O 3.39Å; I244-G265 PolarHBondContact O-N 3.27Å; F263-G265 PolarHBondContact O-N 3.25Å; G265-P321 CarbonylContact C-O 3.46Å; G265-P321 VanDerWaalsContact CA-O 3.28Å; G265-P321 WeakPolarHBondContact CA-O 3.48Å
266	I	98.7	Very high	93	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	130.8	-176.4	-57.4	169.4	0	0	0	109	V243 L268 I312 L320 P321 L322 H323 I358 M362	V243-I266 HydrophobicContact CG2-CG1 4.4Å; I266-L268 HydrophobicContact CG2-CD2 3.7Å; I266-L268 HydrophobicContact CG2-CG 3.99Å; I266-I312 HydrophobicContact CD1-CB 4.09Å; I266-I312 HydrophobicContact CD1-CG2 4.15Å; I266-L320 HydrophobicContact CD1-CB 4.08Å; I266-L320 HydrophobicContact CG1-CB 4.08Å; I266-L320 HydrophobicContact CG1-CD1 4.28Å; I266-P321 PolarHBondContact N-O 3.44Å; I266-L322 HydrophobicContact CB-CD1 4.05Å; I266-L322 HydrophobicContact CG2-CD1 3.9Å; I266-H323 PolarHBondContact O-N 2.95Å; I266-I358 HydrophobicContact CD1-CD1 3.69Å; I266-I358 HydrophobicContact CD1-CG1 4.08Å; I266-M362 HydrophobicContact CD1-CE 4.19Å; I266-M362 HydrophobicContact CG2-CE 3.88Å
267	Y	98.8	Very high	93.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	111.6	176.6	-61	-96.6	0	0	0	109.1	Q228 V231 F232 P241 I242 I244 F263 H323 F324	Q228-Y267 HydrophobicContact CB-CE1 4.46Å; V231-Y267 HydrophobicContact CB-CD1 4.02Å; V231-Y267 HydrophobicContact CB-CD2 4.43Å; V231-Y267 HydrophobicContact CB-CE1 3.89Å; V231-Y267 HydrophobicContact CB-CE2 4.31Å; V231-Y267 HydrophobicContact CB-CG 4.29Å; V231-Y267 HydrophobicContact CG1-CD1 3.82Å; V231-Y267 HydrophobicContact CG1-CD2 3.5Å; V231-Y267 VanDerWaalsContact CG1-CD2 3.5Å; V231-Y267 HydrophobicContact CG1-CE1 4Å; V231-Y267 HydrophobicContact CG1-CE2 3.68Å; V231-Y267 HydrophobicContact CG1-CG 3.57Å; F232-Y267 HydrophobicContact CB-CD1 3.96Å; F232-Y267 HydrophobicContact CD2-CD1 4.4Å; P241-Y267 WeakPolarHBondContact CA-O 3.41Å; I242-Y267 PolarHBondContact N-O 2.89Å; I242-Y267 PolarHBondContact O-N 3.35Å; I244-Y267 HydrophobicContact CB-CE2 4.4Å; I244-Y267 HydrophobicContact CD1-CD2 4.39Å; I244-Y267 HydrophobicContact CD1-CE2 3.89Å; I244-Y267 HydrophobicContact CG1-CD2 4.22Å; I244-Y267 HydrophobicContact CG1-CE2 3.95Å; F263-Y267 WeakPolarHBondContact O-CE2 3.2Å; F263-Y267 PolarHBondContact O-OH 3.04Å; F263-Y267 VanDerWaalsContact O-OH 3.1Å; Y267-H323 HydrophobicContact CD1-CB 3.63Å; Y267-H323 HydrophobicContact CE1-CB 3.45Å; Y267-H323 VanDerWaalsContact CE1-CB 3.45Å; Y267-H323 AromaticContact CE1-CD2 3.75Å; Y267-H323 AromaticContact CE1-CG 3.55Å; Y267-H323 AromaticContact CE2-CD2 3.65Å; Y267-H323 HydrophobicContact CG-CB 4.33Å; Y267-H323 AromaticContact CZ-CD2 3.35Å; Y267-H323 AromaticContact CZ-CG 3.63Å; Y267-H323 AromaticContact CZ-NE2 3.86Å; Y267-H323 PolarHBondContact OH-CD2 2.79Å; Y267-H323 PolarHBondContact OH-NE2 2.83Å; Y267-F324 HydrophobicContact CD1-CD2 4.39Å; Y267-F324 HydrophobicContact CD1-CE2 4.48Å; Y267-F324 HydrophobicContact CE1-CD2 4.35Å; Y267-F324 HydrophobicContact CE1-CE2 4.06Å
268	L	98.5	Very high	93.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.184	C	C	.	.			trans	-102.8	143.1	-179.5	-59.4	-178.3	0	0	0	110.8	F232 P241 I266 L270 L322 L357 Y361 M362	F232-L268 WeakPolarHBondContact CE2-O 3.4Å; P241-L268 HydrophobicContact CB-CD2 3.8Å; P241-L268 HydrophobicContact CG-CD2 4.04Å; I266-L268 HydrophobicContact CG2-CD2 3.7Å; I266-L268 HydrophobicContact CG2-CG 3.99Å; L268-L270 HydrophobicContact CB-CD2 3.7Å; L268-L270 HydrophobicContact CB-CG 3.86Å; L268-L270 HydrophobicContact CD1-CD2 4.13Å; L268-L270 PolarHBondContact O-N 3.47Å; L268-L322 HydrophobicContact CD1-CD1 3.67Å; L268-L322 HydrophobicContact CG-CD1 3.72Å; L268-L357 HydrophobicContact CD1-CB 4.19Å; L268-Y361 HydrophobicContact CB-CG 4.43Å; L268-Y361 HydrophobicContact CD1-CD2 4.07Å; L268-Y361 HydrophobicContact CD1-CG 4.29Å; L268-Y361 HydrophobicContact CD2-CG 4.47Å; L268-M362 HydrophobicContact CD2-CE 4.49Å; L268-M362 HydrophobicContact CD2-CG 4.43Å; L268-M362 HydrophobicContact CD2-SD 4.49Å
269	P	97.4	Very high	94.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.182	C	C	.	.			trans	-75.7	62	174.5	32.4	-36.6	0	0	0	111.9	A235 H236 E271 C272 C277 Y361	A235-P269 WeakPolarHBondContact O-CB 3.46Å; H236-P269 VanDerWaalsContact NE2-C 3.32Å; P269-E271 PolarHBondContact O-N 3.1Å; P269-E271 VanDerWaalsContact O-N 3.1Å; P269-C272 HydrophobicContact CB-CB 4.33Å; P269-C272 VanDerWaalsContact O-CB 3.3Å; P269-C272 WeakPolarHBondContact O-CB 3.36Å; P269-C272 PolarHBondContact O-N 3.19Å; P269-C277 HydrophobicContact CG-CB 4.19Å; P269-C277 VanDerWaalsContact CG-SG 3.53Å; P269-Y361 HydrophobicContact CG-CD1 4.01Å; P269-Y361 HydrophobicContact CG-CE1 4.07Å
270	L	97.1	Very high	94.9	Very high	22 Å²	22	31.7 Å²	31.7	12%	0.115	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.9	-168.7	-63.8	174.2	0	0	0	114.9	F232 H236 L268 C272 L357 Y361	F232-L270 HydrophobicContact CE2-CD1 4.42Å; F232-L270 HydrophobicContact CZ-CD1 4.49Å; H236-L270 PolarHBondContact NE2-N 3.03Å; L268-L270 HydrophobicContact CB-CD2 3.7Å; L268-L270 HydrophobicContact CB-CG 3.86Å; L268-L270 HydrophobicContact CD1-CD2 4.13Å; L268-L270 PolarHBondContact O-N 3.47Å; L270-C272 VanDerWaalsContact C-N 3.27Å; L270-L357 HydrophobicContact CD2-CD2 4.27Å; L270-Y361 HydrophobicContact CD2-CD2 4.29Å; L270-Y361 HydrophobicContact CD2-CE2 3.74Å
271	E	95.3	Very high	95.4	Very high	50 Å²	50	30 Å²	30	23%	0.234	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	4.4	174	-57.6	-59	133.2	0	0	113.2	R151 A154 L155 R158 H236 P269	R151-E271 HydrophobicContact CB-CB 4.25Å; R151-E271 HydrophobicContact CG-CB 3.91Å; R151-E271 VanDerWaalsContact CZ-O 3.31Å; R151-E271 PolarHBondContact NE-O 3.22Å; R151-E271 PolarHBondContact NH2-O 3.19Å; A154-E271 HydrophobicContact CB-CG 3.95Å; A154-E271 WeakPolarHBondContact CB-OE2 3.42Å; L155-E271 HydrophobicContact CD2-CG 4.43Å; R158-E271 IonicContact CZ-OE1 3.35Å; R158-E271 IonicContact NE-OE1 3.93Å; R158-E271 PolarHBondContact NE-OE1 2.85Å; R158-E271 IonicContact NH2-OE1 3.01Å; R158-E271 PolarHBondContact NH2-OE1 3.32Å; H236-E271 WeakPolarHBondContact NE2-CB 3.44Å; H236-E271 PolarHBondContact NE2-N 2.84Å; P269-E271 PolarHBondContact O-N 3.1Å; P269-E271 VanDerWaalsContact O-N 3.1Å
272	C	94	Very high	95.8	Very high	6 Å²	6	29 Å²	29	4%	0.041	16%	0.159	C	C	.	.	S	Bend	trans	-108.3	151.1	170.7	-51.1	0	0	0	0	109.4	R151 P269 L270 C277 Y361	R151-C272 PolarHBondContact NH1-SG 2.93Å; R151-C272 PolarHBondContact NH2-SG 3.45Å; R151-C272 VanDerWaalsContact NH2-SG 3.41Å; P269-C272 HydrophobicContact CB-CB 4.33Å; P269-C272 VanDerWaalsContact O-CB 3.3Å; P269-C272 WeakPolarHBondContact O-CB 3.36Å; P269-C272 PolarHBondContact O-N 3.19Å; L270-C272 VanDerWaalsContact C-N 3.27Å; C272-C277 WeakPolarHBondContact CB-SG 3.44Å; C272-Y361 PolarHBondContact O-OH 3.17Å
273	S	94.1	Very high	96.1	Very high	42 Å²	42	25.9 Å²	25.9	29%	0.294	14%	0.143	S	C	.	.			trans	-67.7	141.3	168.6	69.4	0	0	0	0	109.7	S275 E276 C277	S273-S275 PolarHBondContact O-N 3.06Å; S273-S275 VanDerWaalsContact O-N 3.17Å; S273-S275 PolarHBondContact OG-OG 3.01Å; S273-S275 VanDerWaalsContact OG-OG 3.08Å; S273-E276 PolarHBondContact O-N 2.9Å; S273-E276 WeakPolarHBondContact OG-CB 3.5Å; S273-E276 WeakPolarHBondContact OG-CG 3.47Å; S273-E276 PolarHBondContact OG-N 3.48Å; S273-E276 PolarHBondContact OG-OE1 2.83Å; S273-C277 PolarHBondContact O-SG 3.25Å
274	S	94.8	Very high	96.3	Very high	37 Å²	37	24.5 Å²	24.5	26%	0.259	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	-62.6	-23.7	179.6	59.5	0	0	0	0	113	E276 C277 R360	S274-E276 VanDerWaalsContact C-N 3.3Å; S274-C277 PolarHBondContact O-N 3.28Å; S274-R360 WeakPolarHBondContact CB-O 3.37Å
275	S	94.4	Very high	96.3	Very high	106 Å²	106	24.3 Å²	24.3	74%	0.741	14%	0.135	S	C	*	.	G	3₁₀ helix	trans	-70.4	-22.6	173.5	47	0	0	0	0	114	S273	S273-S275 PolarHBondContact O-N 3.06Å; S273-S275 VanDerWaalsContact O-N 3.17Å; S273-S275 PolarHBondContact OG-OG 3.01Å; S273-S275 VanDerWaalsContact OG-OG 3.08Å
276	E	91.2	Very high	96.3	Very high	99 Å²	99	25.3 Å²	25.3	46%	0.463	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-91.8	-2.2	175.8	-73.2	167.9	-134.7	0	0	113	K239 S273 S274	K239-E276 HydrophobicContact CD-CB 4.31Å; K239-E276 WeakPolarHBondContact CD-O 3.39Å; K239-E276 IonicContact NZ-OE2 3.62Å; K239-E276 PolarHBondContact NZ-OE2 3.29Å; S273-E276 PolarHBondContact O-N 2.9Å; S273-E276 WeakPolarHBondContact OG-CB 3.5Å; S273-E276 WeakPolarHBondContact OG-CG 3.47Å; S273-E276 PolarHBondContact OG-N 3.48Å; S273-E276 PolarHBondContact OG-OE1 2.83Å; S274-E276 VanDerWaalsContact C-N 3.3Å
277	C	94.9	Very high	96.1	Very high	14 Å²	14	26 Å²	26	10%	0.095	14%	0.143	C	C	.	.	S	Bend	trans	-105.1	147.1	-173.2	-60.9	0	0	0	0	111.7	K239 P269 C272 S273 S274 Y361	K239-C277 CarbonylContact O-C 3.58Å; K239-C277 WeakPolarHBondContact O-CA 3.28Å; K239-C277 VanDerWaalsContact O-CB 3.28Å; K239-C277 WeakPolarHBondContact O-CB 3.41Å; P269-C277 HydrophobicContact CG-CB 4.19Å; P269-C277 VanDerWaalsContact CG-SG 3.53Å; C272-C277 WeakPolarHBondContact CB-SG 3.44Å; S273-C277 PolarHBondContact O-SG 3.25Å; S274-C277 PolarHBondContact O-N 3.28Å; C277-Y361 HydrophobicContact CB-CD1 4.32Å
278	H	94.6	Very high	95.7	Very high	53 Å²	53	31.1 Å²	31.1	25%	0.245	18%	0.175	C	C	.	.			trans	-65.7	141	163.9	-61.3	-64.3	0	0	0	109.6	T56 K239 R240 P241	T56-H278 PolarHBondContact O-CE1 3.03Å; T56-H278 PolarHBondContact O-NE2 3.31Å; T56-H278 PolarHBondContact OG1-CD2 2.95Å; T56-H278 VanDerWaalsContact OG1-CD2 3.24Å; T56-H278 PolarHBondContact OG1-NE2 2.96Å; K239-H278 PolarHBondContact O-N 2.96Å; R240-H278 HydrophobicContact CB-CB 4.18Å; R240-H278 HydrophobicContact CG-CB 3.95Å; P241-H278 WeakPolarHBondContact CD-O 3.34Å
279	R	95.1	Very high	95.3	Very high	68 Å²	68	34.6 Å²	34.6	26%	0.257	20%	0.203	S	C	.	.	S	Bend	trans	-97.5	-22.1	-178.3	-59.3	-179.4	62.7	71.7	7.3	113.7	T359 R360 Y361 M362 D363	R279-T359 PolarHBondContact NH2-O 3.49Å; R279-R360 PolarHBondContact NH1-O 2.98Å; R279-Y361 WeakPolarHBondContact CA-O 3.31Å; R279-M362 PolarHBondContact NH2-O 3.26Å; R279-M362 WeakPolarHBondContact O-CA 3.47Å; R279-D363 VanDerWaalsContact CB-OD2 3.31Å; R279-D363 WeakPolarHBondContact CB-OD2 3.42Å; R279-D363 IonicContact CZ-OD1 3.32Å; R279-D363 IonicContact NE-OD1 3.62Å; R279-D363 PolarHBondContact NE-OD1 2.93Å; R279-D363 IonicContact NE-OD2 3.13Å; R279-D363 IonicContact NH2-OD1 3.95Å; R279-D363 PolarHBondContact NH2-OD1 2.8Å; R279-D363 VanDerWaalsContact NH2-OD1 3.12Å
280	S	95.8	Very high	95.2	Very high	11 Å²	11	35.9 Å²	35.9	8%	0.077	21%	0.209	C	C	.	.	S	Bend	trans	-73.7	122.4	168.5	171.4	0	0	0	0	109.4	R240 E487	R240-S280 WeakPolarHBondContact CG-O 3.24Å; R240-S280 PolarHBondContact NE-O 2.94Å; R240-S280 PolarHBondContact NH2-OG 2.96Å; S280-E487 WeakPolarHBondContact OG-CB 3.32Å; S280-E487 PolarHBondContact OG-N 2.86Å
281	P	97.6	Very high	95.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-72.7	154.7	-179	30.1	-32.8	0	0	0	111.9	R240 P241 V243 V283 I310 M362 A484 K485	R240-P281 PolarHBondContact NH2-O 3.46Å; P241-P281 HydrophobicContact CB-CB 4.2Å; P241-P281 CarbonylContact O-C 3.48Å; P241-P281 VanDerWaalsContact O-CA 3.28Å; P241-P281 WeakPolarHBondContact O-CA 3.44Å; V243-P281 HydrophobicContact CG2-CB 3.8Å; V243-P281 HydrophobicContact CG2-CG 4.32Å; P281-V283 HydrophobicContact CG-CG2 4.22Å; P281-I310 HydrophobicContact CG-CG2 3.92Å; P281-M362 HydrophobicContact CB-SD 3.99Å; P281-M362 HydrophobicContact CG-SD 4.27Å; P281-A484 HydrophobicContact CG-CB 4Å; P281-K485 WeakPolarHBondContact CD-O 3.22Å
282	L	97.9	Very high	95.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	122.8	158.3	170.3	66.3	0	0	0	107.6	A124 M128 L238 P241 I242 V243 L284	A124-L282 HydrophobicContact CB-CD2 3.65Å; M128-L282 HydrophobicContact CG-CD1 4.34Å; L238-L282 HydrophobicContact CD1-CD2 3.88Å; P241-L282 PolarHBondContact O-N 2.97Å; I242-L282 WeakPolarHBondContact CA-O 3.29Å; I242-L282 HydrophobicContact CD1-CD2 4.41Å; I242-L282 HydrophobicContact CG1-CB 4.39Å; I242-L282 HydrophobicContact CG1-CD2 4.34Å; V243-L282 PolarHBondContact N-O 3Å; L282-L284 HydrophobicContact CD1-CD2 4.15Å; L282-L284 HydrophobicContact CD2-CD2 4.28Å; L282-L284 HydrophobicContact CG-CD2 4.03Å; L282-L284 HydrophobicContact CG-CG 4.32Å
283	V	98.3	Very high	95.5	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	124.9	-176.2	-166.4	0	0	0	0	110	L108 V243 P281 L294 I310 I486	L108-V283 HydrophobicContact CD1-CG1 4.16Å; V243-V283 WeakPolarHBondContact O-CA 3.08Å; P281-V283 HydrophobicContact CG-CG2 4.22Å; V283-L294 HydrophobicContact CB-CB 4.17Å; V283-L294 HydrophobicContact CG1-CB 3.87Å; V283-L294 HydrophobicContact CG1-CD1 3.87Å; V283-L294 HydrophobicContact CG1-CG 4.48Å; V283-L294 PolarHBondContact O-N 2.91Å; V283-I310 HydrophobicContact CG1-CB 4.38Å; V283-I310 HydrophobicContact CG1-CD1 3.98Å; V283-I310 HydrophobicContact CG1-CG1 3.9Å; V283-I310 HydrophobicContact CG2-CB 4.18Å; V283-I310 HydrophobicContact CG2-CG1 4.48Å; V283-I310 HydrophobicContact CG2-CG2 3.9Å; V283-I486 HydrophobicContact CG2-CD1 3.81Å; V283-I486 HydrophobicContact CG2-CG1 4.06Å
284	L	98.5	Very high	95.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	162.9	178.8	-51.9	179.6	0	0	0	109.9	L120 A123 I242 V243 I244 I245 L282 S292 A293	L120-L284 HydrophobicContact CD1-CD1 3.81Å; A123-L284 HydrophobicContact CB-CD2 3.96Å; I242-L284 HydrophobicContact CG2-CD1 3.89Å; I242-L284 HydrophobicContact CG2-CG 4.16Å; V243-L284 PolarHBondContact O-N 2.95Å; I244-L284 WeakPolarHBondContact CA-O 3.36Å; I244-L284 HydrophobicContact CD1-CD1 4.39Å; I244-L284 HydrophobicContact CG1-CB 4.25Å; I245-L284 PolarHBondContact N-O 3.08Å; L282-L284 HydrophobicContact CD1-CD2 4.15Å; L282-L284 HydrophobicContact CD2-CD2 4.28Å; L282-L284 HydrophobicContact CG-CD2 4.03Å; L282-L284 HydrophobicContact CG-CG 4.32Å; L284-S292 CarbonylContact C-O 3.54Å; L284-S292 VanDerWaalsContact CA-O 3.27Å; L284-S292 WeakPolarHBondContact CA-O 3.31Å; L284-A293 HydrophobicContact CD2-CB 4.43Å
285	C	98.2	Very high	95.8	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.007	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	154.5	161.7	69.3	0	0	0	0	111.9	L90 I245 F291 S292 L294	L90-C285 HydrophobicContact CD1-CB 3.58Å; I245-C285 HydrophobicContact CB-CB 4.48Å; I245-C285 CarbonylContact O-C 3.59Å; I245-C285 WeakPolarHBondContact O-CA 3.26Å; I245-C285 VanDerWaalsContact O-CB 3.29Å; I245-C285 WeakPolarHBondContact O-CB 3.27Å; C285-F291 WeakPolarHBondContact O-CA 3.45Å; C285-S292 PolarHBondContact N-O 3.02Å; C285-S292 PolarHBondContact O-N 2.87Å; C285-L294 HydrophobicContact CB-CD1 3.87Å; C285-L294 HydrophobicContact CB-CD2 4.23Å; C285-L294 HydrophobicContact CB-CG 3.93Å
286	F	97.6	Very high	95.8	Very high	21 Å²	21	24 Å²	24	9%	0.092	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	119.7	174.4	179.4	-94.1	0	0	0	109.8	I244 I245 A246 I261 F263 H290 F291	I244-F286 HydrophobicContact CG2-CB 4.01Å; I245-F286 PolarHBondContact O-N 3.3Å; A246-F286 HydrophobicContact CB-CB 4.1Å; A246-F286 HydrophobicContact CB-CD1 4.43Å; A246-F286 WeakPolarHBondContact CB-O 3.48Å; I261-F286 HydrophobicContact CG2-CD1 3.74Å; I261-F286 HydrophobicContact CG2-CE1 3.84Å; F263-F286 HydrophobicContact CB-CB 4.25Å; F263-F286 HydrophobicContact CB-CD1 4.23Å; F263-F286 HydrophobicContact CB-CG 4.11Å; F263-F286 AromaticContact CD2-CD1 3.89Å; F263-F286 HydrophobicContact CD2-CD1 3.89Å; F263-F286 AromaticContact CD2-CD2 3.99Å; F263-F286 HydrophobicContact CD2-CD2 3.99Å; F263-F286 AromaticContact CD2-CE1 3.62Å; F263-F286 HydrophobicContact CD2-CE1 3.62Å; F263-F286 AromaticContact CD2-CE2 3.71Å; F263-F286 HydrophobicContact CD2-CE2 3.71Å; F263-F286 HydrophobicContact CD2-CG 4.05Å; F263-F286 AromaticContact CD2-CZ 3.5Å; F263-F286 HydrophobicContact CD2-CZ 3.5Å; F263-F286 VanDerWaalsContact CD2-CZ 3.5Å; F263-F286 HydrophobicContact CE2-CD2 4.41Å; F263-F286 HydrophobicContact CE2-CE1 4.17Å; F263-F286 AromaticContact CE2-CE2 3.75Å; F263-F286 HydrophobicContact CE2-CE2 3.75Å; F263-F286 AromaticContact CE2-CZ 3.59Å; F263-F286 HydrophobicContact CE2-CZ 3.59Å; F263-F286 HydrophobicContact CG-CD1 4.42Å; F263-F286 HydrophobicContact CG-CD2 4.31Å; F263-F286 HydrophobicContact CG-CE2 4.43Å; F263-F286 HydrophobicContact CG-CG 4.27Å; F263-F286 HydrophobicContact CZ-CE2 4.49Å; F286-H290 WeakPolarHBondContact CA-O 3.16Å; F286-F291 HydrophobicContact CB-CD1 4.14Å; F286-F291 HydrophobicContact CB-CE1 3.97Å; F286-F291 AromaticContact CD2-CD1 3.88Å; F286-F291 HydrophobicContact CD2-CD1 3.88Å; F286-F291 HydrophobicContact CD2-CD2 4.07Å; F286-F291 AromaticContact CD2-CE1 3.53Å; F286-F291 HydrophobicContact CD2-CE1 3.53Å; F286-F291 AromaticContact CD2-CE2 3.75Å; F286-F291 HydrophobicContact CD2-CE2 3.75Å; F286-F291 HydrophobicContact CD2-CG 4.14Å; F286-F291 AromaticContact CD2-CZ 3.47Å; F286-F291 HydrophobicContact CD2-CZ 3.47Å; F286-F291 VanDerWaalsContact CD2-CZ 3.47Å; F286-F291 HydrophobicContact CE2-CD2 4.44Å; F286-F291 HydrophobicContact CE2-CE1 4.42Å; F286-F291 AromaticContact CE2-CE2 3.93Å; F286-F291 HydrophobicContact CE2-CE2 3.93Å; F286-F291 AromaticContact CE2-CZ 3.92Å; F286-F291 HydrophobicContact CE2-CZ 3.92Å; F286-F291 HydrophobicContact CG-CE1 4.14Å; F286-F291 HydrophobicContact CG-CZ 4.39Å
287	D	94.5	Very high	95.8	Very high	16 Å²	16	20.4 Å²	20.4	9%	0.086	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	143.2	174	-172.6	26.5	0	0	0	109.9	S86 S89 L90 A289 H290	S86-D287 WeakPolarHBondContact CA-OD2 3.32Å; S89-D287 WeakPolarHBondContact CB-OD2 3.2Å; S89-D287 PolarHBondContact OG-OD2 2.84Å; S89-D287 VanDerWaalsContact OG-OD2 3.12Å; L90-D287 HydrophobicContact CD1-CB 4.45Å; L90-D287 HydrophobicContact CG-CB 4.46Å; D287-A289 VanDerWaalsContact C-N 3.3Å; D287-A289 PolarHBondContact O-N 2.76Å; D287-H290 PolarHBondContact N-O 3.1Å; D287-H290 WeakPolarHBondContact O-CA 3.26Å; D287-H290 VanDerWaalsContact O-CB 3.31Å; D287-H290 WeakPolarHBondContact O-CB 3.27Å; D287-H290 PolarHBondContact O-N 3.26Å
288	T	89.6	Confident	95.3	Very high	107 Å²	107	23.3 Å²	23.3	66%	0.656	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.8	44.3	177.8	59.2	0	0	0	0	115.3	H290	T288-H290 PolarHBondContact O-N 3.38Å
289	A	91.1	Very high	94.4	Very high	73 Å²	73	24.5 Å²	24.5	60%	0.603	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.8	28.5	-176.3	0	0	0	0	0	114.5	D287	D287-A289 VanDerWaalsContact C-N 3.3Å; D287-A289 PolarHBondContact O-N 2.76Å
290	H	94.6	Very high	92.8	Very high	26 Å²	26	27.3 Å²	27.3	12%	0.12	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	135.9	-176.8	-165.1	59.8	0	0	0	111.6	T113 F286 D287 T288	T113-H290 PolarHBondContact O-CE1 3.27Å; T113-H290 PolarHBondContact O-NE2 3.1Å; T113-H290 PolarHBondContact OG1-CE1 2.84Å; T113-H290 PolarHBondContact OG1-NE2 2.98Å; F286-H290 WeakPolarHBondContact CA-O 3.16Å; D287-H290 PolarHBondContact N-O 3.1Å; D287-H290 WeakPolarHBondContact O-CA 3.26Å; D287-H290 VanDerWaalsContact O-CB 3.31Å; D287-H290 WeakPolarHBondContact O-CB 3.27Å; D287-H290 PolarHBondContact O-N 3.26Å; T288-H290 PolarHBondContact O-N 3.38Å
291	F	98	Very high	91	Very high	7 Å²	7	31.9 Å²	31.9	3%	0.031	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	138.4	174	-69.9	-81.5	0	0	0	111.1	T113 L120 A123 V231 I244 F263 C285 F286	T113-F291 WeakPolarHBondContact CG2-O 3.35Å; T113-F291 PolarHBondContact OG1-O 2.67Å; L120-F291 HydrophobicContact CB-CD2 3.7Å; L120-F291 HydrophobicContact CB-CE2 4.03Å; L120-F291 HydrophobicContact CB-CG 4.12Å; L120-F291 HydrophobicContact CD1-CD1 3.95Å; L120-F291 HydrophobicContact CD1-CD2 4.26Å; L120-F291 HydrophobicContact CD1-CE1 4.06Å; L120-F291 HydrophobicContact CD1-CE2 4.37Å; L120-F291 HydrophobicContact CD1-CG 4.05Å; L120-F291 HydrophobicContact CD1-CZ 4.26Å; A123-F291 HydrophobicContact CB-CB 4.08Å; V231-F291 HydrophobicContact CG2-CZ 4.49Å; I244-F291 HydrophobicContact CD1-CD1 4.46Å; I244-F291 HydrophobicContact CD1-CE1 3.87Å; F263-F291 HydrophobicContact CD1-CE1 4.14Å; F263-F291 AromaticContact CD1-CZ 3.61Å; F263-F291 HydrophobicContact CD1-CZ 3.61Å; F263-F291 HydrophobicContact CD2-CZ 4.47Å; F263-F291 HydrophobicContact CE1-CE2 4.41Å; F263-F291 AromaticContact CE1-CZ 3.63Å; F263-F291 HydrophobicContact CE1-CZ 3.63Å; F263-F291 HydrophobicContact CE2-CZ 4.5Å; F263-F291 HydrophobicContact CG-CE1 4.39Å; F263-F291 HydrophobicContact CG-CZ 4.04Å; F263-F291 HydrophobicContact CZ-CZ 4.1Å; C285-F291 WeakPolarHBondContact O-CA 3.45Å; F286-F291 HydrophobicContact CB-CD1 4.14Å; F286-F291 HydrophobicContact CB-CE1 3.97Å; F286-F291 AromaticContact CD2-CD1 3.88Å; F286-F291 HydrophobicContact CD2-CD1 3.88Å; F286-F291 HydrophobicContact CD2-CD2 4.07Å; F286-F291 AromaticContact CD2-CE1 3.53Å; F286-F291 HydrophobicContact CD2-CE1 3.53Å; F286-F291 AromaticContact CD2-CE2 3.75Å; F286-F291 HydrophobicContact CD2-CE2 3.75Å; F286-F291 HydrophobicContact CD2-CG 4.14Å; F286-F291 AromaticContact CD2-CZ 3.47Å; F286-F291 HydrophobicContact CD2-CZ 3.47Å; F286-F291 VanDerWaalsContact CD2-CZ 3.47Å; F286-F291 HydrophobicContact CE2-CD2 4.44Å; F286-F291 HydrophobicContact CE2-CE1 4.42Å; F286-F291 AromaticContact CE2-CE2 3.93Å; F286-F291 HydrophobicContact CE2-CE2 3.93Å; F286-F291 AromaticContact CE2-CZ 3.92Å; F286-F291 HydrophobicContact CE2-CZ 3.92Å; F286-F291 HydrophobicContact CG-CE1 4.14Å; F286-F291 HydrophobicContact CG-CZ 4.39Å
292	S	97.9	Very high	88.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	147.3	172.2	-73.9	0	0	0	0	110.8	L111 L284 C285	L111-S292 WeakPolarHBondContact O-CB 3.49Å; L111-S292 PolarHBondContact O-OG 2.83Å; L284-S292 CarbonylContact C-O 3.54Å; L284-S292 VanDerWaalsContact CA-O 3.27Å; L284-S292 WeakPolarHBondContact CA-O 3.31Å; C285-S292 PolarHBondContact N-O 3.02Å; C285-S292 PolarHBondContact O-N 2.87Å
293	A	97.9	Very high	86.1	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	129.7	172.9	0	0	0	0	0	109.3	P110 L111 A123 L126 L284 V295	P110-A293 CarbonylContact C-O 3.52Å; P110-A293 WeakPolarHBondContact CA-O 3.32Å; L111-A293 HydrophobicContact CB-CB 4.36Å; L111-A293 HydrophobicContact CD1-CB 4.22Å; L111-A293 HydrophobicContact CG-CB 4.44Å; L111-A293 PolarHBondContact N-O 3.48Å; A123-A293 VanDerWaalsContact O-CB 3.3Å; A123-A293 WeakPolarHBondContact O-CB 3.29Å; L126-A293 HydrophobicContact CB-CB 4.25Å; L284-A293 HydrophobicContact CD2-CB 4.43Å; A293-V295 HydrophobicContact CB-CG1 4.34Å
294	L	98	Very high	84.1	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	116.6	171.4	-75.8	178.1	0	0	0	108.9	L96 L108 P110 I245 V283 C285	L96-L294 HydrophobicContact CD1-CD1 3.71Å; L96-L294 HydrophobicContact CD1-CD2 3.88Å; L96-L294 HydrophobicContact CD1-CG 4.48Å; L96-L294 HydrophobicContact CD2-CD2 3.95Å; L108-L294 HydrophobicContact CB-CB 4.17Å; L108-L294 HydrophobicContact CB-CD2 4.22Å; L108-L294 HydrophobicContact CD1-CB 4.21Å; L108-L294 HydrophobicContact CD1-CD1 4.41Å; P110-L294 HydrophobicContact CB-CD2 3.91Å; P110-L294 HydrophobicContact CG-CD2 4.49Å; I245-L294 HydrophobicContact CB-CD1 4.12Å; I245-L294 HydrophobicContact CG1-CD1 4.02Å; V283-L294 HydrophobicContact CB-CB 4.17Å; V283-L294 HydrophobicContact CG1-CB 3.87Å; V283-L294 HydrophobicContact CG1-CD1 3.87Å; V283-L294 HydrophobicContact CG1-CG 4.48Å; V283-L294 PolarHBondContact O-N 2.91Å; C285-L294 HydrophobicContact CB-CD1 3.87Å; C285-L294 HydrophobicContact CB-CD2 4.23Å; C285-L294 HydrophobicContact CB-CG 3.93Å
295	V	95.6	Very high	82.6	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.006	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	157.9	-176.9	-59.2	0	0	0	0	111.5	F61 L63 L108 W109 L111 A293	F61-V295 HydrophobicContact CD1-CG1 4.32Å; F61-V295 WeakPolarHBondContact O-CB 3.46Å; F61-V295 WeakPolarHBondContact O-CG1 3.27Å; L63-V295 HydrophobicContact CD1-CG2 3.82Å; L63-V295 HydrophobicContact CG-CG2 3.8Å; L108-V295 WeakPolarHBondContact CA-O 3.5Å; W109-V295 PolarHBondContact N-O 2.94Å; W109-V295 PolarHBondContact O-N 2.91Å; L111-V295 HydrophobicContact CD1-CG1 3.91Å; L111-V295 HydrophobicContact CD1-CG2 4.01Å; L111-V295 HydrophobicContact CD2-CG2 3.74Å; L111-V295 HydrophobicContact CG-CG1 4.28Å; L111-V295 HydrophobicContact CG-CG2 3.74Å; A293-V295 HydrophobicContact CB-CG1 4.34Å
296	T	94.3	Very high	81.6	Confident	4 Å²	4	54 Å²	54	3%	0.025	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-85.6	167.7	171.3	56.9	0	0	0	0	111.3	T62 L63 Q106 L108 A308 T488	T62-T296 WeakPolarHBondContact CG2-OG1 3.38Å; L63-T296 PolarHBondContact N-O 2.8Å; Q106-T296 HydrophobicContact CB-CG2 4.33Å; Q106-T296 VanDerWaalsContact OE1-CB 3.27Å; L108-T296 HydrophobicContact CD2-CG2 3.57Å; T296-A308 HydrophobicContact CG2-CB 3.74Å; T296-T488 HydrophobicContact CG2-CG2 4.15Å; T296-T488 WeakPolarHBondContact OG1-CG2 3.42Å
297	M	91.2	Very high	81.1	Confident	24 Å²	24	54.9 Å²	54.9	12%	0.118	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-102.2	144.1	165.7	-74	178.7	-179.8	0	0	109.7	L63 L66 W109	L63-M297 HydrophobicContact CB-CG 3.85Å; L63-M297 HydrophobicContact CD1-CE 4.07Å; L63-M297 HydrophobicContact CD1-CG 4.36Å; L63-M297 CarbonylContact O-C 3.55Å; L63-M297 WeakPolarHBondContact O-CA 3.33Å; L66-M297 HydrophobicContact CB-CE 4.14Å; L66-M297 HydrophobicContact CB-SD 4.41Å; L66-M297 HydrophobicContact CD1-CE 3.51Å; L66-M297 HydrophobicContact CG-CE 3.69Å; L66-M297 HydrophobicContact CG-SD 4.33Å; W109-M297 HydrophobicContact CD2-CE 3.5Å; W109-M297 HydrophobicContact CD2-SD 4.31Å; W109-M297 VanDerWaalsContact CE2-CE 3.49Å; W109-M297 HydrophobicContact CE3-CE 3.95Å; W109-M297 HydrophobicContact CG-CE 3.79Å; W109-M297 HydrophobicContact CG-CG 4.45Å; W109-M297 HydrophobicContact CH2-CE 4.34Å; W109-M297 HydrophobicContact CZ2-CE 3.93Å; W109-M297 HydrophobicContact CZ2-SD 3.96Å; W109-M297 HydrophobicContact CZ3-CE 4.35Å
298	Q	85.6	Confident	81	Confident	74 Å²	74	54.4 Å²	54.4	35%	0.346	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-56.7	144.8	170.2	-69.4	178.9	2.3	0	0	110.1	L63 D65	L63-Q298 WeakPolarHBondContact O-CG 3.34Å; L63-Q298 PolarHBondContact O-N 2.83Å; D65-Q298 WeakPolarHBondContact CB-O 3.33Å
299	Q	75.8	Confident	81.2	Confident	78 Å²	78	49.3 Å²	49.3	36%	0.364	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-103.9	132.2	178	-57.2	-161.1	-51.7	0	0	109.8	D301 S304 T306	Q299-D301 VanDerWaalsContact C-N 3.25Å; Q299-D301 PolarHBondContact O-N 2.88Å; Q299-S304 PolarHBondContact OE1-O 3.48Å; Q299-S304 PolarHBondContact OE1-OG 3.45Å; Q299-T306 PolarHBondContact NE2-OG1 3.29Å; Q299-T306 PolarHBondContact OE1-OG1 3.26Å
300	K	61	Low	81.5	Confident	127 Å²	127	45.9 Å²	45.9	55%	0.552	26%	0.259	S	S	*	.	S	Bend	trans	-65.7	-29.5	177.2	-77.3	-166.9	-171.5	95	0	113	D65	D65-K300 WeakPolarHBondContact OD2-CE 3.36Å; D65-K300 WeakPolarHBondContact OD2-CG 3.34Å; D65-K300 IonicContact OD2-NZ 3.18Å; D65-K300 PolarHBondContact OD2-NZ 3.29Å
301	D	57.8	Low	81.6	Confident	107 Å²	107	44.8 Å²	44.8	57%	0.572	25%	0.254	S	S	*	.			trans	-107.4	98.1	-176.1	-63.7	-36.1	0	0	0	109.8	Q299 S303 S304	Q299-D301 VanDerWaalsContact C-N 3.25Å; Q299-D301 PolarHBondContact O-N 2.88Å; D301-S303 PolarHBondContact O-N 2.99Å; D301-S304 PolarHBondContact O-N 3.33Å; D301-S304 PolarHBondContact O-OG 2.86Å
302	C	48.8	Very low	81.6	Confident	131 Å²	131	44.5 Å²	44.5	89%	0.885	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-8.7	171.8	-71.3	0	0	0	0	113.6
303	S	44.4	Very low	81.5	Confident	110 Å²	110	44.7 Å²	44.7	77%	0.769	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-19.9	176	52	0	0	0	0	113.8	D301 N305	D301-S303 PolarHBondContact O-N 2.99Å; S303-N305 PolarHBondContact O-N 3.12Å
304	S	56.1	Low	81.3	Confident	48 Å²	48	47 Å²	47	34%	0.336	26%	0.263	S	S	.	.			trans	-88.8	91.9	172.4	68.5	0	0	0	0	109.2	Q299 D301 T306	Q299-S304 PolarHBondContact OE1-O 3.48Å; Q299-S304 PolarHBondContact OE1-OG 3.45Å; D301-S304 PolarHBondContact O-N 3.33Å; D301-S304 PolarHBondContact O-OG 2.86Å; S304-T306 PolarHBondContact O-N 3.03Å
305	N	66.1	Low	81.1	Confident	145 Å²	145	52.9 Å²	52.9	78%	0.775	29%	0.285	S	S	*	.			trans	-75	49.6	-179.8	-140.9	19.9	0	0	0	111.2	S303 P307	S303-N305 PolarHBondContact O-N 3.12Å; N305-P307 WeakPolarHBondContact O-CD 3.48Å
306	T	78.3	Confident	80.9	Confident	34 Å²	34	57.8 Å²	57.8	21%	0.209	31%	0.311	C	S	.	.			trans	-71.3	119.2	-177.5	60.6	0	0	0	0	108.8	S104 Q106 Q299 S304 A308	S104-T306 VanDerWaalsContact O-CB 3.24Å; S104-T306 WeakPolarHBondContact O-CB 3.38Å; S104-T306 WeakPolarHBondContact O-CG2 3.49Å; Q106-T306 VanDerWaalsContact CG-OG1 3.23Å; Q106-T306 WeakPolarHBondContact CG-OG1 3.48Å; Q106-T306 PolarHBondContact NE2-O 3.26Å; Q106-T306 PolarHBondContact NE2-OG1 3.17Å; Q299-T306 PolarHBondContact NE2-OG1 3.29Å; Q299-T306 PolarHBondContact OE1-OG1 3.26Å; S304-T306 PolarHBondContact O-N 3.03Å; T306-A308 PolarHBondContact O-N 3.14Å
307	P	86	Confident	80.9	Confident	38 Å²	38	58.4 Å²	58.4	25%	0.247	31%	0.313	C	S	.	.			trans	-71.1	136.9	-172.6	29.4	-35.3	0	0	0	110.4	Q106 N305 I309 I367	Q106-P307 PolarHBondContact N-O 3.09Å; Q106-P307 VanDerWaalsContact N-O 3.15Å; N305-P307 WeakPolarHBondContact O-CD 3.48Å; P307-I309 HydrophobicContact CB-CG2 4.19Å; P307-I309 PolarHBondContact O-N 3.21Å; P307-I367 HydrophobicContact CB-CD1 4.29Å; P307-I367 HydrophobicContact CG-CD1 3.62Å
308	A	92.3	Very high	81	Confident	7 Å²	7	60.4 Å²	60.4	6%	0.058	33%	0.327	C	S	.	.			trans	-86.9	102.6	167.6	0	0	0	0	0	108.1	T296 T306 I486 T488	T296-A308 HydrophobicContact CG2-CB 3.74Å; T306-A308 PolarHBondContact O-N 3.14Å; A308-I486 HydrophobicContact CB-CB 4.09Å; A308-I486 PolarHBondContact O-N 2.81Å; A308-T488 HydrophobicContact CB-CG2 3.79Å
309	I	94.9	Very high	81.4	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	158.2	178.5	62.8	141.5	0	0	0	111.6	C105 P307 P311 I367 I481 A484	C105-I309 HydrophobicContact CB-CG1 4.28Å; P307-I309 HydrophobicContact CB-CG2 4.19Å; P307-I309 PolarHBondContact O-N 3.21Å; I309-P311 HydrophobicContact CD1-CG 4.45Å; I309-I367 HydrophobicContact CB-CD1 4.44Å; I309-I367 HydrophobicContact CD1-CD1 3.48Å; I309-I367 VanDerWaalsContact CD1-CD1 3.48Å; I309-I367 HydrophobicContact CD1-CG1 4.37Å; I309-I367 HydrophobicContact CG1-CD1 3.74Å; I309-I367 HydrophobicContact CG2-CD1 3.9Å; I309-I481 HydrophobicContact CD1-CG2 3.94Å; I309-A484 WeakPolarHBondContact CA-O 3.35Å
310	I	97.1	Very high	82.4	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	116.7	165.3	-175	62.2	0	0	0	109	W99 L108 V243 I245 P281 V283 I312 G483 A484 I486	W99-I310 HydrophobicContact CH2-CD1 3.53Å; W99-I310 HydrophobicContact CZ2-CD1 3.84Å; W99-I310 HydrophobicContact CZ3-CD1 4.29Å; L108-I310 HydrophobicContact CD1-CD1 3.96Å; V243-I310 HydrophobicContact CB-CG1 4.48Å; V243-I310 HydrophobicContact CG1-CG1 3.78Å; V243-I310 HydrophobicContact CG1-CG2 4.47Å; V243-I310 HydrophobicContact CG2-CG2 4.37Å; I245-I310 HydrophobicContact CD1-CD1 3.84Å; I245-I310 HydrophobicContact CD1-CG1 4.37Å; I245-I310 HydrophobicContact CG1-CD1 3.82Å; P281-I310 HydrophobicContact CG-CG2 3.92Å; V283-I310 HydrophobicContact CG1-CB 4.38Å; V283-I310 HydrophobicContact CG1-CD1 3.98Å; V283-I310 HydrophobicContact CG1-CG1 3.9Å; V283-I310 HydrophobicContact CG2-CB 4.18Å; V283-I310 HydrophobicContact CG2-CG1 4.48Å; V283-I310 HydrophobicContact CG2-CG2 3.9Å; I310-I312 PolarHBondContact O-N 3.49Å; I310-G483 CarbonylContact O-C 3.54Å; I310-G483 WeakPolarHBondContact O-CA 3.34Å; I310-A484 HydrophobicContact CG2-CB 3.98Å; I310-A484 PolarHBondContact N-O 3.18Å; I310-A484 PolarHBondContact O-N 2.98Å; I310-I486 HydrophobicContact CB-CD1 4.22Å; I310-I486 HydrophobicContact CG2-CD1 4.47Å; I310-I486 HydrophobicContact CG2-CG1 4.32Å
311	P	96.9	Very high	84	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.019	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	140.2	176.8	-29.8	38.2	0	0	0	112.4	W98 W99 I309 T313 L320 I481 V482	W98-P311 HydrophobicContact CH2-CB 3.98Å; W98-P311 HydrophobicContact CH2-CG 3.97Å; W98-P311 HydrophobicContact CZ2-CB 3.63Å; W98-P311 HydrophobicContact CZ2-CG 3.75Å; W99-P311 HydrophobicContact CB-CG 3.79Å; W99-P311 VanDerWaalsContact CD2-CD 3.45Å; W99-P311 HydrophobicContact CD2-CG 3.56Å; W99-P311 HydrophobicContact CE3-CG 3.48Å; W99-P311 VanDerWaalsContact CE3-CG 3.48Å; W99-P311 HydrophobicContact CG-CG 3.71Å; W99-P311 HydrophobicContact CZ3-CG 4.19Å; I309-P311 HydrophobicContact CD1-CG 4.45Å; P311-T313 PolarHBondContact O-N 3.48Å; P311-L320 WeakPolarHBondContact O-CD1 3.13Å; P311-I481 HydrophobicContact CB-CG2 4.24Å; P311-I481 HydrophobicContact CG-CG2 3.82Å; P311-V482 WeakPolarHBondContact CA-O 3.49Å
312	I	96.9	Very high	85.9	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	27%	0.271	C	S	.	.	S	Bend	trans	-89	12.3	172.3	63.6	166.1	0	0	0	111.9	I266 I310 L320 L355 I358 M362 I364 V482 A484	I266-I312 HydrophobicContact CD1-CB 4.09Å; I266-I312 HydrophobicContact CD1-CG2 4.15Å; I310-I312 PolarHBondContact O-N 3.49Å; I312-L320 PolarHBondContact O-N 3.22Å; I312-L355 HydrophobicContact CD1-CD1 3.91Å; I312-I358 HydrophobicContact CD1-CG2 3.99Å; I312-I358 HydrophobicContact CG2-CG2 4.31Å; I312-M362 HydrophobicContact CG2-CE 4.14Å; I312-I364 HydrophobicContact CG2-CD1 4.11Å; I312-V482 HydrophobicContact CD1-CG1 3.82Å; I312-V482 HydrophobicContact CG1-CB 4.35Å; I312-V482 HydrophobicContact CG1-CG1 4.01Å; I312-V482 WeakPolarHBondContact CG1-O 3.44Å; I312-V482 PolarHBondContact N-O 2.69Å; I312-A484 HydrophobicContact CG2-CB 4.28Å
313	T	96.3	Very high	88.3	Confident	4 Å²	4	42 Å²	42	3%	0.025	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-130.3	157	179.6	56.3	0	0	0	0	111	P311 T318 V475	P311-T313 PolarHBondContact O-N 3.48Å; T313-T318 CarbonylContact C-O 3.57Å; T313-T318 WeakPolarHBondContact CA-O 2.93Å; T313-T318 VanDerWaalsContact CB-O 3.28Å; T313-T318 WeakPolarHBondContact CB-O 3.43Å; T313-V475 HydrophobicContact CG2-CG1 3.41Å; T313-V475 VanDerWaalsContact CG2-CG1 3.41Å
314	Y	94.6	Very high	90.8	Very high	48 Å²	48	37.1 Å²	37.1	19%	0.188	20%	0.197	C	C	.	.			trans	-72	171.3	160.8	-64.1	-75.8	0	0	0	110.4	T248 D316 R317 T318 L320 P321	T248-Y314 HydrophobicContact CG2-CE1 3.94Å; Y314-D316 WeakPolarHBondContact CB-OD1 3.47Å; Y314-D316 PolarHBondContact O-N 3.04Å; Y314-R317 PolarHBondContact O-N 3.2Å; Y314-T318 VanDerWaalsContact CD2-OG1 3.31Å; Y314-T318 WeakPolarHBondContact CD2-OG1 3.28Å; Y314-T318 PolarHBondContact N-O 3.46Å; Y314-L320 HydrophobicContact CD1-CD2 3.84Å; Y314-L320 HydrophobicContact CD2-CD2 3.96Å; Y314-L320 HydrophobicContact CE1-CD2 3.61Å; Y314-L320 HydrophobicContact CE2-CD2 3.78Å; Y314-L320 HydrophobicContact CG-CD2 4.01Å; Y314-P321 WeakPolarHBondContact OH-CD 3.49Å
315	R	93	Very high	92.7	Very high	125 Å²	125	35.5 Å²	35.5	47%	0.472	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-33.4	179.5	-170.6	175.6	-170.2	179.1	4.2	113.2	W98 E102 R317	W98-R315 HydrophobicContact CB-CG 4.43Å; W98-R315 HydrophobicContact CD2-CB 3.93Å; W98-R315 HydrophobicContact CD2-CG 3.99Å; W98-R315 HydrophobicContact CE3-CB 4.35Å; W98-R315 HydrophobicContact CE3-CG 4.01Å; W98-R315 HydrophobicContact CG-CB 4.09Å; W98-R315 HydrophobicContact CG-CG 4.19Å; E102-R315 IonicContact OE1-CZ 2.85Å; E102-R315 IonicContact OE1-NE 3.17Å; E102-R315 PolarHBondContact OE1-NE 3Å; E102-R315 IonicContact OE1-NH2 3.7Å; E102-R315 PolarHBondContact OE1-NH2 3.04Å; E102-R315 VanDerWaalsContact OE1-NH2 3.07Å; R315-R317 PolarHBondContact O-N 2.93Å; R315-R317 PolarHBondContact O-NH1 2.78Å
316	D	92.2	Very high	94.1	Very high	105 Å²	105	29.5 Å²	29.5	56%	0.561	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	8.8	177.2	69	-3.6	0	0	0	114.3	Y314 T318	Y314-D316 WeakPolarHBondContact CB-OD1 3.47Å; Y314-D316 PolarHBondContact O-N 3.04Å; D316-T318 PolarHBondContact O-N 2.87Å; D316-T318 WeakPolarHBondContact OD1-CB 3.28Å; D316-T318 WeakPolarHBondContact OD1-CG2 3.49Å; D316-T318 PolarHBondContact OD1-N 2.9Å; D316-T318 PolarHBondContact OD1-OG1 2.8Å; D316-T318 PolarHBondContact OD2-OG1 2.99Å
317	R	92.6	Very high	94.9	Very high	17 Å²	17	29.7 Å²	29.7	6%	0.064	16%	0.155	C	C	.	.	S	Bend	trans	67	14.2	-179.6	-48.5	-59.6	-174.5	-113.2	4	114.3	W98 E102 Y314 R315	W98-R317 VanDerWaalsContact CH2-NH1 3.32Å; E102-R317 IonicContact OE2-CZ 3.63Å; E102-R317 IonicContact OE2-NH1 3.63Å; E102-R317 IonicContact OE2-NH2 3.97Å; E102-R317 PolarHBondContact OE2-NH2 2.86Å; Y314-R317 PolarHBondContact O-N 3.2Å; R315-R317 PolarHBondContact O-N 2.93Å; R315-R317 PolarHBondContact O-NH1 2.78Å
318	T	93.6	Very high	95.2	Very high	66 Å²	66	28.3 Å²	28.3	41%	0.405	15%	0.146	S	C	.	.	P	Polyproline II helix	trans	-75.3	137	166.2	62.4	0	0	0	0	110.1	T313 Y314 D316	T313-T318 CarbonylContact C-O 3.57Å; T313-T318 WeakPolarHBondContact CA-O 2.93Å; T313-T318 VanDerWaalsContact CB-O 3.28Å; T313-T318 WeakPolarHBondContact CB-O 3.43Å; Y314-T318 VanDerWaalsContact CD2-OG1 3.31Å; Y314-T318 WeakPolarHBondContact CD2-OG1 3.28Å; Y314-T318 PolarHBondContact N-O 3.46Å; D316-T318 PolarHBondContact O-N 2.87Å; D316-T318 WeakPolarHBondContact OD1-CB 3.28Å; D316-T318 WeakPolarHBondContact OD1-CG2 3.49Å; D316-T318 PolarHBondContact OD1-N 2.9Å; D316-T318 PolarHBondContact OD1-OG1 2.8Å; D316-T318 PolarHBondContact OD2-OG1 2.99Å
319	M	94.6	Very high	95.2	Very high	40 Å²	40	28.7 Å²	28.7	20%	0.197	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-67.6	138.7	-178.4	-174	173.8	58.1	0	0	110.8	D351 R354 I358	M319-D351 HydrophobicContact CE-CB 4.26Å; M319-R354 HydrophobicContact CE-CB 3.72Å; M319-R354 HydrophobicContact CE-CG 4.45Å; M319-R354 HydrophobicContact SD-CB 4.45Å; M319-I358 HydrophobicContact CG-CD1 4.47Å; M319-I358 HydrophobicContact SD-CD1 3.93Å
320	L	96.6	Very high	95	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.026	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-58.6	144.1	173.6	-70.2	179.9	0	0	0	110.5	V243 I245 I266 P311 I312 Y314 L322	V243-L320 HydrophobicContact CG1-CD1 4.2Å; I245-L320 HydrophobicContact CD1-CD1 4.43Å; I266-L320 HydrophobicContact CD1-CB 4.08Å; I266-L320 HydrophobicContact CG1-CB 4.08Å; I266-L320 HydrophobicContact CG1-CD1 4.28Å; P311-L320 WeakPolarHBondContact O-CD1 3.13Å; I312-L320 PolarHBondContact O-N 3.22Å; Y314-L320 HydrophobicContact CD1-CD2 3.84Å; Y314-L320 HydrophobicContact CD2-CD2 3.96Å; Y314-L320 HydrophobicContact CE1-CD2 3.61Å; Y314-L320 HydrophobicContact CE2-CD2 3.78Å; Y314-L320 HydrophobicContact CG-CD2 4.01Å; L320-L322 PolarHBondContact O-N 3.32Å
321	P	95.9	Very high	94.6	Very high	55 Å²	55	36 Å²	36	36%	0.357	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-57.4	131.2	176.3	-24.2	34	0	0	0	111.4	G265 I266 Y314	G265-P321 CarbonylContact C-O 3.46Å; G265-P321 VanDerWaalsContact CA-O 3.28Å; G265-P321 WeakPolarHBondContact CA-O 3.48Å; I266-P321 PolarHBondContact N-O 3.44Å; Y314-P321 WeakPolarHBondContact OH-CD 3.49Å
322	L	97.7	Very high	94.4	Very high	18 Å²	18	36.2 Å²	36.2	9%	0.094	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-94.2	104.2	170.1	-178	64	0	0	0	108.8	I266 L268 L320 A325 R354 L357 I358	I266-L322 HydrophobicContact CB-CD1 4.05Å; I266-L322 HydrophobicContact CG2-CD1 3.9Å; L268-L322 HydrophobicContact CD1-CD1 3.67Å; L268-L322 HydrophobicContact CG-CD1 3.72Å; L320-L322 PolarHBondContact O-N 3.32Å; L322-A325 HydrophobicContact CB-CB 4.44Å; L322-A325 HydrophobicContact CD2-CB 3.75Å; L322-A325 HydrophobicContact CG-CB 3.81Å; L322-R354 HydrophobicContact CD2-CB 4.19Å; L322-R354 HydrophobicContact CD2-CG 4.26Å; L322-L357 HydrophobicContact CD2-CB 4.13Å; L322-L357 HydrophobicContact CD2-CD1 4.01Å; L322-I358 HydrophobicContact CD1-CG1 4.38Å
323	H	97.8	Very high	94.1	Very high	12 Å²	12	38 Å²	38	6%	0.056	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	142.1	-173.7	-74.7	-78	0	0	0	112.3	Q228 L262 G264 I266 Y267 A325	Q228-H323 PolarHBondContact OE1-CE1 2.72Å; L262-H323 PolarHBondContact O-CE1 3.49Å; L262-H323 PolarHBondContact O-NE2 3.04Å; G264-H323 PolarHBondContact O-NE2 3.48Å; I266-H323 PolarHBondContact O-N 2.95Å; Y267-H323 HydrophobicContact CD1-CB 3.63Å; Y267-H323 HydrophobicContact CE1-CB 3.45Å; Y267-H323 VanDerWaalsContact CE1-CB 3.45Å; Y267-H323 AromaticContact CE1-CD2 3.75Å; Y267-H323 AromaticContact CE1-CG 3.55Å; Y267-H323 AromaticContact CE2-CD2 3.65Å; Y267-H323 HydrophobicContact CG-CB 4.33Å; Y267-H323 AromaticContact CZ-CD2 3.35Å; Y267-H323 AromaticContact CZ-CG 3.63Å; Y267-H323 AromaticContact CZ-NE2 3.86Å; Y267-H323 PolarHBondContact OH-CD2 2.79Å; Y267-H323 PolarHBondContact OH-NE2 2.83Å; H323-A325 PolarHBondContact O-N 3.41Å
324	F	97.6	Very high	93.9	Very high	7 Å²	7	39.4 Å²	39.4	3%	0.031	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	28.8	175	-53.5	-69.5	0	0	0	114.4	R158 W159 Q162 Q228 L229 F232 Y267 C326	R158-F324 HydrophobicContact CB-CB 4.09Å; R158-F324 WeakPolarHBondContact CD-O 3.34Å; R158-F324 PolarHBondContact NH1-O 3.45Å; W159-F324 HydrophobicContact CB-CE1 4.28Å; Q162-F324 HydrophobicContact CB-CD1 4.05Å; Q162-F324 HydrophobicContact CB-CE1 4.19Å; Q162-F324 HydrophobicContact CG-CE1 4.48Å; Q228-F324 HydrophobicContact CB-CE2 4.18Å; Q228-F324 HydrophobicContact CB-CZ 4.13Å; L229-F324 HydrophobicContact CB-CZ 4.32Å; F232-F324 HydrophobicContact CB-CD2 3.43Å; F232-F324 VanDerWaalsContact CB-CD2 3.43Å; F232-F324 HydrophobicContact CB-CE2 3.75Å; F232-F324 HydrophobicContact CB-CG 4.35Å; F232-F324 HydrophobicContact CD1-CB 3.85Å; F232-F324 AromaticContact CD1-CD2 3.9Å; F232-F324 HydrophobicContact CD1-CD2 3.9Å; F232-F324 AromaticContact CD1-CG 3.98Å; F232-F324 HydrophobicContact CD1-CG 3.98Å; F232-F324 HydrophobicContact CD2-CB 3.93Å; F232-F324 AromaticContact CD2-CD2 3.85Å; F232-F324 HydrophobicContact CD2-CD2 3.85Å; F232-F324 HydrophobicContact CD2-CG 4.32Å; F232-F324 HydrophobicContact CE1-CB 3.7Å; F232-F324 HydrophobicContact CE1-CG 4.32Å; F232-F324 HydrophobicContact CE2-CB 3.76Å; F232-F324 HydrophobicContact CG-CB 3.96Å; F232-F324 AromaticContact CG-CD2 3.47Å; F232-F324 HydrophobicContact CG-CD2 3.47Å; F232-F324 VanDerWaalsContact CG-CD2 3.47Å; F232-F324 HydrophobicContact CG-CE2 4.27Å; F232-F324 AromaticContact CG-CG 3.98Å; F232-F324 HydrophobicContact CG-CG 3.98Å; F232-F324 HydrophobicContact CZ-CB 3.65Å; Y267-F324 HydrophobicContact CD1-CD2 4.39Å; Y267-F324 HydrophobicContact CD1-CE2 4.48Å; Y267-F324 HydrophobicContact CE1-CD2 4.35Å; Y267-F324 HydrophobicContact CE1-CE2 4.06Å; F324-C326 VanDerWaalsContact C-N 3.31Å; F324-C326 PolarHBondContact O-N 3.25Å
325	A	96.5	Very high	93.7	Very high	15 Å²	15	43.7 Å²	43.7	12%	0.124	23%	0.228	C	C	.	.			trans	-64.6	-32.4	-172.1	0	0	0	0	0	113.9	R158 L322 H323 L349	R158-A325 PolarHBondContact NH1-O 3.27Å; L322-A325 HydrophobicContact CB-CB 4.44Å; L322-A325 HydrophobicContact CD2-CB 3.75Å; L322-A325 HydrophobicContact CG-CB 3.81Å; H323-A325 PolarHBondContact O-N 3.41Å; A325-L349 HydrophobicContact CB-CD1 3.63Å
326	C	95.2	Very high	93.4	Very high	18 Å²	18	45.1 Å²	45.1	12%	0.122	24%	0.238	C	C	.	.			trans	-97.2	126.6	-176.1	-59.7	0	0	0	0	111	R158 W161 F324 A347	R158-C326 WeakPolarHBondContact CG-O 3.18Å; W161-C326 HydrophobicContact CG-CB 4.35Å; F324-C326 VanDerWaalsContact C-N 3.31Å; F324-C326 PolarHBondContact O-N 3.25Å; C326-A347 PolarHBondContact SG-O 3Å
327	D	94.6	Very high	93.1	Very high	39 Å²	39	42.8 Å²	42.8	21%	0.209	23%	0.225	C	C	.	.			trans	-114.3	116.1	162.6	178.9	12.1	0	0	0	107.6	R157 R158 G329	R157-D327 WeakPolarHBondContact CB-OD1 3.38Å; R157-D327 IonicContact CZ-OD1 2.81Å; R157-D327 IonicContact CZ-OD2 3.52Å; R157-D327 IonicContact NE-OD1 3.64Å; R157-D327 PolarHBondContact NE-OD1 2.99Å; R157-D327 IonicContact NE-OD2 2.67Å; R157-D327 PolarHBondContact NE-OD2 3.13Å; R157-D327 IonicContact NH2-OD1 3.4Å; R157-D327 IonicContact NH2-OD2 3.36Å; R157-D327 PolarHBondContact NH2-OD2 2.91Å; R158-D327 HydrophobicContact CG-CB 3.72Å; D327-G329 PolarHBondContact O-N 3.48Å; D327-G329 PolarHBondContact OD1-N 2.97Å
328	P	93.4	Very high	92.8	Very high	9 Å²	9	50.2 Å²	50.2	6%	0.058	26%	0.261	C	S	.	.			trans	-71.2	-7.8	176.9	33.4	-39.1	0	0	0	112.9	W161 F332 W334 I343	W161-P328 HydrophobicContact CD2-CG 4.43Å; W161-P328 HydrophobicContact CE3-CB 3.78Å; W161-P328 HydrophobicContact CE3-CG 3.77Å; W161-P328 HydrophobicContact CZ3-CB 3.95Å; W161-P328 HydrophobicContact CZ3-CG 4.43Å; P328-F332 HydrophobicContact CB-CB 3.7Å; P328-F332 HydrophobicContact CB-CD1 3.85Å; P328-F332 HydrophobicContact CB-CD2 3.95Å; P328-F332 HydrophobicContact CB-CE1 4.44Å; P328-F332 HydrophobicContact CB-CG 3.57Å; P328-F332 HydrophobicContact CG-CB 4.08Å; P328-F332 HydrophobicContact CG-CD1 3.87Å; P328-F332 HydrophobicContact CG-CG 4.03Å; P328-W334 HydrophobicContact CG-CH2 4.3Å; P328-I343 HydrophobicContact CB-CG2 4.38Å; P328-I343 VanDerWaalsContact O-CG2 3.24Å; P328-I343 WeakPolarHBondContact O-CG2 3.37Å
329	G	91.5	Very high	92.5	Very high	15 Å²	15	47.9 Å²	47.9	16%	0.155	25%	0.248	C	C	.	.			trans	85.2	167.9	177.7	0	0	0	0	0	113.6	R157 D327 D331 F332	R157-G329 VanDerWaalsContact CD-C 3.42Å; R157-G329 WeakPolarHBondContact CD-O 3.28Å; D327-G329 PolarHBondContact O-N 3.48Å; D327-G329 PolarHBondContact OD1-N 2.97Å; G329-D331 VanDerWaalsContact C-N 3.26Å; G329-D331 PolarHBondContact O-N 3.15Å; G329-F332 PolarHBondContact O-N 2.99Å
330	P	90.5	Very high	92.2	Very high	100 Å²	100	46 Å²	46	65%	0.649	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-21.4	-174.4	28.4	-35.5	0	0	0	114.2	F332	P330-F332 VanDerWaalsContact C-N 3.31Å
331	D	89.3	Confident	91.8	Very high	53 Å²	53	51.8 Å²	51.8	28%	0.283	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-6.8	-179.9	-66.6	-41.1	0	0	0	113.7	G329 T333 T713 Y715	G329-D331 VanDerWaalsContact C-N 3.26Å; G329-D331 PolarHBondContact O-N 3.15Å; D331-T333 PolarHBondContact O-N 3.4Å; D331-T713 HydrophobicContact CB-CG2 3.98Å; D331-T713 WeakPolarHBondContact CB-OG1 3.2Å; D331-T713 VanDerWaalsContact CG-CB 3.46Å; D331-T713 VanDerWaalsContact CG-OG1 3.26Å; D331-T713 WeakPolarHBondContact OD2-CB 3.39Å; D331-T713 PolarHBondContact OD2-OG1 3.32Å; D331-Y715 WeakPolarHBondContact OD1-CE2 3.33Å; D331-Y715 PolarHBondContact OD1-OH 3.32Å
332	F	92.1	Very high	91.4	Very high	8 Å²	8	55.2 Å²	55.2	4%	0.035	28%	0.275	C	S	.	.			trans	-74.3	119.9	177.9	-170.6	-106.6	0	0	0	110.6	W161 P328 G329 P330 W334 W335 D340 I343 A344	W161-F332 HydrophobicContact CE3-CE1 4.32Å; W161-F332 HydrophobicContact CE3-CZ 4.44Å; W161-F332 HydrophobicContact CZ3-CE1 4.18Å; W161-F332 HydrophobicContact CZ3-CE2 4.26Å; W161-F332 AromaticContact CZ3-CZ 3.85Å; W161-F332 HydrophobicContact CZ3-CZ 3.85Å; P328-F332 HydrophobicContact CB-CB 3.7Å; P328-F332 HydrophobicContact CB-CD1 3.85Å; P328-F332 HydrophobicContact CB-CD2 3.95Å; P328-F332 HydrophobicContact CB-CE1 4.44Å; P328-F332 HydrophobicContact CB-CG 3.57Å; P328-F332 HydrophobicContact CG-CB 4.08Å; P328-F332 HydrophobicContact CG-CD1 3.87Å; P328-F332 HydrophobicContact CG-CG 4.03Å; G329-F332 PolarHBondContact O-N 2.99Å; P330-F332 VanDerWaalsContact C-N 3.31Å; F332-W334 AromaticContact CD1-CD2 3.8Å; F332-W334 HydrophobicContact CD1-CD2 3.8Å; F332-W334 AromaticContact CD1-CE3 3.91Å; F332-W334 HydrophobicContact CD1-CE3 3.91Å; F332-W334 HydrophobicContact CD1-CG 4.2Å; F332-W334 HydrophobicContact CD1-CH2 4.44Å; F332-W334 HydrophobicContact CD1-CZ2 4.38Å; F332-W334 HydrophobicContact CD1-CZ3 4.22Å; F332-W334 HydrophobicContact CE1-CB 4.48Å; F332-W334 AromaticContact CE1-CD2 3.87Å; F332-W334 HydrophobicContact CE1-CD2 3.87Å; F332-W334 AromaticContact CE1-CE3 3.56Å; F332-W334 HydrophobicContact CE1-CE3 3.56Å; F332-W334 HydrophobicContact CE1-CG 4.31Å; F332-W334 AromaticContact CE1-CZ3 3.96Å; F332-W334 HydrophobicContact CE1-CZ3 3.96Å; F332-W335 HydrophobicContact CZ-CD2 4.33Å; F332-W335 AromaticContact CZ-CE2 3.88Å; F332-W335 HydrophobicContact CZ-CZ2 4.14Å; F332-W335 AromaticContact CZ-NE1 3.94Å; F332-D340 HydrophobicContact CD2-CB 3.97Å; F332-D340 WeakPolarHBondContact CD2-OD1 3.45Å; F332-D340 HydrophobicContact CE2-CB 3.55Å; F332-D340 WeakPolarHBondContact CE2-O 3.36Å; F332-D340 HydrophobicContact CZ-CB 4.22Å; F332-I343 HydrophobicContact CB-CG2 4.41Å; F332-I343 HydrophobicContact CD2-CB 3.98Å; F332-I343 HydrophobicContact CD2-CG2 3.71Å; F332-I343 HydrophobicContact CE2-CB 4.5Å; F332-I343 HydrophobicContact CE2-CG2 4.48Å; F332-I343 HydrophobicContact CG-CG2 4.48Å; F332-A344 HydrophobicContact CE2-CB 4.19Å
333	T	90.7	Very high	90.9	Very high	38 Å²	38	55 Å²	55	23%	0.233	27%	0.274	C	S	.	.			trans	-95.7	7.3	-172.3	60.4	0	0	0	0	114.6	D331 K336 D340 R705	D331-T333 PolarHBondContact O-N 3.4Å; T333-K336 WeakPolarHBondContact O-CD 3.41Å; T333-K336 WeakPolarHBondContact O-CE 3.46Å; T333-K336 VanDerWaalsContact O-CG 3.3Å; T333-K336 WeakPolarHBondContact O-CG 3.35Å; T333-D340 WeakPolarHBondContact CA-OD2 3.31Å; T333-D340 PolarHBondContact N-OD1 2.64Å; T333-D340 PolarHBondContact N-OD2 2.95Å; T333-D340 VanDerWaalsContact N-OD2 3.17Å; T333-D340 VanDerWaalsContact OG1-CG 3.26Å; T333-D340 PolarHBondContact OG1-OD1 3.3Å; T333-D340 PolarHBondContact OG1-OD2 3.49Å; T333-R705 PolarHBondContact OG1-NH1 2.79Å
334	W	91.9	Very high	90.5	Very high	35 Å²	35	55 Å²	55	13%	0.133	28%	0.275	C	S	.	.	S	Bend	trans	63.9	52.8	-179.4	-52.7	94.6	0	0	0	113.7	W156 R160 W161 P328 F332 D340	W156-W334 HydrophobicContact CH2-CZ2 4.28Å; W156-W334 AromaticContact CH2-NE1 3.76Å; W156-W334 HydrophobicContact CZ3-CZ2 4.11Å; R160-W334 HydrophobicContact CB-CH2 3.52Å; R160-W334 HydrophobicContact CB-CZ2 3.91Å; R160-W334 HydrophobicContact CB-CZ3 4.1Å; R160-W334 VanDerWaalsContact CD-CE2 3.48Å; R160-W334 HydrophobicContact CG-CD2 4.36Å; R160-W334 HydrophobicContact CG-CE3 4.02Å; R160-W334 HydrophobicContact CG-CH2 3.4Å; R160-W334 HydrophobicContact CG-CZ2 3.74Å; R160-W334 HydrophobicContact CG-CZ3 3.55Å; R160-W334 VanDerWaalsContact CZ-CD1 3.49Å; R160-W334 VanDerWaalsContact CZ-CD2 3.45Å; R160-W334 VanDerWaalsContact NE-CE2 3.32Å; R160-W334 VanDerWaalsContact NH2-CG 3.26Å; W161-W334 HydrophobicContact CB-CH2 4.34Å; P328-W334 HydrophobicContact CG-CH2 4.3Å; F332-W334 AromaticContact CD1-CD2 3.8Å; F332-W334 HydrophobicContact CD1-CD2 3.8Å; F332-W334 AromaticContact CD1-CE3 3.91Å; F332-W334 HydrophobicContact CD1-CE3 3.91Å; F332-W334 HydrophobicContact CD1-CG 4.2Å; F332-W334 HydrophobicContact CD1-CH2 4.44Å; F332-W334 HydrophobicContact CD1-CZ2 4.38Å; F332-W334 HydrophobicContact CD1-CZ3 4.22Å; F332-W334 HydrophobicContact CE1-CB 4.48Å; F332-W334 AromaticContact CE1-CD2 3.87Å; F332-W334 HydrophobicContact CE1-CD2 3.87Å; F332-W334 AromaticContact CE1-CE3 3.56Å; F332-W334 HydrophobicContact CE1-CE3 3.56Å; F332-W334 HydrophobicContact CE1-CG 4.31Å; F332-W334 AromaticContact CE1-CZ3 3.96Å; F332-W334 HydrophobicContact CE1-CZ3 3.96Å; W334-D340 PolarHBondContact N-OD2 2.99Å
335	W	90.2	Very high	89.9	Confident	137 Å²	137	59 Å²	59	52%	0.519	30%	0.303	S	S	.	.	S	Bend	trans	67.3	32.2	174.9	-44.7	95.8	0	0	0	114.2	F332 D340 E341 A344	F332-W335 HydrophobicContact CZ-CD2 4.33Å; F332-W335 AromaticContact CZ-CE2 3.88Å; F332-W335 HydrophobicContact CZ-CZ2 4.14Å; F332-W335 AromaticContact CZ-NE1 3.94Å; W335-D340 WeakPolarHBondContact CA-OD2 3.41Å; W335-D340 HydrophobicContact CE3-CB 4.45Å; W335-D340 PolarHBondContact N-OD2 3.49Å; W335-E341 HydrophobicContact CZ3-CB 4.41Å; W335-A344 HydrophobicContact CH2-CB 3.48Å; W335-A344 VanDerWaalsContact CH2-CB 3.48Å; W335-A344 HydrophobicContact CZ2-CB 4.04Å; W335-A344 HydrophobicContact CZ3-CB 4.16Å
336	K	86.1	Confident	89.2	Confident	156 Å²	156	62 Å²	62	68%	0.678	32%	0.315	S	S	*	.	S	Bend	trans	-83.8	-20.6	175.2	-68.6	178.5	-173.6	176.2	0	113.1	T333 D340	T333-K336 WeakPolarHBondContact O-CD 3.41Å; T333-K336 WeakPolarHBondContact O-CE 3.46Å; T333-K336 VanDerWaalsContact O-CG 3.3Å; T333-K336 WeakPolarHBondContact O-CG 3.35Å; K336-D340 PolarHBondContact N-OD2 2.87Å
337	D	86.6	Confident	88.6	Confident	55 Å²	55	61.9 Å²	61.9	29%	0.294	32%	0.315	S	S	.	.	S	Bend	trans	-141.8	167.4	176.9	63.5	31.4	0	0	0	112	A339 D340 R705	D337-A339 PolarHBondContact O-N 3.46Å; D337-A339 WeakPolarHBondContact OD1-CB 3.33Å; D337-A339 PolarHBondContact OD1-N 3.35Å; D337-A339 VanDerWaalsContact OD1-N 3.1Å; D337-D340 PolarHBondContact O-N 3.37Å; D337-D340 PolarHBondContact OD1-N 3.38Å; D337-D340 VanDerWaalsContact OD1-N 3.16Å; D337-R705 IonicContact OD1-CZ 3.59Å; D337-R705 VanDerWaalsContact OD1-CZ 3.3Å; D337-R705 IonicContact OD1-NH1 2.71Å; D337-R705 PolarHBondContact OD1-NH1 3.3Å; D337-R705 IonicContact OD1-NH2 3.35Å; D337-R705 IonicContact OD2-CZ 3.61Å; D337-R705 IonicContact OD2-NE 3.01Å; D337-R705 IonicContact OD2-NH1 3.31Å; D337-R705 PolarHBondContact OD2-NH1 2.93Å
338	E	86.3	Confident	88.1	Confident	174 Å²	174	62.5 Å²	62.5	81%	0.813	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.2	179.1	-62.1	-179	173.5	0	0	112.9	D340 E341	E338-D340 VanDerWaalsContact C-N 3.29Å; E338-D340 PolarHBondContact O-N 3.36Å; E338-E341 PolarHBondContact O-N 2.74Å
339	A	86.5	Confident	87.9	Confident	16 Å²	16	63.6 Å²	63.6	13%	0.132	33%	0.33	C	S	.	.	H	α-helix	trans	-72.2	-26.9	179.7	0	0	0	0	0	111.8	D337 E341 K342 I343 V707	D337-A339 PolarHBondContact O-N 3.46Å; D337-A339 WeakPolarHBondContact OD1-CB 3.33Å; D337-A339 PolarHBondContact OD1-N 3.35Å; D337-A339 VanDerWaalsContact OD1-N 3.1Å; A339-E341 VanDerWaalsContact C-N 3.28Å; A339-E341 PolarHBondContact O-N 3.49Å; A339-K342 PolarHBondContact O-N 3.14Å; A339-I343 PolarHBondContact O-N 2.81Å; A339-V707 HydrophobicContact CB-CB 4.38Å; A339-V707 HydrophobicContact CB-CG2 3.78Å
340	D	90.2	Very high	87.9	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-61.4	-33	173.7	-76.7	-14	0	0	0	112.7	F332 T333 W334 W335 K336 D337 E338 K342 I343 A344 R705	F332-D340 HydrophobicContact CD2-CB 3.97Å; F332-D340 WeakPolarHBondContact CD2-OD1 3.45Å; F332-D340 HydrophobicContact CE2-CB 3.55Å; F332-D340 WeakPolarHBondContact CE2-O 3.36Å; F332-D340 HydrophobicContact CZ-CB 4.22Å; T333-D340 WeakPolarHBondContact CA-OD2 3.31Å; T333-D340 PolarHBondContact N-OD1 2.64Å; T333-D340 PolarHBondContact N-OD2 2.95Å; T333-D340 VanDerWaalsContact N-OD2 3.17Å; T333-D340 VanDerWaalsContact OG1-CG 3.26Å; T333-D340 PolarHBondContact OG1-OD1 3.3Å; T333-D340 PolarHBondContact OG1-OD2 3.49Å; W334-D340 PolarHBondContact N-OD2 2.99Å; W335-D340 WeakPolarHBondContact CA-OD2 3.41Å; W335-D340 HydrophobicContact CE3-CB 4.45Å; W335-D340 PolarHBondContact N-OD2 3.49Å; K336-D340 PolarHBondContact N-OD2 2.87Å; D337-D340 PolarHBondContact O-N 3.37Å; D337-D340 PolarHBondContact OD1-N 3.38Å; D337-D340 VanDerWaalsContact OD1-N 3.16Å; E338-D340 VanDerWaalsContact C-N 3.29Å; E338-D340 PolarHBondContact O-N 3.36Å; D340-K342 VanDerWaalsContact C-N 3.31Å; D340-K342 PolarHBondContact O-N 2.84Å; D340-I343 PolarHBondContact O-N 2.91Å; D340-A344 VanDerWaalsContact O-CB 3.25Å; D340-A344 WeakPolarHBondContact O-CB 3.32Å; D340-A344 PolarHBondContact O-N 3Å; D340-R705 IonicContact OD1-CZ 3.77Å; D340-R705 VanDerWaalsContact OD1-CZ 3.31Å; D340-R705 IonicContact OD1-NH1 3.6Å; D340-R705 PolarHBondContact OD1-NH1 2.98Å; D340-R705 IonicContact OD1-NH2 3.3Å; D340-R705 PolarHBondContact OD1-NH2 3.43Å
341	E	88.1	Confident	87.9	Confident	127 Å²	127	65 Å²	65	59%	0.593	33%	0.329	S	S	*	.	H	α-helix	trans	-62.2	-40.3	178.3	-171.3	173.7	-168.5	0	0	111.7	W335 E338 A339 A344 C345	W335-E341 HydrophobicContact CZ3-CB 4.41Å; E338-E341 PolarHBondContact O-N 2.74Å; A339-E341 VanDerWaalsContact C-N 3.28Å; A339-E341 PolarHBondContact O-N 3.49Å; E341-A344 PolarHBondContact O-N 3.27Å; E341-C345 PolarHBondContact O-N 3.17Å; E341-C345 PolarHBondContact O-SG 2.92Å
342	K	86.7	Confident	88.1	Confident	128 Å²	128	65.6 Å²	65.6	56%	0.557	34%	0.337	S	S	*	.	H	α-helix	trans	-66.5	-44.5	175.3	-66.5	-179	-178.8	175	0	111.7	A339 D340 A344 C345 Q346	A339-K342 PolarHBondContact O-N 3.14Å; D340-K342 VanDerWaalsContact C-N 3.31Å; D340-K342 PolarHBondContact O-N 2.84Å; K342-A344 VanDerWaalsContact C-N 3.34Å; K342-C345 PolarHBondContact O-N 3.18Å; K342-Q346 WeakPolarHBondContact O-CG 3.46Å; K342-Q346 PolarHBondContact O-N 3.46Å; K342-Q346 VanDerWaalsContact O-N 3.07Å
343	I	87.3	Confident	88.1	Confident	14 Å²	14	66.1 Å²	66.1	7%	0.072	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-43.9	177.3	-63.8	-178.7	0	0	0	110.2	P328 F332 A339 D340 C345 Q346 A347 V707	P328-I343 HydrophobicContact CB-CG2 4.38Å; P328-I343 VanDerWaalsContact O-CG2 3.24Å; P328-I343 WeakPolarHBondContact O-CG2 3.37Å; F332-I343 HydrophobicContact CB-CG2 4.41Å; F332-I343 HydrophobicContact CD2-CB 3.98Å; F332-I343 HydrophobicContact CD2-CG2 3.71Å; F332-I343 HydrophobicContact CE2-CB 4.5Å; F332-I343 HydrophobicContact CE2-CG2 4.48Å; F332-I343 HydrophobicContact CG-CG2 4.48Å; A339-I343 PolarHBondContact O-N 2.81Å; D340-I343 PolarHBondContact O-N 2.91Å; I343-C345 PolarHBondContact O-N 3.13Å; I343-Q346 PolarHBondContact O-N 3.42Å; I343-Q346 VanDerWaalsContact O-N 3.15Å; I343-A347 WeakPolarHBondContact O-CB 3.35Å; I343-A347 PolarHBondContact O-N 2.96Å; I343-V707 HydrophobicContact CD1-CG2 4.04Å; I343-V707 HydrophobicContact CG1-CG1 4.25Å; I343-V707 HydrophobicContact CG1-CG2 4.23Å
344	A	88.7	Confident	88.3	Confident	10 Å²	10	68.7 Å²	68.7	8%	0.083	35%	0.348	C	S	.	.	H	α-helix	trans	-60.6	-43.7	178.6	0	0	0	0	0	112	W161 F332 W335 D340 E341 K342 Q346 A347 A348	W161-A344 HydrophobicContact CH2-CB 3.74Å; W161-A344 HydrophobicContact CZ3-CB 4.14Å; F332-A344 HydrophobicContact CE2-CB 4.19Å; W335-A344 HydrophobicContact CH2-CB 3.48Å; W335-A344 VanDerWaalsContact CH2-CB 3.48Å; W335-A344 HydrophobicContact CZ2-CB 4.04Å; W335-A344 HydrophobicContact CZ3-CB 4.16Å; D340-A344 VanDerWaalsContact O-CB 3.25Å; D340-A344 WeakPolarHBondContact O-CB 3.32Å; D340-A344 PolarHBondContact O-N 3Å; E341-A344 PolarHBondContact O-N 3.27Å; K342-A344 VanDerWaalsContact C-N 3.34Å; A344-Q346 VanDerWaalsContact C-N 3.32Å; A344-Q346 PolarHBondContact O-N 2.9Å; A344-A347 PolarHBondContact O-N 2.94Å; A344-A348 PolarHBondContact O-N 3.06Å
345	C	85.6	Confident	88.5	Confident	93 Å²	93	67.4 Å²	67.4	63%	0.628	34%	0.344	S	S	*	.	H	α-helix	trans	-62.7	-37.5	175	-69.6	0	0	0	0	112.5	E341 K342 I343	E341-C345 PolarHBondContact O-N 3.17Å; E341-C345 PolarHBondContact O-SG 2.92Å; K342-C345 PolarHBondContact O-N 3.18Å; I343-C345 PolarHBondContact O-N 3.13Å
346	Q	81.9	Confident	88.8	Confident	78 Å²	78	63 Å²	63	36%	0.364	33%	0.334	S	S	.	.	H	α-helix	trans	-72.8	-35.1	177.2	-70.8	173.7	0.4	0	0	112.7	K342 I343 A344 R456 G711	K342-Q346 WeakPolarHBondContact O-CG 3.46Å; K342-Q346 PolarHBondContact O-N 3.46Å; K342-Q346 VanDerWaalsContact O-N 3.07Å; I343-Q346 PolarHBondContact O-N 3.42Å; I343-Q346 VanDerWaalsContact O-N 3.15Å; A344-Q346 VanDerWaalsContact C-N 3.32Å; A344-Q346 PolarHBondContact O-N 2.9Å; Q346-R456 PolarHBondContact O-NH1 2.83Å; Q346-G711 VanDerWaalsContact OE1-CA 3.31Å
347	A	82.6	Confident	89.2	Confident	15 Å²	15	56.4 Å²	56.4	12%	0.124	31%	0.306	C	S	.	.	H	α-helix	trans	-74.3	-25.9	179.3	0	0	0	0	0	112.8	W161 C326 I343 A344 L349	W161-A347 HydrophobicContact CH2-CB 4.35Å; W161-A347 HydrophobicContact CZ2-CB 4.47Å; C326-A347 PolarHBondContact SG-O 3Å; I343-A347 WeakPolarHBondContact O-CB 3.35Å; I343-A347 PolarHBondContact O-N 2.96Å; A344-A347 PolarHBondContact O-N 2.94Å; A347-L349 PolarHBondContact O-N 2.87Å
348	A	84.6	Confident	89.7	Confident	51 Å²	51	53.8 Å²	53.8	42%	0.421	29%	0.292	S	S	.	.			trans	-61.6	129.7	177.1	0	0	0	0	0	111.6	A344	A344-A348 PolarHBondContact O-N 3.06Å
349	L	89	Confident	90.2	Very high	33 Å²	33	47.2 Å²	47.2	17%	0.173	26%	0.264	C	S	.	.			trans	-107.8	124.2	179.8	-60.2	174.6	0	0	0	110.2	A325 A347 A353 R354 L357	A325-L349 HydrophobicContact CB-CD1 3.63Å; A347-L349 PolarHBondContact O-N 2.87Å; L349-A353 HydrophobicContact CB-CB 4.27Å; L349-A353 HydrophobicContact CD2-CB 3.86Å; L349-R354 HydrophobicContact CB-CG 4.09Å; L349-R354 PolarHBondContact O-NE 2.84Å; L349-R354 PolarHBondContact O-NH2 3.09Å; L349-L357 HydrophobicContact CD1-CD1 3.7Å
350	D	90.7	Very high	90.7	Very high	92 Å²	92	50.2 Å²	50.2	49%	0.492	27%	0.272	S	S	.	.			trans	-76.7	174.1	167.6	67.2	0.4	0	0	0	111.2	S352 A353 R354	D350-S352 PolarHBondContact O-N 3.44Å; D350-S352 PolarHBondContact OD1-N 2.94Å; D350-A353 PolarHBondContact O-N 3.16Å; D350-A353 WeakPolarHBondContact OD1-CB 3.24Å; D350-A353 PolarHBondContact OD1-N 3.01Å; D350-R354 VanDerWaalsContact O-CG 3.29Å; D350-R354 WeakPolarHBondContact O-CG 3.42Å; D350-R354 PolarHBondContact O-N 3.47Å
351	D	90.9	Very high	91	Very high	53 Å²	53	50.9 Å²	50.9	28%	0.283	28%	0.275	S	S	.	.	H	α-helix	trans	-62.1	-29	-179.9	-72.8	-11.4	0	0	0	112.4	M319 R354 L355 I472 R476	M319-D351 HydrophobicContact CE-CB 4.26Å; D351-R354 IonicContact OD1-NH1 2.8Å; D351-R354 PolarHBondContact OD1-NH1 2.89Å; D351-L355 WeakPolarHBondContact O-CB 3.12Å; D351-L355 PolarHBondContact O-N 2.96Å; D351-I472 HydrophobicContact CB-CD1 4.08Å; D351-R476 IonicContact OD2-NH2 3.3Å; D351-R476 PolarHBondContact OD2-NH2 2.83Å
352	S	92.6	Very high	91.5	Very high	64 Å²	64	44.9 Å²	44.9	45%	0.448	25%	0.246	S	C	.	.	H	α-helix	trans	-67.3	-48.7	177.4	-161.9	0	0	0	0	111.6	D350 R354 L355 S356 I472	D350-S352 PolarHBondContact O-N 3.44Å; D350-S352 PolarHBondContact OD1-N 2.94Å; S352-R354 VanDerWaalsContact C-N 3.33Å; S352-R354 PolarHBondContact O-N 2.99Å; S352-L355 PolarHBondContact O-N 3.06Å; S352-S356 PolarHBondContact O-N 3.41Å; S352-I472 VanDerWaalsContact CA-CD1 3.44Å; S352-I472 VanDerWaalsContact N-CD1 3.33Å
353	A	93	Very high	91.9	Very high	19 Å²	19	41.5 Å²	41.5	16%	0.157	24%	0.235	C	C	.	.	H	α-helix	trans	-65.5	-38	178.4	0	0	0	0	0	111.2	L349 D350 S356 L357	L349-A353 HydrophobicContact CB-CB 4.27Å; L349-A353 HydrophobicContact CD2-CB 3.86Å; D350-A353 PolarHBondContact O-N 3.16Å; D350-A353 WeakPolarHBondContact OD1-CB 3.24Å; D350-A353 PolarHBondContact OD1-N 3.01Å; A353-S356 WeakPolarHBondContact O-CB 3.31Å; A353-S356 PolarHBondContact O-N 3.1Å; A353-L357 WeakPolarHBondContact O-CG 3.38Å; A353-L357 PolarHBondContact O-N 2.83Å
354	R	95.3	Very high	92.3	Very high	93 Å²	93	41.7 Å²	41.7	35%	0.351	24%	0.235	S	C	.	.	H	α-helix	trans	-61.4	-46.5	173.4	-69.9	170.4	-171.9	177.4	-4.5	111.8	M319 L322 L349 D350 D351 S352 S356 L357 I358	M319-R354 HydrophobicContact CE-CB 3.72Å; M319-R354 HydrophobicContact CE-CG 4.45Å; M319-R354 HydrophobicContact SD-CB 4.45Å; L322-R354 HydrophobicContact CD2-CB 4.19Å; L322-R354 HydrophobicContact CD2-CG 4.26Å; L349-R354 HydrophobicContact CB-CG 4.09Å; L349-R354 PolarHBondContact O-NE 2.84Å; L349-R354 PolarHBondContact O-NH2 3.09Å; D350-R354 VanDerWaalsContact O-CG 3.29Å; D350-R354 WeakPolarHBondContact O-CG 3.42Å; D350-R354 PolarHBondContact O-N 3.47Å; D351-R354 IonicContact OD1-NH1 2.8Å; D351-R354 PolarHBondContact OD1-NH1 2.89Å; S352-R354 VanDerWaalsContact C-N 3.33Å; S352-R354 PolarHBondContact O-N 2.99Å; R354-S356 VanDerWaalsContact C-N 3.31Å; R354-S356 PolarHBondContact O-N 3.11Å; R354-L357 PolarHBondContact O-N 3.47Å; R354-I358 WeakPolarHBondContact O-CG1 3.3Å; R354-I358 PolarHBondContact O-N 2.86Å
355	L	95.9	Very high	92.4	Very high	8 Å²	8	44.1 Å²	44.1	4%	0.042	25%	0.245	C	C	.	.	H	α-helix	trans	-63.3	-38	175.5	-177.5	60.5	0	0	0	111.9	I312 D351 S352 L357 I358 T359 I472 V475	I312-L355 HydrophobicContact CD1-CD1 3.91Å; D351-L355 WeakPolarHBondContact O-CB 3.12Å; D351-L355 PolarHBondContact O-N 2.96Å; S352-L355 PolarHBondContact O-N 3.06Å; L355-L357 VanDerWaalsContact C-N 3.34Å; L355-L357 PolarHBondContact O-N 2.96Å; L355-I358 PolarHBondContact O-N 2.96Å; L355-T359 HydrophobicContact CD1-CG2 4.27Å; L355-T359 HydrophobicContact CG-CG2 4.49Å; L355-T359 WeakPolarHBondContact O-CG2 3.18Å; L355-T359 PolarHBondContact O-N 3.36Å; L355-T359 PolarHBondContact O-OG1 3.5Å; L355-I472 HydrophobicContact CD2-CG1 4.06Å; L355-V475 HydrophobicContact CD1-CG2 3.91Å; L355-V475 HydrophobicContact CD2-CG2 3.85Å
356	S	95.4	Very high	92.8	Very high	45 Å²	45	43.5 Å²	43.5	32%	0.315	23%	0.233	S	C	.	.	H	α-helix	trans	-61.9	-40.2	174.2	-171.6	0	0	0	0	112.2	S352 A353 R354 T359 R360	S352-S356 PolarHBondContact O-N 3.41Å; A353-S356 WeakPolarHBondContact O-CB 3.31Å; A353-S356 PolarHBondContact O-N 3.1Å; R354-S356 VanDerWaalsContact C-N 3.31Å; R354-S356 PolarHBondContact O-N 3.11Å; S356-T359 WeakPolarHBondContact CA-OG1 3.39Å; S356-T359 PolarHBondContact O-OG1 3.08Å; S356-T359 VanDerWaalsContact O-OG1 3.04Å; S356-R360 WeakPolarHBondContact O-CB 3.28Å; S356-R360 PolarHBondContact O-N 2.79Å
357	L	96	Very high	93.2	Very high	16 Å²	16	40.8 Å²	40.8	8%	0.084	22%	0.221	C	C	.	.	H	α-helix	trans	-65.4	-45	173.3	-70.4	174.5	0	0	0	111.3	L268 L270 L322 L349 A353 R354 L355 R360 Y361 W458	L268-L357 HydrophobicContact CD1-CB 4.19Å; L270-L357 HydrophobicContact CD2-CD2 4.27Å; L322-L357 HydrophobicContact CD2-CB 4.13Å; L322-L357 HydrophobicContact CD2-CD1 4.01Å; L349-L357 HydrophobicContact CD1-CD1 3.7Å; A353-L357 WeakPolarHBondContact O-CG 3.38Å; A353-L357 PolarHBondContact O-N 2.83Å; R354-L357 PolarHBondContact O-N 3.47Å; L355-L357 VanDerWaalsContact C-N 3.34Å; L355-L357 PolarHBondContact O-N 2.96Å; L357-R360 WeakPolarHBondContact O-CB 3.37Å; L357-R360 PolarHBondContact O-N 3.46Å; L357-Y361 WeakPolarHBondContact O-CD2 3.46Å; L357-Y361 PolarHBondContact O-N 2.84Å; L357-Y361 VanDerWaalsContact O-N 3.14Å; L357-W458 HydrophobicContact CD2-CH2 4.49Å
358	I	97.2	Very high	93.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.6	-53.5	178.3	-73.9	164.2	0	0	0	111.1	I266 I312 M319 L322 R354 L355 R360 Y361 M362 I364	I266-I358 HydrophobicContact CD1-CD1 3.69Å; I266-I358 HydrophobicContact CD1-CG1 4.08Å; I312-I358 HydrophobicContact CD1-CG2 3.99Å; I312-I358 HydrophobicContact CG2-CG2 4.31Å; M319-I358 HydrophobicContact CG-CD1 4.47Å; M319-I358 HydrophobicContact SD-CD1 3.93Å; L322-I358 HydrophobicContact CD1-CG1 4.38Å; R354-I358 WeakPolarHBondContact O-CG1 3.3Å; R354-I358 PolarHBondContact O-N 2.86Å; L355-I358 PolarHBondContact O-N 2.96Å; I358-R360 PolarHBondContact O-N 2.93Å; I358-Y361 PolarHBondContact O-N 2.83Å; I358-Y361 VanDerWaalsContact O-N 3.12Å; I358-M362 HydrophobicContact CB-CE 4.4Å; I358-M362 HydrophobicContact CG1-CE 4.49Å; I358-M362 HydrophobicContact CG2-CE 3.53Å; I358-M362 PolarHBondContact O-N 3.19Å; I358-I364 HydrophobicContact CG2-CD1 3.78Å; I358-I364 HydrophobicContact CG2-CG1 4.26Å
359	T	96.3	Very high	93.8	Very high	36 Å²	36	42.6 Å²	42.6	22%	0.221	23%	0.232	C	C	.	.	H	α-helix	trans	-62.9	-29.5	178.5	50.7	0	0	0	0	112.8	R279 L355 S356 M362 I364	R279-T359 PolarHBondContact NH2-O 3.49Å; L355-T359 HydrophobicContact CD1-CG2 4.27Å; L355-T359 HydrophobicContact CG-CG2 4.49Å; L355-T359 WeakPolarHBondContact O-CG2 3.18Å; L355-T359 PolarHBondContact O-N 3.36Å; L355-T359 PolarHBondContact O-OG1 3.5Å; S356-T359 WeakPolarHBondContact CA-OG1 3.39Å; S356-T359 PolarHBondContact O-OG1 3.08Å; S356-T359 VanDerWaalsContact O-OG1 3.04Å; T359-M362 VanDerWaalsContact O-O 3.09Å; T359-I364 HydrophobicContact CG2-CB 4.48Å; T359-I364 HydrophobicContact CG2-CG1 3.9Å
360	R	96.3	Very high	93.6	Very high	79 Å²	79	46.6 Å²	46.6	30%	0.298	25%	0.25	S	C	.	.	H	α-helix	trans	-70.9	-29.2	175.3	-170.9	178.2	-54.3	172	7	113.5	S274 R279 S356 L357 I358	S274-R360 WeakPolarHBondContact CB-O 3.37Å; R279-R360 PolarHBondContact NH1-O 2.98Å; S356-R360 WeakPolarHBondContact O-CB 3.28Å; S356-R360 PolarHBondContact O-N 2.79Å; L357-R360 WeakPolarHBondContact O-CB 3.37Å; L357-R360 PolarHBondContact O-N 3.46Å; I358-R360 PolarHBondContact O-N 2.93Å
361	Y	97.7	Very high	92.5	Very high	15 Å²	15	49.8 Å²	49.8	6%	0.059	26%	0.259	C	S	.	.	H	α-helix	trans	-107.3	-14.7	-178.2	-77.8	-94.6	0	0	0	114.4	P241 L268 P269 L270 C272 C277 R279 L357 I358	P241-Y361 WeakPolarHBondContact CG-O 3.35Å; L268-Y361 HydrophobicContact CB-CG 4.43Å; L268-Y361 HydrophobicContact CD1-CD2 4.07Å; L268-Y361 HydrophobicContact CD1-CG 4.29Å; L268-Y361 HydrophobicContact CD2-CG 4.47Å; P269-Y361 HydrophobicContact CG-CD1 4.01Å; P269-Y361 HydrophobicContact CG-CE1 4.07Å; L270-Y361 HydrophobicContact CD2-CD2 4.29Å; L270-Y361 HydrophobicContact CD2-CE2 3.74Å; C272-Y361 PolarHBondContact O-OH 3.17Å; C277-Y361 HydrophobicContact CB-CD1 4.32Å; R279-Y361 WeakPolarHBondContact CA-O 3.31Å; L357-Y361 WeakPolarHBondContact O-CD2 3.46Å; L357-Y361 PolarHBondContact O-N 2.84Å; L357-Y361 VanDerWaalsContact O-N 3.14Å; I358-Y361 PolarHBondContact O-N 2.83Å; I358-Y361 VanDerWaalsContact O-N 3.12Å
362	M	97	Very high	91.1	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.28	C	S	.	.	S	Bend	trans	-130.7	148.5	-179	-64.5	-172	-60.9	0	0	111.9	P241 V243 I266 L268 R279 P281 I312 I358 T359 I364 A484	P241-M362 HydrophobicContact CB-CG 3.76Å; P241-M362 HydrophobicContact CB-SD 3.77Å; P241-M362 HydrophobicContact CG-CG 3.7Å; P241-M362 HydrophobicContact CG-SD 4.4Å; V243-M362 HydrophobicContact CG2-SD 4.07Å; I266-M362 HydrophobicContact CD1-CE 4.19Å; I266-M362 HydrophobicContact CG2-CE 3.88Å; L268-M362 HydrophobicContact CD2-CE 4.49Å; L268-M362 HydrophobicContact CD2-CG 4.43Å; L268-M362 HydrophobicContact CD2-SD 4.49Å; R279-M362 PolarHBondContact NH2-O 3.26Å; R279-M362 WeakPolarHBondContact O-CA 3.47Å; P281-M362 HydrophobicContact CB-SD 3.99Å; P281-M362 HydrophobicContact CG-SD 4.27Å; I312-M362 HydrophobicContact CG2-CE 4.14Å; I358-M362 HydrophobicContact CB-CE 4.4Å; I358-M362 HydrophobicContact CG1-CE 4.49Å; I358-M362 HydrophobicContact CG2-CE 3.53Å; I358-M362 PolarHBondContact O-N 3.19Å; T359-M362 VanDerWaalsContact O-O 3.09Å; M362-I364 HydrophobicContact CB-CD1 3.93Å; M362-I364 HydrophobicContact CE-CD1 4.41Å; M362-I364 PolarHBondContact O-N 2.8Å; M362-A484 HydrophobicContact CB-CB 4.18Å; M362-A484 HydrophobicContact CE-CB 4.22Å; M362-A484 HydrophobicContact SD-CB 3.89Å
363	D	95.1	Very high	89	Confident	58 Å²	58	53.9 Å²	53.9	31%	0.31	30%	0.295	S	S	.	.			trans	-80.8	110.5	170.7	-67.4	-37.9	0	0	0	109.5	R279 A484 K485	R279-D363 VanDerWaalsContact CB-OD2 3.31Å; R279-D363 WeakPolarHBondContact CB-OD2 3.42Å; R279-D363 IonicContact CZ-OD1 3.32Å; R279-D363 IonicContact NE-OD1 3.62Å; R279-D363 PolarHBondContact NE-OD1 2.93Å; R279-D363 IonicContact NE-OD2 3.13Å; R279-D363 IonicContact NH2-OD1 3.95Å; R279-D363 PolarHBondContact NH2-OD1 2.8Å; R279-D363 VanDerWaalsContact NH2-OD1 3.12Å; D363-A484 CarbonylContact O-C 3.5Å; D363-A484 WeakPolarHBondContact O-CA 3.4Å; D363-K485 HydrophobicContact CB-CB 4.35Å; D363-K485 PolarHBondContact O-N 3.04Å
364	I	95.6	Very high	86.7	Confident	18 Å²	18	61.8 Å²	61.8	9%	0.092	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	131.9	-175.6	-55.1	-55.5	0	0	0	109.9	I312 I358 T359 M362 V470 V482 G483 A484	I312-I364 HydrophobicContact CG2-CD1 4.11Å; I358-I364 HydrophobicContact CG2-CD1 3.78Å; I358-I364 HydrophobicContact CG2-CG1 4.26Å; T359-I364 HydrophobicContact CG2-CB 4.48Å; T359-I364 HydrophobicContact CG2-CG1 3.9Å; M362-I364 HydrophobicContact CB-CD1 3.93Å; M362-I364 HydrophobicContact CE-CD1 4.41Å; M362-I364 PolarHBondContact O-N 2.8Å; I364-V470 HydrophobicContact CB-CG2 4.43Å; I364-V470 HydrophobicContact CG2-CG2 3.93Å; I364-V482 HydrophobicContact CG2-CG1 3.35Å; I364-G483 WeakPolarHBondContact CA-O 3.33Å; I364-A484 HydrophobicContact CD1-CB 3.97Å
365	E	92.4	Very high	84	Confident	60 Å²	60	61.2 Å²	61.2	28%	0.28	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	145	174.8	-66.5	-173.8	176.7	0	0	110.3	G483 K485	E365-G483 PolarHBondContact N-O 3.34Å; E365-G483 PolarHBondContact O-N 2.84Å; E365-K485 HydrophobicContact CG-CB 4.47Å; E365-K485 WeakPolarHBondContact OE1-CD 3.44Å; E365-K485 WeakPolarHBondContact OE1-CE 3.28Å; E365-K485 IonicContact OE1-NZ 2.98Å; E365-K485 PolarHBondContact OE1-NZ 3.12Å
366	E	92.7	Very high	81.3	Confident	80 Å²	80	64.8 Å²	64.8	37%	0.374	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122.7	174.8	-64.1	175.7	-157	0	0	109.4	V470 V482	E366-V470 HydrophobicContact CG-CG2 4.35Å; E366-V470 WeakPolarHBondContact OE1-CG2 3.49Å; E366-V482 HydrophobicContact CG-CG2 4.35Å
367	I	91	Very high	78.6	Confident	22 Å²	22	67.7 Å²	67.7	11%	0.113	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	127.6	-177.2	-57.6	-174.7	0	0	0	109.7	C105 P307 I309 L480 I481	C105-I367 WeakPolarHBondContact SG-CD1 3.25Å; P307-I367 HydrophobicContact CB-CD1 4.29Å; P307-I367 HydrophobicContact CG-CD1 3.62Å; I309-I367 HydrophobicContact CB-CD1 4.44Å; I309-I367 HydrophobicContact CD1-CD1 3.48Å; I309-I367 VanDerWaalsContact CD1-CD1 3.48Å; I309-I367 HydrophobicContact CD1-CG1 4.37Å; I309-I367 HydrophobicContact CG1-CD1 3.74Å; I309-I367 HydrophobicContact CG2-CD1 3.9Å; I367-L480 CarbonylContact O-C 3.57Å; I367-L480 WeakPolarHBondContact O-CA 3.24Å; I367-I481 HydrophobicContact CB-CB 4.45Å; I367-I481 PolarHBondContact N-O 3.49Å; I367-I481 PolarHBondContact O-N 3.38Å
368	A	90.8	Very high	76	Confident	68 Å²	68	73.6 Å²	73.6	56%	0.562	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	134.4	176.8	0	0	0	0	0	111.3
369	V	89.2	Confident	73.2	Confident	35 Å²	35	77.7 Å²	77.7	21%	0.212	45%	0.452	C	S	.	.			trans	-74.3	128.6	173.1	175.7	0	0	0	0	109.6	E102 K371 N479 I481	E102-V369 HydrophobicContact CB-CG1 4.28Å; V369-K371 PolarHBondContact O-N 2.97Å; V369-N479 PolarHBondContact N-O 2.68Å; V369-I481 HydrophobicContact CG2-CD1 4.06Å; V369-I481 HydrophobicContact CG2-CG1 3.76Å
370	E	84.7	Confident	70.6	Confident	118 Å²	118	80.4 Å²	80.4	55%	0.551	47%	0.473	S	S	*	.			trans	-75.9	106	176.1	-67.5	179.4	-161.8	0	0	109.3	E102 S104	E102-E370 PolarHBondContact O-N 3.15Å; S104-E370 WeakPolarHBondContact CB-OE1 3.33Å; S104-E370 PolarHBondContact N-OE1 3.08Å; S104-E370 PolarHBondContact OG-OE1 3.07Å
371	K	68.1	Low	68	Low	158 Å²	158	81.5 Å²	81.5	69%	0.687	49%	0.492	S	S	*	.			trans	-65.4	131.2	174.4	-70.2	-177.7	-179.2	175.9	0	109.2	V369 A373	V369-K371 PolarHBondContact O-N 2.97Å; K371-A373 PolarHBondContact O-N 2.94Å
372	P	60	Low	65.1	Low	113 Å²	113	86.3 Å²	86.3	73%	0.734	52%	0.523	S	S	*	.			trans	-61.3	114.4	176.4	23.3	-31.4	0	0	0	109.4	K374	P372-K374 PolarHBondContact O-N 2.85Å
373	A	48.6	Very low	62.3	Low	91 Å²	91	95 Å²	95	75%	0.752	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	14.1	-176.9	0	0	0	0	0	114.9	K371	K371-A373 PolarHBondContact O-N 2.94Å
374	K	46.2	Very low	59.6	Low	185 Å²	185	97.1 Å²	97.1	80%	0.804	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	12.5	-169.3	-77	-174.1	176.6	175.7	0	116.5	P372	P372-K374 PolarHBondContact O-N 2.85Å
375	A	38.4	Very low	56.9	Low	81 Å²	81	105 Å²	105	67%	0.669	62%	0.619	S	S	*	*	S	Bend	trans	-105.1	-13	172.3	0	0	0	0	0	114.7
376	A	37.9	Very low	54.3	Low	83 Å²	83	107.5 Å²	107.5	69%	0.686	64%	0.643	S	S	*	*	S	Bend	trans	-91.2	-13.8	-174.2	0	0	0	0	0	115
377	T	40.2	Very low	51.6	Low	105 Å²	105	108.7 Å²	108.7	64%	0.644	66%	0.66	S	S	*	*	S	Bend	trans	-98.1	-5.7	-175.5	-28.8	0	0	0	0	114.2
378	L	39.9	Very low	49.2	Very low	141 Å²	141	114.4 Å²	114.4	74%	0.738	70%	0.695	S	S	*	*	S	Bend	trans	-102.1	-12.3	176.7	-83.9	137.9	0	0	0	113.6
379	A	40	Very low	46.6	Very low	86 Å²	86	115.5 Å²	115.5	71%	0.711	71%	0.705	S	S	*	*	S	Bend	trans	-89	-7.9	177.2	0	0	0	0	0	113.7
380	S	41.2	Very low	44	Very low	93 Å²	93	119.1 Å²	119.1	65%	0.65	73%	0.729	S	S	*	*	S	Bend	trans	-104.4	3.4	-177.5	61.3	0	0	0	0	115.1
381	S	40.8	Very low	41.7	Very low	101 Å²	101	124.2 Å²	124.2	71%	0.706	75%	0.75	S	S	*	*	S	Bend	trans	-120.8	16.6	-177.5	-72.5	0	0	0	0	115.3
382	V	37.8	Very low	40.1	Very low	116 Å²	116	120.4 Å²	120.4	70%	0.703	76%	0.756	S	S	*	*			trans	-115.1	58.8	177.5	-167.1	0	0	0	0	110.6
383	H	38	Very low	38.8	Very low	183 Å²	183	120 Å²	120	85%	0.847	76%	0.755	S	S	*	*	S	Bend	trans	-150.8	65.8	168.1	-82.6	89.8	0	0	0	109.8
384	S	37.3	Very low	38.2	Very low	103 Å²	103	121.6 Å²	121.6	72%	0.72	76%	0.761	S	S	*	*	S	Bend	trans	175.8	140.1	154.2	28.4	0	0	0	0	110.3
385	H	40.4	Very low	37.6	Very low	183 Å²	183	120.1 Å²	120.1	85%	0.847	76%	0.762	S	S	*	*			trans	90.8	82.9	176.8	-57.1	-74	0	0	0	117.2
386	S	36.9	Very low	37.6	Very low	112 Å²	112	122.1 Å²	122.1	78%	0.783	77%	0.771	S	S	*	*			trans	-62.4	135	150.8	67.7	0	0	0	0	110.9
387	S	37	Very low	37.3	Very low	106 Å²	106	124.5 Å²	124.5	74%	0.741	77%	0.772	S	S	*	*				163.3	121.2	119.6	47.9	0	0	0	0	112.3
388	V	40.5	Very low	36.9	Very low	141 Å²	141	125.8 Å²	125.8	86%	0.855	78%	0.784	S	S	*	*			trans	69.8	103.5	140.5	-172.7	0	0	0	0	119.2
389	A	35.8	Very low	36.3	Very low	91 Å²	91	128 Å²	128	75%	0.752	79%	0.788	S	S	*	*				160.3	126	112.7	0	0	0	0	0	111.3
390	P	34.4	Very low	35.9	Very low	112 Å²	112	136 Å²	136	73%	0.727	80%	0.799	S	S	*	*			trans	-115.8	121.8	171.9	33.9	-20.2	0	0	0	111.9
391	F	36.3	Very low	35.1	Very low	224 Å²	224	141.2 Å²	141.2	98%	0.982	81%	0.811	S	S	*	*			trans	-159.5	136.3	160.8	-91.5	-73.8	0	0	0	111.6
392	G	34.3	Very low	34.6	Very low	79 Å²	79	140.9 Å²	140.9	81%	0.814	81%	0.808	S	S	*	*			trans	127	79.4	153.3	0	0	0	0	0	116.8
393	S	32.5	Very low	34.1	Very low	104 Å²	104	146.5 Å²	146.5	73%	0.727	82%	0.817	S	S	*	*			trans	-72	144.4	163	177.5	0	0	0	0	111.3
394	S	36.5	Very low	33.6	Very low	124 Å²	124	143 Å²	143	87%	0.867	81%	0.813	S	S	*	*			trans	-160	107.7	149.1	-81.5	0	0	0	0	110.8
395	D	33.1	Very low	33.3	Very low	155 Å²	155	150 Å²	150	83%	0.829	82%	0.824	S	S	*	*			trans	-61.2	141.2	165.1	-74.5	-48.4	0	0	0	111.7
396	S	39.6	Very low	32.7	Very low	123 Å²	123	146.5 Å²	146.5	86%	0.86	82%	0.82	S	S	*	*			trans	-150.1	120.6	144.1	55.5	0	0	0	0	111.5
397	N	31.8	Very low	32.3	Very low	133 Å²	133	150.2 Å²	150.2	71%	0.711	83%	0.827	S	S	*	*			trans	-83.5	135.4	179.6	-176.3	5.9	0	0	0	109.5
398	C	30.7	Very low	31.9	Very low	132 Å²	132	149.2 Å²	149.2	89%	0.892	83%	0.833	S	S	*	*			trans	-147.5	94.9	161.9	-94.6	0	0	0	0	111.3
399	K	27.5	Very low	31.2	Very low	188 Å²	188	149.6 Å²	149.6	82%	0.817	83%	0.83	S	S	*	*			trans	-62.2	132.9	157.4	-69.9	173.9	175.7	171.1	0	110
400	R	32.1	Very low	30.7	Very low	252 Å²	252	151.9 Å²	151.9	95%	0.951	83%	0.829	S	S	*	*			trans	-141.8	114	155.3	-109.4	-178.1	-174.6	-176.9	2.1	111.6
401	K	24.8	Very low	30.4	Very low	204 Å²	204	156.5 Å²	156.5	89%	0.887	84%	0.838	S	S	*	*			trans	-79.2	143.1	160.4	-60.6	174.6	174.1	-178.5	0	108.2
402	S	28.8	Very low	30.3	Very low	93 Å²	93	154 Å²	154	65%	0.65	83%	0.834	S	S	*	*			trans	-170.1	111	154.8	-169.2	0	0	0	0	114.7
403	W	27.5	Very low	30	Very low	234 Å²	234	159.6 Å²	159.6	89%	0.886	84%	0.839	S	S	*	*			trans	67.6	112.6	133.1	-53.3	-4.3	0	0	0	119.2
404	S	26.9	Very low	29.8	Very low	110 Å²	110	159.5 Å²	159.5	77%	0.769	84%	0.839	S	S	*	*				65	109.5	63.7	-50.7	0	0	0	0	115.1
405	R	32	Very low	29.7	Very low	250 Å²	250	162.5 Å²	162.5	94%	0.943	83%	0.832	S	S	*	*			trans	168.9	102.7	147.4	-93.5	160.7	178.3	-150	-2.1	108.4
406	S	26.8	Very low	29.8	Very low	110 Å²	110	161.4 Å²	161.4	77%	0.769	83%	0.825	S	S	*	*				62.6	103.7	79.4	-169.3	0	0	0	0	114.6
407	M	29.3	Very low	29.4	Very low	190 Å²	190	163 Å²	163	94%	0.936	83%	0.83	S	S	*	*			trans	169.3	118.6	130.9	-96.5	-171.2	-72.7	0	0	110.2
408	G	28.2	Very low	29.5	Very low	84 Å²	84	159 Å²	159	87%	0.866	82%	0.821	S	S	*	*			trans	159.2	53.9	174.7	0	0	0	0	0	113.1
409	N	25.7	Very low	29.9	Very low	149 Å²	149	155.8 Å²	155.8	80%	0.797	80%	0.799	S	S	*	*			trans	-77.2	150.3	-175.1	-108.7	0.8	0	0	0	112.9
410	L	26.9	Very low	30.5	Very low	139 Å²	139	155.7 Å²	155.7	73%	0.728	80%	0.799	S	S	*	*			trans	73	105.2	148.4	-63.2	155.5	0	0	0	117.4
411	F	28.1	Very low	30.9	Very low	209 Å²	209	149.8 Å²	149.8	92%	0.917	78%	0.782	S	S	*	*	S	Bend	trans	168.9	63.3	137.8	-95.6	-72.4	0	0	0	110.6
412	L	32.7	Very low	31.8	Very low	172 Å²	172	146.5 Å²	146.5	90%	0.901	77%	0.768	S	S	*	*	S	Bend	trans	-160.2	48.8	162.6	-147.2	72.5	0	0	0	113.7
413	E	28.5	Very low	32.6	Very low	196 Å²	196	144.8 Å²	144.8	92%	0.916	75%	0.751	S	S	*	*			trans	-128.3	14.1	-176.8	-135.2	168.7	-169.5	0	0	114.9
414	S	29.4	Very low	33.6	Very low	103 Å²	103	139 Å²	139	72%	0.72	74%	0.737	S	S	*	*	S	Bend	trans	-115.4	15.6	-171.4	69.5	0	0	0	0	117.7
415	Y	32.6	Very low	34.8	Very low	186 Å²	186	139.8 Å²	139.8	73%	0.729	73%	0.726	S	S	*	*	S	Bend	trans	-129.6	15.7	-177.8	-89.6	-80.6	0	0	0	117.6
416	I	35.2	Very low	35.4	Very low	132 Å²	132	130.3 Å²	130.3	68%	0.677	69%	0.694	S	S	*	*			trans	-128.1	70.7	176.5	-47.2	-179.9	0	0	0	111.1
417	T	31.3	Very low	36.4	Very low	156 Å²	156	130.7 Å²	130.7	96%	0.957	68%	0.679	S	S	*	*			trans	-96.1	77.9	154	49.9	0	0	0	0	108.4
418	G	33.7	Very low	37.3	Very low	51 Å²	51	124.3 Å²	124.3	53%	0.526	66%	0.657	S	S	.	*	S	Bend	trans	-154.5	85.3	-179.5	0	0	0	0	0	112.3
419	S	40.6	Very low	38.2	Very low	63 Å²	63	126 Å²	126	44%	0.441	64%	0.636	S	S	.	*			trans	53	98.1	170.2	-167.5	0	0	0	0	117.8	E421 K422	S419-E421 PolarHBondContact O-N 3.41Å; S419-K422 PolarHBondContact O-N 2.98Å
420	K	40	Very low	39.2	Very low	187 Å²	187	119.4 Å²	119.4	81%	0.813	60%	0.602	S	S	*	*	H	α-helix	trans	-48	-25.3	168	-129.7	175.5	-177.2	177	0	113.6	L424	K420-L424 PolarHBondContact O-N 2.84Å
421	E	39.3	Very low	40	Very low	127 Å²	127	121.8 Å²	121.8	59%	0.593	60%	0.601	S	S	*	*	H	α-helix	trans	-77.9	-31.6	-178.6	-156.3	174.6	170.1	0	0	113.2	S419 L424 K425	S419-E421 PolarHBondContact O-N 3.41Å; E421-L424 PolarHBondContact O-N 3.28Å; E421-K425 PolarHBondContact O-N 3.42Å
422	K	45.1	Very low	40.8	Very low	136 Å²	136	121.7 Å²	121.7	59%	0.591	59%	0.594	S	S	*	*	H	α-helix	trans	-67	-39.6	173.2	-73	-174.9	176.7	-176.4	0	111.3	S419 L424 K425 L426	S419-K422 PolarHBondContact O-N 2.98Å; K422-L424 PolarHBondContact O-N 3.32Å; K422-K425 PolarHBondContact O-N 3.04Å; K422-L426 PolarHBondContact O-N 2.93Å
423	L	45.7	Very low	41.1	Very low	56 Å²	56	121.3 Å²	121.3	29%	0.293	58%	0.581	S	S	.	*	H	α-helix	trans	-63.5	-37.1	176	-99.6	161.1	0	0	0	113.1	F258 L426 R427	F258-L423 HydrophobicContact CE2-CD2 3.62Å; F258-L423 HydrophobicContact CZ-CD2 3.65Å; L423-L426 PolarHBondContact O-N 3.12Å; L423-R427 WeakPolarHBondContact O-CB 3.4Å; L423-R427 PolarHBondContact O-N 3.36Å
424	L	46.8	Very low	41.5	Very low	112 Å²	112	115.7 Å²	115.7	59%	0.586	57%	0.568	S	S	*	*	H	α-helix	trans	-67.1	-41.7	176.2	-78.4	158.7	0	0	0	112	K420 E421 K422 R427 A428	K420-L424 PolarHBondContact O-N 2.84Å; E421-L424 PolarHBondContact O-N 3.28Å; K422-L424 PolarHBondContact O-N 3.32Å; L424-R427 PolarHBondContact O-N 2.87Å; L424-A428 PolarHBondContact O-N 3.26Å; L424-A428 VanDerWaalsContact O-N 3.09Å
425	K	52.3	Low	41.6	Very low	127 Å²	127	116.2 Å²	116.2	55%	0.552	57%	0.567	S	S	*	*	H	α-helix	trans	-67.2	-35.3	175.3	-71.3	179.1	-178.7	172.7	0	112.2	E421 K422 R429	E421-K425 PolarHBondContact O-N 3.42Å; K422-K425 PolarHBondContact O-N 3.04Å; K425-R429 WeakPolarHBondContact O-CG 3.49Å; K425-R429 PolarHBondContact O-N 2.79Å
426	L	45.3	Very low	41.5	Very low	51 Å²	51	112.8 Å²	112.8	27%	0.267	57%	0.567	S	S	.	*	H	α-helix	trans	-67.1	-45.2	174.8	-149.7	81.7	0	0	0	111.7	K422 L423 A428 R429 L430	K422-L426 PolarHBondContact O-N 2.93Å; L423-L426 PolarHBondContact O-N 3.12Å; L426-A428 VanDerWaalsContact C-N 3.33Å; L426-A428 PolarHBondContact O-N 3.38Å; L426-R429 PolarHBondContact O-N 3.1Å; L426-R429 VanDerWaalsContact O-N 3.07Å; L426-L430 HydrophobicContact CD2-CD1 4.28Å; L426-L430 HydrophobicContact CG-CD1 4.2Å; L426-L430 PolarHBondContact O-N 3.34Å
427	R	47.3	Very low	41.1	Very low	118 Å²	118	115 Å²	115	45%	0.445	58%	0.575	S	S	.	*	H	α-helix	trans	-57.5	-41.6	174.2	-97.4	-178.1	173.7	150.6	-1.6	113	D252 L423 L424 R429 R431	D252-R427 IonicContact OD2-NH2 3.9Å; L423-R427 WeakPolarHBondContact O-CB 3.4Å; L423-R427 PolarHBondContact O-N 3.36Å; L424-R427 PolarHBondContact O-N 2.87Å; R427-R429 PolarHBondContact O-N 2.9Å; R427-R431 PolarHBondContact O-N 3.12Å
428	A	48.8	Very low	40.9	Very low	57 Å²	57	115.6 Å²	115.6	47%	0.471	57%	0.571	S	S	.	*	H	α-helix	trans	-66.2	-24.5	178.1	0	0	0	0	0	113.2	L424 L426	L424-A428 PolarHBondContact O-N 3.26Å; L424-A428 VanDerWaalsContact O-N 3.09Å; L426-A428 VanDerWaalsContact C-N 3.33Å; L426-A428 PolarHBondContact O-N 3.38Å
429	R	46.9	Very low	40.4	Very low	118 Å²	118	118.7 Å²	118.7	45%	0.445	58%	0.58	S	S	.	*	H	α-helix	trans	-93.9	-33	-177.8	-74	174.3	171	175.7	-12.6	113.5	Q169 K425 L426 R427 R431 R432	Q169-R429 PolarHBondContact O-NH1 2.86Å; Q169-R429 PolarHBondContact O-NH2 3.33Å; K425-R429 WeakPolarHBondContact O-CG 3.49Å; K425-R429 PolarHBondContact O-N 2.79Å; L426-R429 PolarHBondContact O-N 3.1Å; L426-R429 VanDerWaalsContact O-N 3.07Å; R427-R429 PolarHBondContact O-N 2.9Å; R429-R431 VanDerWaalsContact C-N 3.27Å; R429-R431 PolarHBondContact O-N 3.4Å; R429-R432 WeakPolarHBondContact O-CB 3.48Å; R429-R432 PolarHBondContact O-N 3.35Å
430	L	46.8	Very low	39.8	Very low	12 Å²	12	121.1 Å²	121.1	6%	0.063	60%	0.595	C	S	.	*	H	α-helix	trans	-65.5	-32.4	174	-76.4	159.2	0	0	0	112.3	F258 P260 L426 R432 R433	F258-L430 VanDerWaalsContact C-CD1 3.45Å; F258-L430 WeakPolarHBondContact O-CD1 3.41Å; P260-L430 HydrophobicContact CB-CD2 4.43Å; L426-L430 HydrophobicContact CD2-CD1 4.28Å; L426-L430 HydrophobicContact CG-CD1 4.2Å; L426-L430 PolarHBondContact O-N 3.34Å; L430-R432 PolarHBondContact O-N 3.42Å; L430-R432 VanDerWaalsContact O-N 3.13Å; L430-R433 PolarHBondContact O-N 2.94Å; L430-R433 VanDerWaalsContact O-N 3.09Å
431	R	42.7	Very low	39	Very low	189 Å²	189	116.8 Å²	116.8	71%	0.713	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-19.7	169.1	-76.9	-173.5	171.6	179.7	-2.6	114.2	R427 R429	R427-R431 PolarHBondContact O-N 3.12Å; R429-R431 VanDerWaalsContact C-N 3.27Å; R429-R431 PolarHBondContact O-N 3.4Å
432	R	45	Very low	38.4	Very low	207 Å²	207	119.2 Å²	119.2	78%	0.781	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-12	176.9	-59.1	-171.7	-166.3	-174.9	1.2	113.9	R429 L430	R429-R432 WeakPolarHBondContact O-CB 3.48Å; R429-R432 PolarHBondContact O-N 3.35Å; L430-R432 PolarHBondContact O-N 3.42Å; L430-R432 VanDerWaalsContact O-N 3.13Å
433	R	40.8	Very low	37.6	Very low	163 Å²	163	122.2 Å²	122.2	62%	0.615	61%	0.607	S	S	*	*	S	Bend	trans	-92.9	1.5	177.2	-85	-173.6	177.8	157.5	5.1	113.7	L430	L430-R433 PolarHBondContact O-N 2.94Å; L430-R433 VanDerWaalsContact O-N 3.09Å
434	A	36	Very low	36.7	Very low	78 Å²	78	122.9 Å²	122.9	65%	0.645	63%	0.627	S	S	*	*	S	Bend	trans	-97.9	16.1	-173.7	0	0	0	0	0	115.7
435	T	31.4	Very low	35.9	Very low	115 Å²	115	124.4 Å²	124.4	71%	0.706	64%	0.642	S	S	*	*	S	Bend	trans	-147.2	141.7	173.8	47.1	0	0	0	0	111.4
436	P	31.5	Very low	34.8	Very low	113 Å²	113	123.5 Å²	123.5	73%	0.734	65%	0.651	S	S	*	*			trans	-80.7	159.9	-171.5	35.8	-34.5	0	0	0	111.6
437	E	26	Very low	34	Very low	180 Å²	180	128.8 Å²	128.8	84%	0.841	68%	0.68	S	S	*	*			trans	59.7	118.9	169.3	-59.7	-158.8	153.3	0	0	118.2
438	L	27.1	Very low	33.1	Very low	168 Å²	168	128.1 Å²	128.1	88%	0.88	69%	0.691	S	S	*	*			trans	-148.8	99.5	147.5	-112.3	150.9	0	0	0	110
439	V	23.5	Very low	32.2	Very low	116 Å²	116	133.1 Å²	133.1	70%	0.703	71%	0.71	S	S	*	*			trans	-57.6	129.3	154.8	170.4	0	0	0	0	109	T441	V439-T441 HydrophobicContact CG1-CG2 4.11Å
440	C	27.3	Very low	31.3	Very low	113 Å²	113	131.4 Å²	131.4	76%	0.764	72%	0.721	S	S	*	*			trans	-151.3	96.3	161.2	-112.4	0	0	0	0	104.8
441	T	23.4	Very low	30.3	Very low	97 Å²	97	139.3 Å²	139.3	60%	0.595	76%	0.76	S	S	*	*				38.5	126.2	69	56.5	0	0	0	0	115.9	V439	V439-T441 HydrophobicContact CG1-CG2 4.11Å
442	F	26.8	Very low	29.7	Very low	178 Å²	178	137 Å²	137	78%	0.781	77%	0.767	S	S	*	*			trans	83.3	120.2	175.4	-65.3	-91.1	0	0	0	115.6
443	F	29.3	Very low	28.9	Very low	198 Å²	198	131.5 Å²	131.5	87%	0.868	77%	0.765	S	S	*	*			cis	-142.8	149.9	27.6	-64.6	-100.2	0	0	0	108.6
444	G	24.9	Very low	28.5	Very low	70 Å²	70	128 Å²	128	72%	0.722	77%	0.766	S	S	*	*			cis	109.9	65.8	24.7	0	0	0	0	0	111.3
445	T	31.6	Very low	28.3	Very low	144 Å²	144	131.7 Å²	131.7	88%	0.883	77%	0.769	S	S	*	*			trans	-153.9	129.9	147.2	49	0	0	0	0	110.2
446	S	27.8	Very low	28.8	Very low	108 Å²	108	131.1 Å²	131.1	76%	0.755	75%	0.754	S	S	*	*			trans	-63.1	135.1	179.9	37.9	0	0	0	0	114.6
447	D	29.4	Very low	29	Very low	163 Å²	163	129.4 Å²	129.4	87%	0.872	74%	0.743	S	S	*	*			trans	-153.2	121.7	134.4	-107.8	-25.6	0	0	0	109.8
448	P	29	Very low	29.7	Very low	103 Å²	103	128.5 Å²	128.5	67%	0.669	73%	0.732	S	S	*	*			trans	-91	117.9	166.4	33	-22	0	0	0	107.6
449	D	29.4	Very low	30.5	Very low	162 Å²	162	125.5 Å²	125.5	87%	0.866	71%	0.714	S	S	*	*			trans	-176.6	126.6	139.5	-91.6	-27	0	0	0	112.2
450	A	27.3	Very low	31	Very low	83 Å²	83	123.8 Å²	123.8	69%	0.686	71%	0.712	S	S	*	*			trans	59.9	108.4	137.9	0	0	0	0	0	120.1
451	M	26.3	Very low	31.4	Very low	178 Å²	178	126.8 Å²	126.8	88%	0.877	71%	0.712	S	S	*	*				59.9	104.3	125.7	-60	-160.1	165.9	0	0	117.5
452	T	30.7	Very low	32.1	Very low	141 Å²	141	131 Å²	131	87%	0.865	73%	0.727	S	S	*	*				178.4	121.3	111.2	28.5	0	0	0	0	110.1	S454	T452-S454 PolarHBondContact O-N 3.28Å; T452-S454 VanDerWaalsContact O-N 3.08Å
453	A	28.3	Very low	32.4	Very low	90 Å²	90	126.2 Å²	126.2	74%	0.744	73%	0.728	S	S	*	*			trans	-65	105	169.6	0	0	0	0	0	109	H455	A453-H455 PolarHBondContact O-N 3.46Å; A453-H455 VanDerWaalsContact O-N 3.14Å
454	S	31.7	Very low	32.5	Very low	91 Å²	91	128.1 Å²	128.1	64%	0.636	73%	0.729	S	S	*	*			trans	-74.6	100.6	171.6	-171.5	0	0	0	0	108.9	T452 R456	T452-S454 PolarHBondContact O-N 3.28Å; T452-S454 VanDerWaalsContact O-N 3.08Å; S454-R456 PolarHBondContact O-N 2.83Å
455	H	32.3	Very low	33.1	Very low	154 Å²	154	129.4 Å²	129.4	71%	0.713	73%	0.725	S	S	*	*			trans	-59.8	121.3	175	-86.7	-97.3	0	0	0	110.9	A453 P457	A453-H455 PolarHBondContact O-N 3.46Å; A453-H455 VanDerWaalsContact O-N 3.14Å; H455-P457 WeakPolarHBondContact O-CD 3.38Å
456	R	41.5	Very low	33.3	Very low	103 Å²	103	128.7 Å²	128.7	39%	0.389	72%	0.723	S	S	.	*			trans	-63.8	119.4	170.6	-64.9	-172.9	-173.4	-127	6.7	109.4	Q346 S454 W458 E459	Q346-R456 PolarHBondContact O-NH1 2.83Å; S454-R456 PolarHBondContact O-N 2.83Å; R456-W458 PolarHBondContact O-N 3.47Å; R456-E459 PolarHBondContact O-N 3.36Å
457	P	36.1	Very low	34.1	Very low	77 Å²	77	127.6 Å²	127.6	50%	0.5	71%	0.712	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.6	14.3	-169.3	-22.3	36.1	0	0	0	117.7	H455 A710 F712	H455-P457 WeakPolarHBondContact O-CD 3.38Å; P457-A710 HydrophobicContact CG-CB 3.63Å; P457-A710 VanDerWaalsContact CG-O 3.24Å; P457-A710 WeakPolarHBondContact CG-O 3.28Å; P457-F712 HydrophobicContact CB-CE2 4.29Å
458	W	40.7	Very low	35.3	Very low	161 Å²	161	123.7 Å²	123.7	61%	0.61	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	-9.4	176.9	79	-81.2	0	0	0	114	L357 R456	L357-W458 HydrophobicContact CD2-CH2 4.49Å; R456-W458 PolarHBondContact O-N 3.47Å
459	E	43.4	Very low	37.2	Very low	105 Å²	105	124.9 Å²	124.9	49%	0.491	70%	0.703	S	S	.	*	S	Bend	trans	-92.4	-7.3	-174	-68.9	-179.1	148.7	0	0	114.1	R456	R456-E459 PolarHBondContact O-N 3.36Å
460	A	34.5	Very low	39.9	Very low	81 Å²	81	117.9 Å²	117.9	67%	0.669	67%	0.666	S	S	*	*	S	Bend	trans	-97.3	5.2	-166.7	0	0	0	0	0	116.6
461	K	35.9	Very low	42.9	Very low	176 Å²	176	115.9 Å²	115.9	77%	0.765	65%	0.647	S	S	*	*	S	Bend	trans	-146.5	68.5	-177.1	-74.5	-174.2	177.1	179.5	0	113.2
462	M	36.4	Very low	46	Very low	186 Å²	186	109.7 Å²	109.7	92%	0.916	62%	0.617	S	S	*	*	S	Bend	trans	-161.1	137.8	147.9	-75.1	-143	-154.9	0	0	109.3
463	G	32.9	Very low	48.8	Very low	77 Å²	77	110.8 Å²	110.8	79%	0.794	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-58.5	139.7	-169.2	0	0	0	0	0	115.2	P465	G463-P465 WeakPolarHBondContact O-CD 3.42Å
464	R	31.8	Very low	51.7	Low	237 Å²	237	108.8 Å²	108.8	89%	0.894	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-63.6	118.7	176.2	-175	-172.6	-143.2	-137.1	3.8	111.7
465	P	38.8	Very low	54.5	Low	98 Å²	98	104.8 Å²	104.8	64%	0.636	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-88.2	149.6	159.6	33.7	-26.3	0	0	0	109.9	G463 T467	G463-P465 WeakPolarHBondContact O-CD 3.42Å; P465-T467 PolarHBondContact O-N 3.18Å
466	P	34.3	Very low	57.3	Low	129 Å²	129	104.4 Å²	104.4	84%	0.838	55%	0.553	S	S	*	*			trans	-84.8	108.6	178.6	33	-27.6	0	0	0	109.5
467	T	45.7	Very low	59.6	Low	85 Å²	85	101 Å²	101	52%	0.521	55%	0.545	S	S	.	.			trans	-137.4	141.4	161.1	40.2	0	0	0	0	107.5	P465 T469	P465-T467 PolarHBondContact O-N 3.18Å; T467-T469 PolarHBondContact O-N 3.44Å
468	S	53.5	Low	62.1	Low	81 Å²	81	103 Å²	103	57%	0.566	55%	0.552	S	S	*	*			trans	-41.8	123.1	-176.3	41.1	0	0	0	0	111.6	V470	S468-V470 VanDerWaalsContact C-N 3.28Å; S468-V470 PolarHBondContact O-N 3.18Å
469	T	70	Confident	64.5	Low	127 Å²	127	99.8 Å²	99.8	78%	0.779	55%	0.546	S	S	*	.			trans	-75.2	83.8	-179.7	49.5	0	0	0	0	109.5	T467 S471	T467-T469 PolarHBondContact O-N 3.44Å; T469-S471 PolarHBondContact O-N 3.28Å
470	V	85.5	Confident	66.8	Low	15 Å²	15	96.6 Å²	96.6	9%	0.091	53%	0.532	C	S	.	.			trans	-61.7	123.6	171.3	-175.1	0	0	0	0	108.4	I364 E366 S468 D474 V475 V482	I364-V470 HydrophobicContact CB-CG2 4.43Å; I364-V470 HydrophobicContact CG2-CG2 3.93Å; E366-V470 HydrophobicContact CG-CG2 4.35Å; E366-V470 WeakPolarHBondContact OE1-CG2 3.49Å; S468-V470 VanDerWaalsContact C-N 3.28Å; S468-V470 PolarHBondContact O-N 3.18Å; V470-D474 HydrophobicContact CG1-CB 4.24Å; V470-V475 HydrophobicContact CG1-CG2 3.97Å; V470-V482 HydrophobicContact CG1-CG1 3.92Å; V470-V482 HydrophobicContact CG1-CG2 4.38Å
471	S	90.5	Very high	69.6	Low	42 Å²	42	92.7 Å²	92.7	29%	0.294	50%	0.5	S	S	.	.			trans	-94	163.1	175.9	80.6	0	0	0	0	111.7	T469 Q473 D474 V475	T469-S471 PolarHBondContact O-N 3.28Å; S471-Q473 PolarHBondContact O-N 2.93Å; S471-Q473 PolarHBondContact OG-N 3.47Å; S471-D474 WeakPolarHBondContact CA-OD2 3.39Å; S471-D474 VanDerWaalsContact CB-OD2 3.22Å; S471-D474 WeakPolarHBondContact CB-OD2 3.31Å; S471-D474 PolarHBondContact N-OD2 3.46Å; S471-D474 WeakPolarHBondContact O-CB 3.15Å; S471-D474 PolarHBondContact O-N 2.99Å; S471-D474 VanDerWaalsContact O-N 3.11Å; S471-D474 PolarHBondContact OG-N 2.76Å; S471-D474 PolarHBondContact OG-OD2 2.94Å; S471-V475 PolarHBondContact O-N 3.3Å
472	I	90.7	Very high	72.4	Confident	47 Å²	47	84.4 Å²	84.4	24%	0.241	46%	0.464	C	S	.	.	H	α-helix	trans	-61	-29.4	172.8	-58.8	171	0	0	0	111.2	D351 S352 L355 D474 V475 R476	D351-I472 HydrophobicContact CB-CD1 4.08Å; S352-I472 VanDerWaalsContact CA-CD1 3.44Å; S352-I472 VanDerWaalsContact N-CD1 3.33Å; L355-I472 HydrophobicContact CD2-CG1 4.06Å; I472-D474 VanDerWaalsContact C-N 3.32Å; I472-V475 PolarHBondContact O-N 3.08Å; I472-R476 HydrophobicContact CG2-CG 4.43Å; I472-R476 WeakPolarHBondContact O-CG 3.39Å; I472-R476 PolarHBondContact O-N 3.03Å; I472-R476 VanDerWaalsContact O-N 3.1Å
473	Q	89.8	Confident	75.2	Confident	165 Å²	165	75.5 Å²	75.5	77%	0.771	42%	0.42	S	S	*	.	H	α-helix	trans	-67.6	-36	177.6	-65.7	179.9	-12.7	0	0	111.1	S471 R476 S477	S471-Q473 PolarHBondContact O-N 2.93Å; S471-Q473 PolarHBondContact OG-N 3.47Å; Q473-R476 PolarHBondContact O-N 2.89Å; Q473-S477 PolarHBondContact O-N 3.36Å; Q473-S477 VanDerWaalsContact O-N 3.1Å
474	D	89.7	Confident	78.3	Confident	47 Å²	47	71.9 Å²	71.9	25%	0.251	38%	0.383	S	S	.	.	H	α-helix	trans	-68.2	-42.5	176.3	-53.3	-45.7	0	0	0	110.8	V470 S471 I472 R476 S477 L480	V470-D474 HydrophobicContact CG1-CB 4.24Å; S471-D474 WeakPolarHBondContact CA-OD2 3.39Å; S471-D474 VanDerWaalsContact CB-OD2 3.22Å; S471-D474 WeakPolarHBondContact CB-OD2 3.31Å; S471-D474 PolarHBondContact N-OD2 3.46Å; S471-D474 WeakPolarHBondContact O-CB 3.15Å; S471-D474 PolarHBondContact O-N 2.99Å; S471-D474 VanDerWaalsContact O-N 3.11Å; S471-D474 PolarHBondContact OG-N 2.76Å; S471-D474 PolarHBondContact OG-OD2 2.94Å; I472-D474 VanDerWaalsContact C-N 3.32Å; D474-R476 VanDerWaalsContact C-N 3.26Å; D474-R476 PolarHBondContact O-N 2.83Å; D474-S477 VanDerWaalsContact O-CB 3.23Å; D474-S477 WeakPolarHBondContact O-CB 3.39Å; D474-S477 PolarHBondContact O-N 3.4Å; D474-S477 VanDerWaalsContact O-N 3.08Å; D474-L480 HydrophobicContact CB-CD1 4.31Å
475	V	90.5	Very high	81.3	Confident	7 Å²	7	64.2 Å²	64.2	4%	0.042	36%	0.356	C	S	.	.	H	α-helix	trans	-59.1	-36.9	175.2	177.3	0	0	0	0	112.1	T313 L355 V470 S471 I472 S477 V482	T313-V475 HydrophobicContact CG2-CG1 3.41Å; T313-V475 VanDerWaalsContact CG2-CG1 3.41Å; L355-V475 HydrophobicContact CD1-CG2 3.91Å; L355-V475 HydrophobicContact CD2-CG2 3.85Å; V470-V475 HydrophobicContact CG1-CG2 3.97Å; S471-V475 PolarHBondContact O-N 3.3Å; I472-V475 PolarHBondContact O-N 3.08Å; V475-S477 VanDerWaalsContact C-N 3.35Å; V475-V482 HydrophobicContact CG2-CB 4.44Å; V475-V482 HydrophobicContact CG2-CG1 4.29Å; V475-V482 HydrophobicContact CG2-CG2 4.27Å
476	R	91	Very high	83.9	Confident	147 Å²	147	59.9 Å²	59.9	56%	0.555	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-0.8	179.4	-66.5	178.8	-179.1	175.1	1	113.4	D351 I472 Q473 D474	D351-R476 IonicContact OD2-NH2 3.3Å; D351-R476 PolarHBondContact OD2-NH2 2.83Å; I472-R476 HydrophobicContact CG2-CG 4.43Å; I472-R476 WeakPolarHBondContact O-CG 3.39Å; I472-R476 PolarHBondContact O-N 3.03Å; I472-R476 VanDerWaalsContact O-N 3.1Å; Q473-R476 PolarHBondContact O-N 2.89Å; D474-R476 VanDerWaalsContact C-N 3.26Å; D474-R476 PolarHBondContact O-N 2.83Å
477	S	90.1	Very high	86.6	Confident	31 Å²	31	56 Å²	56	22%	0.217	30%	0.298	C	S	.	.			trans	-74.7	128.3	-178.2	-177.7	0	0	0	0	111.3	Q473 D474 V475 N479 L480	Q473-S477 PolarHBondContact O-N 3.36Å; Q473-S477 VanDerWaalsContact O-N 3.1Å; D474-S477 VanDerWaalsContact O-CB 3.23Å; D474-S477 WeakPolarHBondContact O-CB 3.39Å; D474-S477 PolarHBondContact O-N 3.4Å; D474-S477 VanDerWaalsContact O-N 3.08Å; V475-S477 VanDerWaalsContact C-N 3.35Å; S477-N479 PolarHBondContact O-N 2.9Å; S477-N479 PolarHBondContact OG-N 3.35Å; S477-L480 PolarHBondContact O-N 3.49Å; S477-L480 VanDerWaalsContact O-O 3.06Å
478	N	88.9	Confident	88.5	Confident	120 Å²	120	53.7 Å²	53.7	64%	0.642	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-15.3	175.2	-72.7	-25.6	0	0	0	113.5
479	N	90.7	Very high	89.5	Confident	92 Å²	92	56.9 Å²	56.9	49%	0.492	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-8.9	-179.1	-60.6	-50.7	0	0	0	113	V369 S477	V369-N479 PolarHBondContact N-O 2.68Å; S477-N479 PolarHBondContact O-N 2.9Å; S477-N479 PolarHBondContact OG-N 3.35Å
480	L	92.4	Very high	89.6	Confident	38 Å²	38	54 Å²	54	20%	0.199	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	145.4	-176.6	-62.6	172.9	0	0	0	110.2	I367 D474 S477	I367-L480 CarbonylContact O-C 3.57Å; I367-L480 WeakPolarHBondContact O-CA 3.24Å; D474-L480 HydrophobicContact CB-CD1 4.31Å; S477-L480 PolarHBondContact O-N 3.49Å; S477-L480 VanDerWaalsContact O-O 3.06Å
481	I	92.9	Very high	88.9	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	113.5	164.8	-63.5	170.7	0	0	0	105.7	W98 W99 E102 I309 P311 I367 V369	W98-I481 HydrophobicContact CH2-CG2 4.3Å; W98-I481 HydrophobicContact CZ3-CD1 4.1Å; W98-I481 HydrophobicContact CZ3-CG1 4.17Å; W99-I481 HydrophobicContact CB-CD1 3.98Å; W99-I481 HydrophobicContact CB-CG2 4.31Å; E102-I481 HydrophobicContact CB-CD1 4.07Å; I309-I481 HydrophobicContact CD1-CG2 3.94Å; P311-I481 HydrophobicContact CB-CG2 4.24Å; P311-I481 HydrophobicContact CG-CG2 3.82Å; I367-I481 HydrophobicContact CB-CB 4.45Å; I367-I481 PolarHBondContact N-O 3.49Å; I367-I481 PolarHBondContact O-N 3.38Å; V369-I481 HydrophobicContact CG2-CD1 4.06Å; V369-I481 HydrophobicContact CG2-CG1 3.76Å
482	V	94.7	Very high	88.2	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	119.7	174.8	-175.3	0	0	0	0	108.1	P311 I312 I364 E366 V470 V475	P311-V482 WeakPolarHBondContact CA-O 3.49Å; I312-V482 HydrophobicContact CD1-CG1 3.82Å; I312-V482 HydrophobicContact CG1-CB 4.35Å; I312-V482 HydrophobicContact CG1-CG1 4.01Å; I312-V482 WeakPolarHBondContact CG1-O 3.44Å; I312-V482 PolarHBondContact N-O 2.69Å; I364-V482 HydrophobicContact CG2-CG1 3.35Å; E366-V482 HydrophobicContact CG-CG2 4.35Å; V470-V482 HydrophobicContact CG1-CG1 3.92Å; V470-V482 HydrophobicContact CG1-CG2 4.38Å; V475-V482 HydrophobicContact CG2-CB 4.44Å; V475-V482 HydrophobicContact CG2-CG1 4.29Å; V475-V482 HydrophobicContact CG2-CG2 4.27Å
483	G	95.6	Very high	87.4	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	155.4	-176.2	0	0	0	0	0	113.5	I310 I364 E365	I310-G483 CarbonylContact O-C 3.54Å; I310-G483 WeakPolarHBondContact O-CA 3.34Å; I364-G483 WeakPolarHBondContact CA-O 3.33Å; E365-G483 PolarHBondContact N-O 3.34Å; E365-G483 PolarHBondContact O-N 2.84Å
484	A	96.7	Very high	86.9	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	134.1	171	0	0	0	0	0	109.9	P281 I309 I310 I312 M362 D363 I364	P281-A484 HydrophobicContact CG-CB 4Å; I309-A484 WeakPolarHBondContact CA-O 3.35Å; I310-A484 HydrophobicContact CG2-CB 3.98Å; I310-A484 PolarHBondContact N-O 3.18Å; I310-A484 PolarHBondContact O-N 2.98Å; I312-A484 HydrophobicContact CG2-CB 4.28Å; M362-A484 HydrophobicContact CB-CB 4.18Å; M362-A484 HydrophobicContact CE-CB 4.22Å; M362-A484 HydrophobicContact SD-CB 3.89Å; D363-A484 CarbonylContact O-C 3.5Å; D363-A484 WeakPolarHBondContact O-CA 3.4Å; I364-A484 HydrophobicContact CD1-CB 3.97Å
485	K	95.2	Very high	86.5	Confident	77 Å²	77	58.2 Å²	58.2	34%	0.335	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	131.7	177.7	-172.8	-173.6	-163	132.8	0	111.1	P281 D363 E365	P281-K485 WeakPolarHBondContact CD-O 3.22Å; D363-K485 HydrophobicContact CB-CB 4.35Å; D363-K485 PolarHBondContact O-N 3.04Å; E365-K485 HydrophobicContact CG-CB 4.47Å; E365-K485 WeakPolarHBondContact OE1-CD 3.44Å; E365-K485 WeakPolarHBondContact OE1-CE 3.28Å; E365-K485 IonicContact OE1-NZ 2.98Å; E365-K485 PolarHBondContact OE1-NZ 3.12Å
486	I	94.6	Very high	86.2	Confident	7 Å²	7	60.9 Å²	60.9	4%	0.036	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-98.1	118.6	172.6	-53.4	171.6	0	0	0	108	T60 L108 V283 A308 I310 T488	T60-I486 HydrophobicContact CG2-CG2 4.37Å; T60-I486 WeakPolarHBondContact OG1-CG2 3.32Å; L108-I486 HydrophobicContact CD1-CD1 4.11Å; L108-I486 HydrophobicContact CD2-CD1 3.96Å; V283-I486 HydrophobicContact CG2-CD1 3.81Å; V283-I486 HydrophobicContact CG2-CG1 4.06Å; A308-I486 HydrophobicContact CB-CB 4.09Å; A308-I486 PolarHBondContact O-N 2.81Å; I310-I486 HydrophobicContact CB-CD1 4.22Å; I310-I486 HydrophobicContact CG2-CD1 4.47Å; I310-I486 HydrophobicContact CG2-CG1 4.32Å; I486-T488 HydrophobicContact CG2-CG2 4.03Å; I486-T488 PolarHBondContact O-N 2.84Å
487	E	90.6	Very high	86	Confident	48 Å²	48	59 Å²	59	22%	0.224	30%	0.296	C	S	.	.			trans	-73	112	176.5	-175.8	59.2	-135	0	0	110.5	T60 S280 Q489 T490	T60-E487 PolarHBondContact N-O 3.39Å; S280-E487 WeakPolarHBondContact OG-CB 3.32Å; S280-E487 PolarHBondContact OG-N 2.86Å; E487-Q489 PolarHBondContact OE1-N 2.94Å; E487-T490 PolarHBondContact OE1-OG1 2.8Å
488	T	85.1	Confident	85.8	Confident	35 Å²	35	59.4 Å²	59.4	22%	0.215	30%	0.295	C	S	.	.			trans	-124.4	-6.4	-178.3	62.3	0	0	0	0	113.6	T62 T296 A308 I486	T62-T488 HydrophobicContact CG2-CG2 4.09Å; T296-T488 HydrophobicContact CG2-CG2 4.15Å; T296-T488 WeakPolarHBondContact OG1-CG2 3.42Å; A308-T488 HydrophobicContact CB-CG2 3.79Å; I486-T488 HydrophobicContact CG2-CG2 4.03Å; I486-T488 PolarHBondContact O-N 2.84Å
489	Q	74.5	Confident	85.7	Confident	148 Å²	148	54.4 Å²	54.4	69%	0.692	27%	0.268	S	S	*	.	S	Bend	trans	-83.9	-26	-173	-63.5	-177.2	-1	0	0	112.7	E487	E487-Q489 PolarHBondContact OE1-N 2.94Å
490	T	71.1	Confident	85.7	Confident	68 Å²	68	54.6 Å²	54.6	42%	0.417	27%	0.269	S	S	.	.			trans	-94.7	132.7	175.4	45.4	0	0	0	0	109.1	Y59 E487	Y59-T490 WeakPolarHBondContact CB-O 3.22Å; E487-T490 PolarHBondContact OE1-OG1 2.8Å
491	H	72.4	Confident	85.5	Confident	86 Å²	86	53.6 Å²	53.6	40%	0.398	27%	0.266	S	S	.	.			trans	-139	156.4	171.2	64.5	-79.7	0	0	0	110.4	M495 D496	H491-M495 HydrophobicContact CB-CB 4.46Å; H491-M495 HydrophobicContact CB-CE 4.06Å; H491-M495 HydrophobicContact CB-SD 3.8Å; H491-D496 IonicContact CD2-OD1 3.91Å; H491-D496 IonicContact CD2-OD2 3.69Å; H491-D496 IonicContact CE1-OD2 3.11Å; H491-D496 IonicContact NE2-OD1 2.82Å; H491-D496 IonicContact NE2-OD2 3.57Å; H491-D496 PolarHBondContact NE2-OD2 2.83Å
492	H	75.5	Confident	85.3	Confident	91 Å²	91	54.2 Å²	54.2	42%	0.421	27%	0.268	S	S	.	.			trans	-67.3	144.2	173.5	-160.7	-100.5	0	0	0	110.5	Y59 L494 M495	Y59-H492 HydrophobicContact CE1-CB 4.49Å; Y59-H492 WeakPolarHBondContact OH-CB 3.49Å; H492-L494 WeakPolarHBondContact ND1-CB 3.33Å; H492-L494 PolarHBondContact ND1-N 2.83Å; H492-L494 VanDerWaalsContact ND1-N 3.19Å; H492-L494 PolarHBondContact O-N 3.4Å; H492-L494 VanDerWaalsContact O-N 3.14Å; H492-M495 HydrophobicContact CB-CB 4.41Å; H492-M495 WeakPolarHBondContact O-CB 2.88Å; H492-M495 PolarHBondContact O-N 2.9Å
493	Q	74.3	Confident	85.2	Confident	172 Å²	172	55.1 Å²	55.1	80%	0.804	27%	0.273	S	S	*	.	H	α-helix	trans	-55.7	-35.2	177.6	-64.3	175.8	7.3	0	0	112.4	M495	Q493-M495 VanDerWaalsContact C-N 3.32Å; Q493-M495 PolarHBondContact O-N 3.38Å
494	L	79	Confident	85	Confident	47 Å²	47	59.9 Å²	59.9	25%	0.246	30%	0.302	C	S	.	.	H	α-helix	trans	-79.3	-8.2	178.1	-55.3	175.7	0	0	0	114.2	H492 E497 M498 F537 F554	H492-L494 WeakPolarHBondContact ND1-CB 3.33Å; H492-L494 PolarHBondContact ND1-N 2.83Å; H492-L494 VanDerWaalsContact ND1-N 3.19Å; H492-L494 PolarHBondContact O-N 3.4Å; H492-L494 VanDerWaalsContact O-N 3.14Å; L494-E497 WeakPolarHBondContact CD2-OE2 3.37Å; L494-E497 PolarHBondContact O-N 3.06Å; L494-M498 WeakPolarHBondContact O-CB 3.07Å; L494-M498 PolarHBondContact O-N 3.15Å; L494-F537 HydrophobicContact CD2-CE1 4.47Å; L494-F554 HydrophobicContact CD1-CD1 4.22Å; L494-F554 HydrophobicContact CD1-CE1 3.76Å; L494-F554 HydrophobicContact CD1-CE2 4.5Å; L494-F554 HydrophobicContact CD1-CZ 3.92Å
495	M	81.7	Confident	84.7	Confident	8 Å²	8	61.8 Å²	61.8	4%	0.039	31%	0.314	C	S	.	.	H	α-helix	trans	-65.6	-42	-178.7	-172.9	-178.1	-67.6	0	0	110.7	Y59 F61 H491 H492 Q493 E497 M498 I499	Y59-M495 HydrophobicContact CD2-CE 3.74Å; Y59-M495 HydrophobicContact CE2-CE 3.35Å; F61-M495 HydrophobicContact CD2-CE 3.99Å; F61-M495 HydrophobicContact CD2-CG 4.06Å; F61-M495 HydrophobicContact CD2-SD 3.8Å; F61-M495 HydrophobicContact CE2-CG 4.03Å; F61-M495 HydrophobicContact CE2-SD 4.2Å; H491-M495 HydrophobicContact CB-CB 4.46Å; H491-M495 HydrophobicContact CB-CE 4.06Å; H491-M495 HydrophobicContact CB-SD 3.8Å; H492-M495 HydrophobicContact CB-CB 4.41Å; H492-M495 WeakPolarHBondContact O-CB 2.88Å; H492-M495 PolarHBondContact O-N 2.9Å; Q493-M495 VanDerWaalsContact C-N 3.32Å; Q493-M495 PolarHBondContact O-N 3.38Å; M495-E497 VanDerWaalsContact C-N 3.34Å; M495-E497 PolarHBondContact O-N 3.5Å; M495-M498 HydrophobicContact CG-CE 4.25Å; M495-M498 PolarHBondContact O-N 3.5Å; M495-I499 HydrophobicContact CG-CD1 3.92Å; M495-I499 HydrophobicContact CG-CG1 4.5Å; M495-I499 VanDerWaalsContact O-CG1 3.29Å; M495-I499 WeakPolarHBondContact O-CG1 3.16Å; M495-I499 PolarHBondContact O-N 3.09Å
496	D	83.8	Confident	84.6	Confident	62 Å²	62	58.1 Å²	58.1	33%	0.332	30%	0.298	S	S	.	.	H	α-helix	trans	-64.1	-40.7	177	-66.5	-33	0	0	0	111.2	H491 I499 N500	H491-D496 IonicContact CD2-OD1 3.91Å; H491-D496 IonicContact CD2-OD2 3.69Å; H491-D496 IonicContact CE1-OD2 3.11Å; H491-D496 IonicContact NE2-OD1 2.82Å; H491-D496 IonicContact NE2-OD2 3.57Å; H491-D496 PolarHBondContact NE2-OD2 2.83Å; D496-I499 PolarHBondContact O-N 3.04Å; D496-N500 VanDerWaalsContact O-CB 3.26Å; D496-N500 WeakPolarHBondContact O-CB 3.16Å; D496-N500 PolarHBondContact O-N 3.32Å; D496-N500 PolarHBondContact O-ND2 3.27Å
497	E	85.9	Confident	84.5	Confident	109 Å²	109	63.7 Å²	63.7	51%	0.509	32%	0.318	S	S	.	.	H	α-helix	trans	-62.6	-44.1	175.2	-65.6	-177.4	-175.3	0	0	111.9	L494 M495 N500 S501	L494-E497 WeakPolarHBondContact CD2-OE2 3.37Å; L494-E497 PolarHBondContact O-N 3.06Å; M495-E497 VanDerWaalsContact C-N 3.34Å; M495-E497 PolarHBondContact O-N 3.5Å; E497-N500 PolarHBondContact O-N 2.96Å; E497-S501 VanDerWaalsContact O-CB 3.27Å; E497-S501 WeakPolarHBondContact O-CB 3.4Å; E497-S501 PolarHBondContact O-N 2.9Å
498	M	85.6	Confident	84.5	Confident	39 Å²	39	66.4 Å²	66.4	19%	0.192	33%	0.331	C	S	.	.	H	α-helix	trans	-62	-46.6	176.8	-179.5	-170.9	67.9	0	0	111.5	F61 W129 L494 M495 S501 Y502 L530	F61-M498 HydrophobicContact CD2-CE 3.92Å; F61-M498 HydrophobicContact CE2-CE 3.35Å; F61-M498 HydrophobicContact CZ-CE 4.25Å; W129-M498 WeakPolarHBondContact O-CE 3.19Å; L494-M498 WeakPolarHBondContact O-CB 3.07Å; L494-M498 PolarHBondContact O-N 3.15Å; M495-M498 HydrophobicContact CG-CE 4.25Å; M495-M498 PolarHBondContact O-N 3.5Å; M498-S501 PolarHBondContact O-N 2.69Å; M498-Y502 PolarHBondContact O-N 3.15Å; M498-L530 HydrophobicContact CG-CD1 4.48Å; M498-L530 HydrophobicContact CG-CD2 3.55Å; M498-L530 WeakPolarHBondContact O-CD2 3.3Å
499	I	87.9	Confident	84.9	Confident	14 Å²	14	66.5 Å²	66.5	7%	0.072	33%	0.327	C	S	.	.	H	α-helix	trans	-62.1	-47.4	177.3	-69.7	168	0	0	0	110.2	F61 P64 M495 D496 S501 Y502 L503	F61-I499 HydrophobicContact CE2-CD1 4.02Å; F61-I499 HydrophobicContact CE2-CG1 4.01Å; F61-I499 HydrophobicContact CZ-CD1 4.25Å; F61-I499 HydrophobicContact CZ-CG1 4.12Å; P64-I499 HydrophobicContact CB-CG2 4Å; P64-I499 HydrophobicContact CG-CG2 3.72Å; M495-I499 HydrophobicContact CG-CD1 3.92Å; M495-I499 HydrophobicContact CG-CG1 4.5Å; M495-I499 VanDerWaalsContact O-CG1 3.29Å; M495-I499 WeakPolarHBondContact O-CG1 3.16Å; M495-I499 PolarHBondContact O-N 3.09Å; D496-I499 PolarHBondContact O-N 3.04Å; I499-S501 VanDerWaalsContact C-N 3.34Å; I499-S501 PolarHBondContact O-N 3.33Å; I499-Y502 PolarHBondContact O-N 3.49Å; I499-L503 HydrophobicContact CG2-CD1 3.84Å; I499-L503 HydrophobicContact CG2-CG 4.28Å; I499-L503 WeakPolarHBondContact O-CB 3.41Å; I499-L503 VanDerWaalsContact O-CG 3.29Å; I499-L503 WeakPolarHBondContact O-CG 3.17Å; I499-L503 PolarHBondContact O-N 3.15Å
500	N	89.5	Confident	85.8	Confident	96 Å²	96	61 Å²	61	51%	0.513	30%	0.301	S	S	.	.	H	α-helix	trans	-63.3	-39.6	179.3	-74.2	-36.8	0	0	0	112.3	D496 E497 L503 T504	D496-N500 VanDerWaalsContact O-CB 3.26Å; D496-N500 WeakPolarHBondContact O-CB 3.16Å; D496-N500 PolarHBondContact O-N 3.32Å; D496-N500 PolarHBondContact O-ND2 3.27Å; E497-N500 PolarHBondContact O-N 2.96Å; N500-L503 PolarHBondContact O-N 3.45Å; N500-T504 WeakPolarHBondContact O-CB 3.31Å; N500-T504 PolarHBondContact O-N 2.9Å; N500-T504 PolarHBondContact O-OG1 3.4Å
501	S	89	Confident	86.7	Confident	18 Å²	18	61.6 Å²	61.6	13%	0.126	30%	0.299	C	S	.	.	H	α-helix	trans	-62.4	-47.2	174.5	-179.3	0	0	0	0	111.1	E497 M498 I499 L503 T504 T505 A533	E497-S501 VanDerWaalsContact O-CB 3.27Å; E497-S501 WeakPolarHBondContact O-CB 3.4Å; E497-S501 PolarHBondContact O-N 2.9Å; M498-S501 PolarHBondContact O-N 2.69Å; I499-S501 VanDerWaalsContact C-N 3.34Å; I499-S501 PolarHBondContact O-N 3.33Å; S501-L503 PolarHBondContact O-N 2.66Å; S501-T504 PolarHBondContact O-N 3.12Å; S501-T505 PolarHBondContact O-N 3.48Å; S501-T505 VanDerWaalsContact O-N 3.12Å; S501-T505 PolarHBondContact O-OG1 3.42Å; S501-A533 WeakPolarHBondContact OG-CB 3.33Å
502	Y	89.4	Confident	87.5	Confident	12 Å²	12	61.4 Å²	61.4	5%	0.047	30%	0.298	C	S	.	.	H	α-helix	trans	-58.3	-50.3	175.2	-180	-86.3	0	0	0	111.7	L77 E80 L81 M498 I499 T504 T505 A506 R509 F526 L530	L77-Y502 HydrophobicContact CD2-CE1 4.25Å; E80-Y502 PolarHBondContact OE2-OH 3.27Å; L81-Y502 HydrophobicContact CD2-CD1 3.91Å; L81-Y502 HydrophobicContact CD2-CE1 3.19Å; L81-Y502 HydrophobicContact CD2-CE2 4.47Å; L81-Y502 HydrophobicContact CG-CE1 4.25Å; M498-Y502 PolarHBondContact O-N 3.15Å; I499-Y502 PolarHBondContact O-N 3.49Å; Y502-T504 VanDerWaalsContact C-N 3.25Å; Y502-T504 PolarHBondContact O-N 3.43Å; Y502-T505 PolarHBondContact O-N 2.79Å; Y502-A506 HydrophobicContact CD1-CB 4.21Å; Y502-A506 HydrophobicContact CE1-CB 3.78Å; Y502-A506 VanDerWaalsContact O-CB 3.27Å; Y502-A506 WeakPolarHBondContact O-CB 3.3Å; Y502-A506 PolarHBondContact O-N 2.73Å; Y502-R509 PolarHBondContact OH-NH2 3.12Å; Y502-F526 HydrophobicContact CE2-CD2 4.4Å; Y502-F526 HydrophobicContact CE2-CE2 4.18Å; Y502-F526 AromaticContact CZ-CE2 3.8Å; Y502-F526 VanDerWaalsContact OH-CE2 3.26Å; Y502-F526 WeakPolarHBondContact OH-CE2 3.34Å; Y502-L530 HydrophobicContact CD2-CD1 4.22Å; Y502-L530 HydrophobicContact CD2-CD2 4.5Å; Y502-L530 HydrophobicContact CD2-CG 4.04Å
503	L	91.5	Very high	88	Confident	20 Å²	20	61.9 Å²	61.9	11%	0.105	30%	0.301	C	S	.	.	H	α-helix	trans	-60.6	-36.3	-178.2	-71.9	173.6	0	0	0	112.1	P64 F69 L77 I499 N500 S501 R507	P64-L503 HydrophobicContact CB-CD1 4.48Å; P64-L503 HydrophobicContact CG-CD1 4.26Å; P64-L503 HydrophobicContact CG-CD2 4.47Å; F69-L503 HydrophobicContact CE2-CD2 4.22Å; F69-L503 HydrophobicContact CZ-CD1 3.83Å; F69-L503 HydrophobicContact CZ-CD2 4.04Å; L77-L503 HydrophobicContact CD1-CD2 3.95Å; L77-L503 HydrophobicContact CD2-CD2 4.23Å; I499-L503 HydrophobicContact CG2-CD1 3.84Å; I499-L503 HydrophobicContact CG2-CG 4.28Å; I499-L503 WeakPolarHBondContact O-CB 3.41Å; I499-L503 VanDerWaalsContact O-CG 3.29Å; I499-L503 WeakPolarHBondContact O-CG 3.17Å; I499-L503 PolarHBondContact O-N 3.15Å; N500-L503 PolarHBondContact O-N 3.45Å; S501-L503 PolarHBondContact O-N 2.66Å; L503-R507 WeakPolarHBondContact O-CB 3.46Å; L503-R507 PolarHBondContact O-N 3.14Å
504	T	92.1	Very high	88.6	Confident	100 Å²	100	61.6 Å²	61.6	61%	0.613	29%	0.292	S	S	*	.	H	α-helix	trans	-64.2	-49.3	175.9	-58.5	0	0	0	0	111	N500 S501 Y502 R507 H508	N500-T504 WeakPolarHBondContact O-CB 3.31Å; N500-T504 PolarHBondContact O-N 2.9Å; N500-T504 PolarHBondContact O-OG1 3.4Å; S501-T504 PolarHBondContact O-N 3.12Å; Y502-T504 VanDerWaalsContact C-N 3.25Å; Y502-T504 PolarHBondContact O-N 3.43Å; T504-R507 PolarHBondContact O-N 3.45Å; T504-H508 PolarHBondContact O-N 2.79Å
505	T	91	Very high	88.8	Confident	41 Å²	41	64.4 Å²	64.4	25%	0.252	31%	0.308	S	S	.	.	H	α-helix	trans	-67.7	-38.8	178.4	-51	0	0	0	0	112	S501 Y502 R507 H508 R509 D529	S501-T505 PolarHBondContact O-N 3.48Å; S501-T505 VanDerWaalsContact O-N 3.12Å; S501-T505 PolarHBondContact O-OG1 3.42Å; Y502-T505 PolarHBondContact O-N 2.79Å; T505-R507 VanDerWaalsContact C-N 3.32Å; T505-R507 PolarHBondContact O-N 2.7Å; T505-H508 WeakPolarHBondContact O-CB 3.28Å; T505-H508 PolarHBondContact O-N 3.29Å; T505-R509 WeakPolarHBondContact O-CG 3.27Å; T505-R509 PolarHBondContact O-N 3.16Å; T505-D529 HydrophobicContact CG2-CB 3.72Å
506	A	91.6	Very high	88.3	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-61.7	-39.2	174.9	0	0	0	0	0	112.1	Y76 L77 Y502 R509 F510	Y76-A506 HydrophobicContact CE1-CB 4.35Å; Y76-A506 WeakPolarHBondContact CE1-O 3.05Å; L77-A506 HydrophobicContact CD2-CB 3.87Å; Y502-A506 HydrophobicContact CD1-CB 4.21Å; Y502-A506 HydrophobicContact CE1-CB 3.78Å; Y502-A506 VanDerWaalsContact O-CB 3.27Å; Y502-A506 WeakPolarHBondContact O-CB 3.3Å; Y502-A506 PolarHBondContact O-N 2.73Å; A506-R509 PolarHBondContact O-N 3.1Å; A506-F510 WeakPolarHBondContact O-CB 3.49Å; A506-F510 PolarHBondContact O-N 2.66Å
507	R	93	Very high	87.1	Confident	124 Å²	124	70.8 Å²	70.8	47%	0.468	35%	0.35	S	S	.	.	H	α-helix	trans	-63.1	-43.3	174.4	-176.5	176.1	-66.1	174.4	0.7	111.9	F73 L503 T504 T505 R509 F510 E511	F73-R507 HydrophobicContact CE2-CB 4.2Å; F73-R507 HydrophobicContact CZ-CB 3.98Å; L503-R507 WeakPolarHBondContact O-CB 3.46Å; L503-R507 PolarHBondContact O-N 3.14Å; T504-R507 PolarHBondContact O-N 3.45Å; T505-R507 VanDerWaalsContact C-N 3.32Å; T505-R507 PolarHBondContact O-N 2.7Å; R507-R509 PolarHBondContact O-N 3.34Å; R507-F510 PolarHBondContact O-N 3.27Å; R507-E511 HydrophobicContact CG-CG 4.48Å; R507-E511 WeakPolarHBondContact CG-OE1 3.36Å; R507-E511 WeakPolarHBondContact O-CG 3.38Å; R507-E511 PolarHBondContact O-N 3.1Å
508	H	91.6	Very high	85.5	Confident	105 Å²	105	71.3 Å²	71.3	49%	0.486	36%	0.363	S	S	.	.	H	α-helix	trans	-58.9	-47.8	175.7	-173.3	-86.9	0	0	0	111.4	T504 T505 F510 E511 E512	T504-H508 PolarHBondContact O-N 2.79Å; T505-H508 WeakPolarHBondContact O-CB 3.28Å; T505-H508 PolarHBondContact O-N 3.29Å; H508-F510 PolarHBondContact O-N 2.77Å; H508-E511 PolarHBondContact O-N 2.95Å; H508-E512 IonicContact CE1-OE1 2.65Å; H508-E512 PolarHBondContact CE1-OE1 2.87Å; H508-E512 IonicContact CE1-OE2 3.54Å; H508-E512 PolarHBondContact CE1-OE2 3.32Å; H508-E512 VanDerWaalsContact ND1-CD 3.33Å; H508-E512 IonicContact ND1-OE1 3.55Å; H508-E512 IonicContact ND1-OE2 3.81Å; H508-E512 PolarHBondContact ND1-OE2 3.37Å; H508-E512 WeakPolarHBondContact O-CG 3.41Å; H508-E512 PolarHBondContact O-N 3.08Å
509	R	92.4	Very high	84	Confident	37 Å²	37	73.7 Å²	73.7	14%	0.14	39%	0.389	C	S	.	.	H	α-helix	trans	-60.9	-42.6	177.3	-67.5	-178.5	-65.3	162.7	8.2	112.4	Y76 E80 Y502 T505 A506 R507 E512 E513 D529	Y76-R509 WeakPolarHBondContact OH-CB 3.48Å; E80-R509 IonicContact OE1-CZ 2.82Å; E80-R509 IonicContact OE1-NH1 3.47Å; E80-R509 PolarHBondContact OE1-NH1 2.99Å; E80-R509 IonicContact OE1-NH2 2.68Å; E80-R509 PolarHBondContact OE1-NH2 3.13Å; E80-R509 IonicContact OE2-CZ 3.69Å; E80-R509 VanDerWaalsContact OE2-CZ 3.28Å; E80-R509 IonicContact OE2-NE 3.5Å; E80-R509 IonicContact OE2-NH1 3.31Å; E80-R509 IonicContact OE2-NH2 3.22Å; E80-R509 PolarHBondContact OE2-NH2 3.16Å; Y502-R509 PolarHBondContact OH-NH2 3.12Å; T505-R509 WeakPolarHBondContact O-CG 3.27Å; T505-R509 PolarHBondContact O-N 3.16Å; A506-R509 PolarHBondContact O-N 3.1Å; R507-R509 PolarHBondContact O-N 3.34Å; R509-E512 PolarHBondContact O-N 3.48Å; R509-E513 PolarHBondContact O-N 2.8Å; R509-D529 WeakPolarHBondContact CD-OD2 3.47Å; R509-D529 IonicContact CZ-OD2 3.97Å; R509-D529 IonicContact NE-OD2 2.7Å; R509-D529 PolarHBondContact NE-OD2 2.79Å; R509-D529 VanDerWaalsContact NE-OD2 3.15Å; R509-D529 IonicContact NH1-OD2 3.28Å; R509-D529 PolarHBondContact NH1-OD2 3.32Å
510	F	92.8	Very high	82	Confident	33 Å²	33	77.3 Å²	77.3	15%	0.145	42%	0.421	C	S	.	.	H	α-helix	trans	-60.7	-44.2	174.9	171.6	-107.2	0	0	0	112.3	D72 F73 Y76 A506 R507 H508 E512 E513 R514	D72-F510 HydrophobicContact CB-CE2 4.27Å; D72-F510 HydrophobicContact CB-CZ 3.81Å; F73-F510 HydrophobicContact CB-CD1 4.34Å; F73-F510 HydrophobicContact CB-CE1 4.06Å; F73-F510 HydrophobicContact CB-CZ 4.19Å; F73-F510 HydrophobicContact CD2-CB 3.83Å; F73-F510 AromaticContact CD2-CD1 3.67Å; F73-F510 HydrophobicContact CD2-CD1 3.67Å; F73-F510 HydrophobicContact CD2-CD2 4.16Å; F73-F510 HydrophobicContact CD2-CE1 4.25Å; F73-F510 AromaticContact CD2-CG 3.61Å; F73-F510 HydrophobicContact CD2-CG 3.61Å; F73-F510 HydrophobicContact CE2-CB 3.94Å; F73-F510 HydrophobicContact CE2-CD1 4.44Å; F73-F510 HydrophobicContact CE2-CG 4.25Å; F73-F510 HydrophobicContact CG-CD1 4.35Å; Y76-F510 HydrophobicContact CD1-CB 3.84Å; Y76-F510 HydrophobicContact CD1-CD2 4.19Å; Y76-F510 HydrophobicContact CD1-CG 4.38Å; Y76-F510 HydrophobicContact CD2-CB 4.15Å; Y76-F510 AromaticContact CD2-CD2 3.73Å; Y76-F510 HydrophobicContact CD2-CD2 3.73Å; Y76-F510 HydrophobicContact CD2-CG 4.44Å; Y76-F510 HydrophobicContact CE1-CB 3.94Å; Y76-F510 HydrophobicContact CE2-CB 4.22Å; Y76-F510 HydrophobicContact CG-CB 3.97Å; Y76-F510 AromaticContact CG-CD2 3.54Å; Y76-F510 HydrophobicContact CG-CD2 3.54Å; Y76-F510 HydrophobicContact CG-CE2 4.46Å; Y76-F510 HydrophobicContact CG-CG 4.16Å; A506-F510 WeakPolarHBondContact O-CB 3.49Å; A506-F510 PolarHBondContact O-N 2.66Å; R507-F510 PolarHBondContact O-N 3.27Å; H508-F510 PolarHBondContact O-N 2.77Å; F510-E512 VanDerWaalsContact C-N 3.34Å; F510-E513 PolarHBondContact O-N 2.77Å; F510-R514 WeakPolarHBondContact O-CB 2.88Å; F510-R514 PolarHBondContact O-N 3.28Å
511	E	91.4	Very high	79.7	Confident	80 Å²	80	77.8 Å²	77.8	37%	0.374	44%	0.439	S	S	.	.	H	α-helix	trans	-66.2	-36.3	177.7	-73.1	173.7	-174.8	0	0	112	R507 H508 N515	R507-E511 HydrophobicContact CG-CG 4.48Å; R507-E511 WeakPolarHBondContact CG-OE1 3.36Å; R507-E511 WeakPolarHBondContact O-CG 3.38Å; R507-E511 PolarHBondContact O-N 3.1Å; H508-E511 PolarHBondContact O-N 2.95Å; E511-N515 VanDerWaalsContact O-CB 3.3Å; E511-N515 WeakPolarHBondContact O-CB 3.23Å; E511-N515 PolarHBondContact O-N 2.85Å; E511-N515 PolarHBondContact O-ND2 3.4Å
512	E	88.5	Confident	77.7	Confident	82 Å²	82	84.7 Å²	84.7	38%	0.383	46%	0.462	S	S	.	.	H	α-helix	trans	-65.1	-45	173.7	-72.5	-177.6	133	0	0	112.5	H508 R509 F510 N515	H508-E512 IonicContact CE1-OE1 2.65Å; H508-E512 PolarHBondContact CE1-OE1 2.87Å; H508-E512 IonicContact CE1-OE2 3.54Å; H508-E512 PolarHBondContact CE1-OE2 3.32Å; H508-E512 VanDerWaalsContact ND1-CD 3.33Å; H508-E512 IonicContact ND1-OE1 3.55Å; H508-E512 IonicContact ND1-OE2 3.81Å; H508-E512 PolarHBondContact ND1-OE2 3.37Å; H508-E512 WeakPolarHBondContact O-CG 3.41Å; H508-E512 PolarHBondContact O-N 3.08Å; R509-E512 PolarHBondContact O-N 3.48Å; F510-E512 VanDerWaalsContact C-N 3.34Å; E512-N515 PolarHBondContact O-N 3.41Å
513	E	86.1	Confident	75.6	Confident	101 Å²	101	94.9 Å²	94.9	47%	0.472	50%	0.5	S	S	.	.	H	α-helix	trans	-63.2	-42.8	175.9	-172.6	173.2	170.4	0	0	110.9	Y76 K79 R509 F510 N515 G516	Y76-E513 WeakPolarHBondContact CE2-OE2 3.4Å; K79-E513 IonicContact NZ-OE1 2.73Å; R509-E513 PolarHBondContact O-N 2.8Å; F510-E513 PolarHBondContact O-N 2.77Å; E513-N515 VanDerWaalsContact C-N 3.33Å; E513-N515 PolarHBondContact O-N 2.89Å; E513-G516 PolarHBondContact O-N 3.46Å
514	R	86.4	Confident	73.5	Confident	165 Å²	165	96.5 Å²	96.5	62%	0.623	51%	0.507	S	S	*	.	H	α-helix	trans	-64.4	-35.3	177.7	-170.2	-177.7	68.9	170.5	-3.5	112.9	F510 G516	F510-R514 WeakPolarHBondContact O-CB 2.88Å; F510-R514 PolarHBondContact O-N 3.28Å; R514-G516 PolarHBondContact O-N 3.37Å
515	N	83.3	Confident	71.6	Confident	107 Å²	107	98.5 Å²	98.5	57%	0.572	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	6.4	-178.4	-69.9	-23.2	0	0	0	113.7	E511 E512 E513 K517	E511-N515 VanDerWaalsContact O-CB 3.3Å; E511-N515 WeakPolarHBondContact O-CB 3.23Å; E511-N515 PolarHBondContact O-N 2.85Å; E511-N515 PolarHBondContact O-ND2 3.4Å; E512-N515 PolarHBondContact O-N 3.41Å; E513-N515 VanDerWaalsContact C-N 3.33Å; E513-N515 PolarHBondContact O-N 2.89Å; N515-K517 PolarHBondContact O-N 2.78Å
516	G	71.1	Confident	69.4	Low	64 Å²	64	97.3 Å²	97.3	66%	0.66	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	14.3	174.2	0	0	0	0	0	114.5	E513 R514	E513-G516 PolarHBondContact O-N 3.46Å; R514-G516 PolarHBondContact O-N 3.37Å
517	K	58.3	Low	67.3	Low	139 Å²	139	97.8 Å²	97.8	60%	0.604	50%	0.498	S	S	*	.			trans	-71.3	131.1	168	-71.7	-179	-179.3	175.6	0	107.2	N515 A519	N515-K517 PolarHBondContact O-N 2.78Å; K517-A519 PolarHBondContact O-N 3.01Å
518	P	53.6	Low	65	Low	121 Å²	121	92.1 Å²	92.1	79%	0.786	48%	0.478	S	S	*	.			trans	-59.5	113.2	178.3	23.3	-30.6	0	0	0	108	A520	P518-A520 VanDerWaalsContact C-N 3.32Å; P518-A520 PolarHBondContact O-N 2.78Å
519	A	52.9	Low	62.7	Low	88 Å²	88	88.6 Å²	88.6	73%	0.727	46%	0.463	S	S	*	.			trans	-57.2	103.5	165.7	0	0	0	0	0	105.8	K517 A521	K517-A519 PolarHBondContact O-N 3.01Å; A519-A521 VanDerWaalsContact C-N 3.25Å; A519-A521 PolarHBondContact O-N 2.83Å
520	A	45.6	Very low	60.4	Low	90 Å²	90	88.2 Å²	88.2	74%	0.744	46%	0.464	S	S	*	.			trans	-61.9	92.3	178.6	0	0	0	0	0	108.1	P518 R522	P518-A520 VanDerWaalsContact C-N 3.32Å; P518-A520 PolarHBondContact O-N 2.78Å; A520-R522 PolarHBondContact O-N 3.24Å
521	A	42.1	Very low	58.1	Low	107 Å²	107	87.6 Å²	87.6	88%	0.884	46%	0.464	S	S	*	.	S	Bend	trans	36.3	21.5	159.5	0	0	0	0	0	119.7	A519 R523	A519-A521 VanDerWaalsContact C-N 3.25Å; A519-A521 PolarHBondContact O-N 2.83Å; A521-R523 PolarHBondContact O-N 3.03Å
522	R	47	Very low	55.7	Low	162 Å²	162	89 Å²	89	61%	0.611	47%	0.473	S	S	*	.			trans	-100.8	80.8	-175.1	-152.3	172.3	-170.8	-165	-2.5	110.5	A520 E524	A520-R522 PolarHBondContact O-N 3.24Å; R522-E524 HydrophobicContact CG-CB 4.14Å; R522-E524 HydrophobicContact CG-CG 3.87Å; R522-E524 IonicContact CZ-OE1 2.7Å; R522-E524 IonicContact CZ-OE2 3.18Å; R522-E524 IonicContact NE-OE1 2.79Å; R522-E524 PolarHBondContact NE-OE1 3.37Å; R522-E524 IonicContact NE-OE2 2.72Å; R522-E524 VanDerWaalsContact NH2-CD 3.34Å; R522-E524 IonicContact NH2-OE1 3.15Å; R522-E524 PolarHBondContact NH2-OE1 2.95Å; R522-E524 IonicContact NH2-OE2 2.72Å; R522-E524 PolarHBondContact NH2-OE2 3.39Å; R522-E524 PolarHBondContact O-N 3.04Å
523	R	44.3	Very low	53.4	Low	226 Å²	226	86.2 Å²	86.2	85%	0.853	47%	0.465	S	S	*	.			trans	-73.2	47.3	169	-131.9	-177.4	-159.1	-174	5.6	110.3	A521 R525	A521-R523 PolarHBondContact O-N 3.03Å; R523-R525 VanDerWaalsContact C-N 3.34Å; R523-R525 PolarHBondContact O-N 2.89Å; R523-R525 VanDerWaalsContact O-N 3.12Å
524	E	47.9	Very low	51.5	Low	55 Å²	55	91.4 Å²	91.4	26%	0.257	49%	0.486	S	S	.	.			trans	-84.7	84	173.1	-80.6	-171.7	-148.5	0	0	109	R522 F526 G528	R522-E524 HydrophobicContact CG-CB 4.14Å; R522-E524 HydrophobicContact CG-CG 3.87Å; R522-E524 IonicContact CZ-OE1 2.7Å; R522-E524 IonicContact CZ-OE2 3.18Å; R522-E524 IonicContact NE-OE1 2.79Å; R522-E524 PolarHBondContact NE-OE1 3.37Å; R522-E524 IonicContact NE-OE2 2.72Å; R522-E524 VanDerWaalsContact NH2-CD 3.34Å; R522-E524 IonicContact NH2-OE1 3.15Å; R522-E524 PolarHBondContact NH2-OE1 2.95Å; R522-E524 IonicContact NH2-OE2 2.72Å; R522-E524 PolarHBondContact NH2-OE2 3.39Å; R522-E524 PolarHBondContact O-N 3.04Å; E524-F526 PolarHBondContact O-N 3.01Å; E524-F526 VanDerWaalsContact O-N 3.14Å; E524-G528 VanDerWaalsContact OE2-CA 3.25Å; E524-G528 WeakPolarHBondContact OE2-CA 3.25Å
525	R	51.8	Low	49.8	Very low	141 Å²	141	89.3 Å²	89.3	53%	0.532	48%	0.482	S	S	.	.			trans	-52.1	118.5	168.7	-68.2	179.8	-177.5	169.3	-1.8	109.1	R523 S527	R523-R525 VanDerWaalsContact C-N 3.34Å; R523-R525 PolarHBondContact O-N 2.89Å; R523-R525 VanDerWaalsContact O-N 3.12Å; R525-S527 PolarHBondContact O-N 3.41Å; R525-S527 PolarHBondContact O-OG 2.94Å
526	F	46	Very low	48.5	Very low	16 Å²	16	91.3 Å²	91.3	7%	0.07	49%	0.492	C	S	.	.	S	Bend	trans	58.3	-14.2	164.6	-116.9	-114.1	0	0	0	119.8	E80 L81 Y502 E524	E80-F526 HydrophobicContact CB-CE2 4.45Å; E80-F526 WeakPolarHBondContact O-CD2 3.46Å; E80-F526 WeakPolarHBondContact O-CE2 3.23Å; L81-F526 HydrophobicContact CB-CE2 3.55Å; L81-F526 HydrophobicContact CB-CZ 3.47Å; L81-F526 VanDerWaalsContact CB-CZ 3.47Å; L81-F526 HydrophobicContact CD2-CE1 4.16Å; L81-F526 HydrophobicContact CD2-CE2 3.29Å; L81-F526 HydrophobicContact CD2-CZ 3.03Å; L81-F526 HydrophobicContact CG-CE2 3.58Å; L81-F526 HydrophobicContact CG-CZ 3.62Å; Y502-F526 HydrophobicContact CE2-CD2 4.4Å; Y502-F526 HydrophobicContact CE2-CE2 4.18Å; Y502-F526 AromaticContact CZ-CE2 3.8Å; Y502-F526 VanDerWaalsContact OH-CE2 3.26Å; Y502-F526 WeakPolarHBondContact OH-CE2 3.34Å; E524-F526 PolarHBondContact O-N 3.01Å; E524-F526 VanDerWaalsContact O-N 3.14Å
527	S	46.3	Very low	48.2	Very low	10 Å²	10	90.3 Å²	90.3	7%	0.07	47%	0.47	C	S	.	.	S	Bend	trans	-98.7	-46	-164.9	-70.9	0	0	0	0	112.2	R134 R525 D529 S531	R134-S527 PolarHBondContact NH1-O 3.49Å; R134-S527 PolarHBondContact NH2-O 2.82Å; R525-S527 PolarHBondContact O-N 3.41Å; R525-S527 PolarHBondContact O-OG 2.94Å; S527-D529 VanDerWaalsContact C-N 3.33Å; S527-D529 PolarHBondContact O-N 3.32Å; S527-D529 VanDerWaalsContact O-N 3.15Å; S527-S531 PolarHBondContact O-OG 2.71Å
528	G	46.1	Very low	49.1	Very low	5 Å²	5	88.7 Å²	88.7	5%	0.052	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-34.6	-171.1	0	0	0	0	0	116.1	E524 S531	E524-G528 VanDerWaalsContact OE2-CA 3.25Å; E524-G528 WeakPolarHBondContact OE2-CA 3.25Å; G528-S531 PolarHBondContact O-OG 2.77Å
529	D	43.4	Very low	50.1	Low	32 Å²	32	83.4 Å²	83.4	17%	0.171	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-18.2	-154.5	-69.7	-33.2	0	0	0	116.4	T505 R509 S527 S531	T505-D529 HydrophobicContact CG2-CB 3.72Å; R509-D529 WeakPolarHBondContact CD-OD2 3.47Å; R509-D529 IonicContact CZ-OD2 3.97Å; R509-D529 IonicContact NE-OD2 2.7Å; R509-D529 PolarHBondContact NE-OD2 2.79Å; R509-D529 VanDerWaalsContact NE-OD2 3.15Å; R509-D529 IonicContact NH1-OD2 3.28Å; R509-D529 PolarHBondContact NH1-OD2 3.32Å; S527-D529 VanDerWaalsContact C-N 3.33Å; S527-D529 PolarHBondContact O-N 3.32Å; S527-D529 VanDerWaalsContact O-N 3.15Å; D529-S531 PolarHBondContact O-N 3.26Å
530	L	44.4	Very low	51.1	Low	29 Å²	29	83.6 Å²	83.6	15%	0.152	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-21.6	166.6	-80.5	162.6	0	0	0	111.7	M498 Y502	M498-L530 HydrophobicContact CG-CD1 4.48Å; M498-L530 HydrophobicContact CG-CD2 3.55Å; M498-L530 WeakPolarHBondContact O-CD2 3.3Å; Y502-L530 HydrophobicContact CD2-CD1 4.22Å; Y502-L530 HydrophobicContact CD2-CD2 4.5Å; Y502-L530 HydrophobicContact CD2-CG 4.04Å
531	S	43	Very low	52.2	Low	20 Å²	20	79.7 Å²	79.7	14%	0.14	39%	0.392	C	S	.	.	S	Bend	trans	-84.2	-19	-175.4	23	0	0	0	0	115.4	R134 S527 G528 D529 H550	R134-S531 PolarHBondContact NH1-OG 2.73Å; S527-S531 PolarHBondContact O-OG 2.71Å; G528-S531 PolarHBondContact O-OG 2.77Å; D529-S531 PolarHBondContact O-N 3.26Å; S531-H550 WeakPolarHBondContact CA-CE1 2.98Å; S531-H550 VanDerWaalsContact CA-NE2 3.31Å; S531-H550 WeakPolarHBondContact CA-NE2 3.42Å; S531-H550 WeakPolarHBondContact CB-NE2 3.26Å; S531-H550 PolarHBondContact O-CE1 3.15Å
532	N	41.2	Very low	53	Low	108 Å²	108	78.4 Å²	78.4	58%	0.578	39%	0.389	S	S	*	.			trans	-96.7	3.9	-174.9	-81.8	-23.9	0	0	0	114.3	K534	N532-K534 PolarHBondContact O-N 2.93Å; N532-K534 VanDerWaalsContact O-N 3.11Å
533	A	41.3	Very low	54.2	Low	25 Å²	25	74.1 Å²	74.1	21%	0.207	38%	0.384	C	S	.	.			trans	-75.7	101.5	175.9	0	0	0	0	0	110.2	S501 F535	S501-A533 WeakPolarHBondContact OG-CB 3.33Å; A533-F535 VanDerWaalsContact C-N 3.28Å; A533-F535 HydrophobicContact CB-CD2 3.64Å; A533-F535 HydrophobicContact CB-CE2 3.66Å; A533-F535 PolarHBondContact O-N 2.87Å
534	K	44.9	Very low	55.8	Low	210 Å²	210	63.5 Å²	63.5	91%	0.913	34%	0.344	S	S	*	.			trans	-68.7	82.7	172.9	-76.4	-178.3	176.6	178.2	0	110.4	N532	N532-K534 PolarHBondContact O-N 2.93Å; N532-K534 VanDerWaalsContact O-N 3.11Å
535	F	50.7	Low	57.4	Low	121 Å²	121	68 Å²	68	53%	0.531	37%	0.37	S	S	.	.			trans	-106.8	135.3	167.1	-70.9	-74.1	0	0	0	110.1	A533 F537	A533-F535 VanDerWaalsContact C-N 3.28Å; A533-F535 HydrophobicContact CB-CD2 3.64Å; A533-F535 HydrophobicContact CB-CE2 3.66Å; A533-F535 PolarHBondContact O-N 2.87Å; F535-F537 HydrophobicContact CB-CD2 4.41Å; F535-F537 HydrophobicContact CB-CE2 3.7Å; F535-F537 HydrophobicContact CB-CZ 3.77Å; F535-F537 WeakPolarHBondContact O-CD2 3.44Å; F535-F537 PolarHBondContact O-N 2.73Å
536	N	56.6	Low	58.8	Low	148 Å²	148	65.8 Å²	65.8	79%	0.791	36%	0.362	S	S	*	.			trans	-85.3	101.6	175.9	-74	-17.1	0	0	0	108.8	T547	N536-T547 HydrophobicContact CB-CG2 4.03Å
537	F	64.6	Low	60.4	Low	43 Å²	43	69.3 Å²	69.3	19%	0.189	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	157.3	169.5	-57.2	-82.8	0	0	0	109.6	L494 F535 T547 A548 H550 F554	L494-F537 HydrophobicContact CD2-CE1 4.47Å; F535-F537 HydrophobicContact CB-CD2 4.41Å; F535-F537 HydrophobicContact CB-CE2 3.7Å; F535-F537 HydrophobicContact CB-CZ 3.77Å; F535-F537 WeakPolarHBondContact O-CD2 3.44Å; F535-F537 PolarHBondContact O-N 2.73Å; F537-T547 CarbonylContact O-C 3.48Å; F537-T547 VanDerWaalsContact O-CA 3.27Å; F537-T547 WeakPolarHBondContact O-CA 3.19Å; F537-A548 HydrophobicContact CB-CB 3.99Å; F537-A548 WeakPolarHBondContact CB-O 3.48Å; F537-A548 PolarHBondContact N-O 3.42Å; F537-A548 VanDerWaalsContact N-O 3.07Å; F537-A548 PolarHBondContact O-N 3.45Å; F537-H550 HydrophobicContact CE2-CB 4.44Å; F537-F554 HydrophobicContact CB-CD1 4.41Å; F537-F554 AromaticContact CD1-CD1 3.92Å; F537-F554 HydrophobicContact CD1-CD1 3.92Å; F537-F554 HydrophobicContact CD1-CE1 4.06Å; F537-F554 HydrophobicContact CD2-CD1 4.11Å; F537-F554 HydrophobicContact CD2-CE1 4.31Å; F537-F554 HydrophobicContact CE1-CD1 4.21Å; F537-F554 AromaticContact CE1-CE1 3.86Å; F537-F554 HydrophobicContact CE1-CE1 3.86Å; F537-F554 HydrophobicContact CE2-CD1 4.37Å; F537-F554 HydrophobicContact CE2-CE1 4.11Å; F537-F554 AromaticContact CG-CD1 3.87Å; F537-F554 HydrophobicContact CG-CD1 3.87Å; F537-F554 HydrophobicContact CG-CE1 4.28Å; F537-F554 HydrophobicContact CZ-CD1 4.42Å; F537-F554 AromaticContact CZ-CE1 3.88Å; F537-F554 HydrophobicContact CZ-CE1 3.88Å
538	T	76.8	Confident	61.7	Low	106 Å²	106	69.1 Å²	69.1	65%	0.65	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	140.8	160.9	41.6	0	0	0	0	109.2	I540	T538-I540 PolarHBondContact O-N 3.28Å
539	C	76	Confident	62.5	Low	9 Å²	9	70.3 Å²	70.3	6%	0.061	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-51.3	127.8	178.4	-174.3	0	0	0	0	111.9	N541 C544 R546 A548 F554 C556	C539-N541 PolarHBondContact O-N 2.76Å; C539-N541 VanDerWaalsContact SG-CB 3.55Å; C539-C544 HydrophobicContact CB-CB 3.81Å; C539-C544 WeakPolarHBondContact CB-O 3.35Å; C539-C544 VanDerWaalsContact SG-SG 3.7Å; C539-R546 WeakPolarHBondContact CB-O 3.13Å; C539-R546 PolarHBondContact N-O 2.95Å; C539-A548 HydrophobicContact CB-CB 4.42Å; C539-F554 CarbonylContact C-O 3.45Å; C539-F554 WeakPolarHBondContact CA-O 3.48Å; C539-C556 HydrophobicContact CB-CB 3.98Å; C539-C556 PolarHBondContact SG-N 3.24Å
540	I	74.2	Confident	63.5	Low	93 Å²	93	71.4 Å²	71.4	48%	0.477	40%	0.395	S	S	.	.	S	Bend	trans	-70.7	-13.6	179.4	-163.4	168.3	0	0	0	112.8	T538 G542 F554 L555	T538-I540 PolarHBondContact O-N 3.28Å; I540-G542 PolarHBondContact O-N 2.74Å; I540-G542 VanDerWaalsContact O-N 3.09Å; I540-F554 HydrophobicContact CB-CB 4.36Å; I540-F554 HydrophobicContact CG2-CB 4.35Å; I540-F554 WeakPolarHBondContact CG2-O 3.29Å; I540-F554 PolarHBondContact N-O 3.31Å; I540-L555 HydrophobicContact CG2-CD2 3.58Å; I540-L555 HydrophobicContact CG2-CG 4.03Å
541	N	68.8	Low	64.3	Low	8 Å²	8	75 Å²	75	4%	0.043	41%	0.411	C	S	.	.	S	Bend	trans	-64.3	111.6	170.5	-176.9	8.5	0	0	0	108.6	C539 S543 C544 L555 C559 F618	C539-N541 PolarHBondContact O-N 2.76Å; C539-N541 VanDerWaalsContact SG-CB 3.55Å; N541-S543 PolarHBondContact O-N 3.14Å; N541-S543 PolarHBondContact OD1-OG 3.34Å; N541-C544 HydrophobicContact CB-CB 3.98Å; N541-C544 WeakPolarHBondContact O-CA 3.14Å; N541-C544 WeakPolarHBondContact O-CB 3.35Å; N541-C544 PolarHBondContact O-N 3.42Å; N541-L555 HydrophobicContact CB-CD2 3.89Å; N541-C559 HydrophobicContact CB-CB 4.48Å; N541-C559 PolarHBondContact ND2-SG 3.1Å; N541-F618 HydrophobicContact CB-CZ 4.32Å; N541-F618 WeakPolarHBondContact OD1-CZ 3.48Å
542	G	58.7	Low	65.5	Low	79 Å²	79	75.1 Å²	75.1	81%	0.814	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-8.1	-169.5	0	0	0	0	0	116.2	I540	I540-G542 PolarHBondContact O-N 2.74Å; I540-G542 VanDerWaalsContact O-N 3.09Å
543	S	71.2	Confident	66.7	Low	73 Å²	73	72.2 Å²	72.2	51%	0.51	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	7.7	171.6	59.3	0	0	0	0	114.2	N541	N541-S543 PolarHBondContact O-N 3.14Å; N541-S543 PolarHBondContact OD1-OG 3.34Å
544	C	78.3	Confident	68.2	Low	3 Å²	3	73.9 Å²	73.9	2%	0.02	40%	0.398	C	S	.	.			trans	-127.4	119.8	-172.8	-169.9	0	0	0	0	111.7	C539 N541 C556 C611	C539-C544 HydrophobicContact CB-CB 3.81Å; C539-C544 WeakPolarHBondContact CB-O 3.35Å; C539-C544 VanDerWaalsContact SG-SG 3.7Å; N541-C544 HydrophobicContact CB-CB 3.98Å; N541-C544 WeakPolarHBondContact O-CA 3.14Å; N541-C544 WeakPolarHBondContact O-CB 3.35Å; N541-C544 PolarHBondContact O-N 3.42Å; C544-C556 PolarHBondContact SG-SG 2.88Å; C544-C611 VanDerWaalsContact SG-SG 3.67Å
545	N	81.5	Confident	69.6	Low	150 Å²	150	64.5 Å²	64.5	80%	0.802	36%	0.358	S	S	*	.			trans	-101	16.4	176.6	-67.5	-17	0	0	0	113.1
546	R	80.4	Confident	71.2	Confident	93 Å²	93	58.9 Å²	58.9	35%	0.351	33%	0.334	S	S	.	.	S	Bend	trans	-81.5	156.7	-176.5	-60.8	-172	-167.3	-168.4	19.1	111.3	C539 A548 C556 E558	C539-R546 WeakPolarHBondContact CB-O 3.13Å; C539-R546 PolarHBondContact N-O 2.95Å; R546-A548 PolarHBondContact O-N 3.31Å; R546-C556 HydrophobicContact CB-CB 3.55Å; R546-E558 IonicContact CZ-OE1 2.9Å; R546-E558 IonicContact CZ-OE2 3.99Å; R546-E558 IonicContact NE-OE2 3.98Å; R546-E558 IonicContact NH1-OE1 3.64Å; R546-E558 PolarHBondContact NH1-OE1 3.12Å; R546-E558 IonicContact NH1-OE2 3.07Å; R546-E558 PolarHBondContact NH1-OE2 2.82Å; R546-E558 IonicContact NH2-OE1 2.82Å; R546-E558 IonicContact NH2-OE2 3.02Å; R546-E558 PolarHBondContact NH2-OE2 3.49Å
547	T	81	Confident	72.3	Confident	91 Å²	91	54 Å²	54	56%	0.558	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62	131.4	178.8	-45.4	0	0	0	0	110.9	N536 F537 C556	N536-T547 HydrophobicContact CB-CG2 4.03Å; F537-T547 CarbonylContact O-C 3.48Å; F537-T547 VanDerWaalsContact O-CA 3.27Å; F537-T547 WeakPolarHBondContact O-CA 3.19Å; T547-C556 VanDerWaalsContact O-CA 3.28Å; T547-C556 WeakPolarHBondContact O-CA 3.34Å; T547-C556 WeakPolarHBondContact O-CB 3.5Å
548	A	72.6	Confident	73.1	Confident	5 Å²	5	56.1 Å²	56.1	4%	0.041	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	158.4	175.9	0	0	0	0	0	110.3	F537 C539 R546 F554 L555	F537-A548 HydrophobicContact CB-CB 3.99Å; F537-A548 WeakPolarHBondContact CB-O 3.48Å; F537-A548 PolarHBondContact N-O 3.42Å; F537-A548 VanDerWaalsContact N-O 3.07Å; F537-A548 PolarHBondContact O-N 3.45Å; C539-A548 HydrophobicContact CB-CB 4.42Å; R546-A548 PolarHBondContact O-N 3.31Å; A548-F554 VanDerWaalsContact CB-O 3.23Å; A548-F554 WeakPolarHBondContact CB-O 3.38Å; A548-L555 WeakPolarHBondContact CA-O 3.47Å; A548-L555 WeakPolarHBondContact CB-O 2.82Å
549	S	63.4	Low	73.1	Confident	31 Å²	31	51.2 Å²	51.2	22%	0.217	30%	0.299	C	S	.	.			trans	-124.9	163.5	172.7	72.3	0	0	0	0	109.7	E551 T552 F554	S549-E551 PolarHBondContact O-N 2.76Å; S549-E551 WeakPolarHBondContact OG-CB 3.41Å; S549-E551 PolarHBondContact OG-N 3.23Å; S549-T552 PolarHBondContact N-OG1 2.9Å; S549-T552 VanDerWaalsContact N-OG1 3.13Å; S549-T552 PolarHBondContact O-N 2.57Å; S549-T552 PolarHBondContact O-OG1 2.7Å; S549-T552 PolarHBondContact OG-N 2.86Å; S549-T552 PolarHBondContact OG-OG1 3.46Å; S549-T552 VanDerWaalsContact OG-OG1 3.08Å; S549-F554 WeakPolarHBondContact O-CA 3.43Å; S549-F554 PolarHBondContact O-N 2.72Å
550	H	63.3	Low	73.3	Confident	55 Å²	55	53 Å²	53	26%	0.255	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-65	-26.1	170.1	94.6	-67.5	0	0	0	110.9	S531 F537 T552 N553 F554	S531-H550 WeakPolarHBondContact CA-CE1 2.98Å; S531-H550 VanDerWaalsContact CA-NE2 3.31Å; S531-H550 WeakPolarHBondContact CA-NE2 3.42Å; S531-H550 WeakPolarHBondContact CB-NE2 3.26Å; S531-H550 PolarHBondContact O-CE1 3.15Å; F537-H550 HydrophobicContact CE2-CB 4.44Å; H550-T552 PolarHBondContact O-N 2.93Å; H550-N553 PolarHBondContact O-N 3.15Å; H550-F554 HydrophobicContact CB-CE1 4.33Å; H550-F554 HydrophobicContact CB-CZ 4.42Å
551	E	61.2	Low	73.4	Confident	105 Å²	105	54 Å²	54	49%	0.491	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-64.6	-26.3	177.1	-56.5	177.1	160.2	0	0	111.5	F135 S549	F135-E551 WeakPolarHBondContact CZ-O 3.19Å; S549-E551 PolarHBondContact O-N 2.76Å; S549-E551 WeakPolarHBondContact OG-CB 3.41Å; S549-E551 PolarHBondContact OG-N 3.23Å
552	T	68.3	Low	73.6	Confident	21 Å²	21	56 Å²	56	13%	0.129	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-105.4	26.3	179.9	52.7	0	0	0	0	112.3	S549 H550 F554 L555 F560	S549-T552 PolarHBondContact N-OG1 2.9Å; S549-T552 VanDerWaalsContact N-OG1 3.13Å; S549-T552 PolarHBondContact O-N 2.57Å; S549-T552 PolarHBondContact O-OG1 2.7Å; S549-T552 PolarHBondContact OG-N 2.86Å; S549-T552 PolarHBondContact OG-OG1 3.46Å; S549-T552 VanDerWaalsContact OG-OG1 3.08Å; H550-T552 PolarHBondContact O-N 2.93Å; T552-F554 PolarHBondContact O-N 2.8Å; T552-L555 WeakPolarHBondContact CB-O 3.37Å; T552-L555 VanDerWaalsContact O-CB 3.31Å; T552-L555 WeakPolarHBondContact O-CB 3.48Å; T552-L555 PolarHBondContact O-N 3.45Å; T552-L555 PolarHBondContact OG1-O 3.38Å; T552-F560 VanDerWaalsContact C-CD2 3.48Å; T552-F560 VanDerWaalsContact CA-CD2 3.5Å; T552-F560 HydrophobicContact CG2-CB 4.01Å; T552-F560 HydrophobicContact CG2-CD1 3.85Å; T552-F560 HydrophobicContact CG2-CD2 4.42Å; T552-F560 HydrophobicContact CG2-CE1 4.43Å; T552-F560 HydrophobicContact CG2-CG 3.83Å; T552-F560 VanDerWaalsContact O-CD2 3.27Å; T552-F560 WeakPolarHBondContact O-CD2 3.27Å
553	N	66.7	Low	74.1	Confident	47 Å²	47	55.9 Å²	55.9	25%	0.251	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	39.6	-177.2	-65.6	-38.9	0	0	0	113.2	H550 L555	H550-N553 PolarHBondContact O-N 3.15Å; N553-L555 PolarHBondContact O-N 2.82Å
554	F	73.8	Confident	74	Confident	61 Å²	61	54.3 Å²	54.3	27%	0.268	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	17.8	-175.9	-48.5	-82.6	0	0	0	114.5	L494 F537 C539 I540 A548 S549 H550 T552	L494-F554 HydrophobicContact CD1-CD1 4.22Å; L494-F554 HydrophobicContact CD1-CE1 3.76Å; L494-F554 HydrophobicContact CD1-CE2 4.5Å; L494-F554 HydrophobicContact CD1-CZ 3.92Å; F537-F554 HydrophobicContact CB-CD1 4.41Å; F537-F554 AromaticContact CD1-CD1 3.92Å; F537-F554 HydrophobicContact CD1-CD1 3.92Å; F537-F554 HydrophobicContact CD1-CE1 4.06Å; F537-F554 HydrophobicContact CD2-CD1 4.11Å; F537-F554 HydrophobicContact CD2-CE1 4.31Å; F537-F554 HydrophobicContact CE1-CD1 4.21Å; F537-F554 AromaticContact CE1-CE1 3.86Å; F537-F554 HydrophobicContact CE1-CE1 3.86Å; F537-F554 HydrophobicContact CE2-CD1 4.37Å; F537-F554 HydrophobicContact CE2-CE1 4.11Å; F537-F554 AromaticContact CG-CD1 3.87Å; F537-F554 HydrophobicContact CG-CD1 3.87Å; F537-F554 HydrophobicContact CG-CE1 4.28Å; F537-F554 HydrophobicContact CZ-CD1 4.42Å; F537-F554 AromaticContact CZ-CE1 3.88Å; F537-F554 HydrophobicContact CZ-CE1 3.88Å; C539-F554 CarbonylContact C-O 3.45Å; C539-F554 WeakPolarHBondContact CA-O 3.48Å; I540-F554 HydrophobicContact CB-CB 4.36Å; I540-F554 HydrophobicContact CG2-CB 4.35Å; I540-F554 WeakPolarHBondContact CG2-O 3.29Å; I540-F554 PolarHBondContact N-O 3.31Å; A548-F554 VanDerWaalsContact CB-O 3.23Å; A548-F554 WeakPolarHBondContact CB-O 3.38Å; S549-F554 WeakPolarHBondContact O-CA 3.43Å; S549-F554 PolarHBondContact O-N 2.72Å; H550-F554 HydrophobicContact CB-CE1 4.33Å; H550-F554 HydrophobicContact CB-CZ 4.42Å; T552-F554 PolarHBondContact O-N 2.8Å
555	L	73.7	Confident	73.5	Confident	13 Å²	13	59.3 Å²	59.3	7%	0.068	31%	0.309	C	S	.	.	S	Bend	trans	-95.7	156.1	167.1	-63.8	164.8	0	0	0	110.3	I540 N541 A548 T552 N553 C559 F560 Q563	I540-L555 HydrophobicContact CG2-CD2 3.58Å; I540-L555 HydrophobicContact CG2-CG 4.03Å; N541-L555 HydrophobicContact CB-CD2 3.89Å; A548-L555 WeakPolarHBondContact CA-O 3.47Å; A548-L555 WeakPolarHBondContact CB-O 2.82Å; T552-L555 WeakPolarHBondContact CB-O 3.37Å; T552-L555 VanDerWaalsContact O-CB 3.31Å; T552-L555 WeakPolarHBondContact O-CB 3.48Å; T552-L555 PolarHBondContact O-N 3.45Å; T552-L555 PolarHBondContact OG1-O 3.38Å; N553-L555 PolarHBondContact O-N 2.82Å; L555-C559 HydrophobicContact CB-CB 3.93Å; L555-C559 HydrophobicContact CD2-CB 4.01Å; L555-C559 HydrophobicContact CG-CB 4.44Å; L555-F560 HydrophobicContact CB-CB 4.06Å; L555-Q563 HydrophobicContact CD1-CB 4.15Å; L555-Q563 HydrophobicContact CD1-CG 4.45Å
556	C	85.3	Confident	72.6	Confident	3 Å²	3	55.4 Å²	55.4	2%	0.02	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-70.7	162.4	167.4	73.1	0	0	0	0	110.5	C539 C544 R546 T547 E558 C559 F560	C539-C556 HydrophobicContact CB-CB 3.98Å; C539-C556 PolarHBondContact SG-N 3.24Å; C544-C556 PolarHBondContact SG-SG 2.88Å; R546-C556 HydrophobicContact CB-CB 3.55Å; T547-C556 VanDerWaalsContact O-CA 3.28Å; T547-C556 WeakPolarHBondContact O-CA 3.34Å; T547-C556 WeakPolarHBondContact O-CB 3.5Å; C556-E558 VanDerWaalsContact C-N 3.26Å; C556-E558 PolarHBondContact O-N 3.16Å; C556-E558 VanDerWaalsContact O-N 3.16Å; C556-C559 PolarHBondContact O-N 2.81Å; C556-C559 PolarHBondContact SG-N 3.42Å; C556-C559 VanDerWaalsContact SG-N 3.41Å; C556-C559 PolarHBondContact SG-SG 2.98Å; C556-F560 WeakPolarHBondContact O-CB 3.23Å; C556-F560 PolarHBondContact O-N 3.21Å
557	G	79.4	Confident	71.1	Confident	46 Å²	46	54.8 Å²	54.8	47%	0.474	29%	0.291	S	S	.	.	H	α-helix	trans	-49	-44.6	-179	0	0	0	0	0	113.8	F560 E561	G557-F560 PolarHBondContact O-N 2.98Å; G557-E561 WeakPolarHBondContact O-CB 3.29Å; G557-E561 PolarHBondContact O-N 2.86Å
558	E	80.1	Confident	69.7	Low	86 Å²	86	55.7 Å²	55.7	40%	0.402	29%	0.289	S	S	.	.	H	α-helix	trans	-66.9	-44.3	177.1	-76.2	-179.8	-162	0	0	113.2	R546 C556 F560 E561 V562	R546-E558 IonicContact CZ-OE1 2.9Å; R546-E558 IonicContact CZ-OE2 3.99Å; R546-E558 IonicContact NE-OE2 3.98Å; R546-E558 IonicContact NH1-OE1 3.64Å; R546-E558 PolarHBondContact NH1-OE1 3.12Å; R546-E558 IonicContact NH1-OE2 3.07Å; R546-E558 PolarHBondContact NH1-OE2 2.82Å; R546-E558 IonicContact NH2-OE1 2.82Å; R546-E558 IonicContact NH2-OE2 3.02Å; R546-E558 PolarHBondContact NH2-OE2 3.49Å; C556-E558 VanDerWaalsContact C-N 3.26Å; C556-E558 PolarHBondContact O-N 3.16Å; C556-E558 VanDerWaalsContact O-N 3.16Å; E558-F560 VanDerWaalsContact C-N 3.3Å; E558-F560 PolarHBondContact O-N 3.02Å; E558-E561 PolarHBondContact O-N 2.6Å; E558-V562 VanDerWaalsContact O-CG2 3.3Å; E558-V562 WeakPolarHBondContact O-CG2 3.44Å; E558-V562 PolarHBondContact O-N 2.97Å
559	C	76.7	Confident	68.4	Low	4 Å²	4	58.6 Å²	58.6	3%	0.027	31%	0.309	C	S	.	.	H	α-helix	trans	-67.4	-35.7	179.1	-72.2	0	0	0	0	111.5	N541 L555 C556 Q563	N541-C559 HydrophobicContact CB-CB 4.48Å; N541-C559 PolarHBondContact ND2-SG 3.1Å; L555-C559 HydrophobicContact CB-CB 3.93Å; L555-C559 HydrophobicContact CD2-CB 4.01Å; L555-C559 HydrophobicContact CG-CB 4.44Å; C556-C559 PolarHBondContact O-N 2.81Å; C556-C559 PolarHBondContact SG-N 3.42Å; C556-C559 VanDerWaalsContact SG-N 3.41Å; C556-C559 PolarHBondContact SG-SG 2.98Å; C559-Q563 WeakPolarHBondContact O-CB 3.43Å; C559-Q563 PolarHBondContact O-N 3.26Å
560	F	80	Confident	67.2	Low	46 Å²	46	59.3 Å²	59.3	20%	0.202	31%	0.308	C	S	.	.	H	α-helix	trans	-67.7	-42.5	175.3	-178.9	-105.5	0	0	0	111.9	T552 L555 C556 G557 E558 Q563 T564	T552-F560 VanDerWaalsContact C-CD2 3.48Å; T552-F560 VanDerWaalsContact CA-CD2 3.5Å; T552-F560 HydrophobicContact CG2-CB 4.01Å; T552-F560 HydrophobicContact CG2-CD1 3.85Å; T552-F560 HydrophobicContact CG2-CD2 4.42Å; T552-F560 HydrophobicContact CG2-CE1 4.43Å; T552-F560 HydrophobicContact CG2-CG 3.83Å; T552-F560 VanDerWaalsContact O-CD2 3.27Å; T552-F560 WeakPolarHBondContact O-CD2 3.27Å; L555-F560 HydrophobicContact CB-CB 4.06Å; C556-F560 WeakPolarHBondContact O-CB 3.23Å; C556-F560 PolarHBondContact O-N 3.21Å; G557-F560 PolarHBondContact O-N 2.98Å; E558-F560 VanDerWaalsContact C-N 3.3Å; E558-F560 PolarHBondContact O-N 3.02Å; F560-Q563 PolarHBondContact O-N 3.32Å; F560-T564 VanDerWaalsContact O-CB 3.3Å; F560-T564 WeakPolarHBondContact O-CB 3.37Å; F560-T564 PolarHBondContact O-N 2.68Å; F560-T564 PolarHBondContact O-OG1 3.04Å
561	E	78	Confident	66.1	Low	113 Å²	113	59.7 Å²	59.7	53%	0.528	32%	0.315	S	S	.	.	H	α-helix	trans	-64.5	-43.8	176.8	-171.6	171.6	-167	0	0	111.2	G557 E558 Q563 T564 Q565	G557-E561 WeakPolarHBondContact O-CB 3.29Å; G557-E561 PolarHBondContact O-N 2.86Å; E558-E561 PolarHBondContact O-N 2.6Å; E561-Q563 PolarHBondContact O-N 2.67Å; E561-T564 PolarHBondContact O-N 2.77Å; E561-Q565 WeakPolarHBondContact O-CB 3.33Å; E561-Q565 WeakPolarHBondContact O-CG 3.3Å; E561-Q565 PolarHBondContact O-N 2.91Å
562	V	72.6	Confident	65	Low	50 Å²	50	58.3 Å²	58.3	30%	0.303	32%	0.321	S	S	.	.	H	α-helix	trans	-61.7	-44.6	174.1	174.9	0	0	0	0	111	E558 T564 Q565 I566 V613	E558-V562 VanDerWaalsContact O-CG2 3.3Å; E558-V562 WeakPolarHBondContact O-CG2 3.44Å; E558-V562 PolarHBondContact O-N 2.97Å; V562-T564 VanDerWaalsContact C-N 3.32Å; V562-T564 PolarHBondContact O-N 3.42Å; V562-Q565 PolarHBondContact O-N 3.18Å; V562-I566 HydrophobicContact CG1-CD1 3.83Å; V562-I566 HydrophobicContact CG1-CG1 4.45Å; V562-I566 WeakPolarHBondContact O-CB 3.3Å; V562-I566 WeakPolarHBondContact O-CD1 3.45Å; V562-I566 WeakPolarHBondContact O-CG1 3.16Å; V562-I566 PolarHBondContact O-N 3.38Å; V562-V613 HydrophobicContact CB-CG2 4.2Å; V562-V613 HydrophobicContact CG1-CB 4.4Å; V562-V613 HydrophobicContact CG1-CG2 3.58Å
563	Q	69.4	Low	63.4	Low	77 Å²	77	64.6 Å²	64.6	36%	0.36	35%	0.354	S	S	.	.	H	α-helix	trans	-60.4	-43.7	175.7	-172.7	-173.4	37.4	0	0	111.3	L555 C559 F560 E561 I566 L567	L555-Q563 HydrophobicContact CD1-CB 4.15Å; L555-Q563 HydrophobicContact CD1-CG 4.45Å; C559-Q563 WeakPolarHBondContact O-CB 3.43Å; C559-Q563 PolarHBondContact O-N 3.26Å; F560-Q563 PolarHBondContact O-N 3.32Å; E561-Q563 PolarHBondContact O-N 2.67Å; Q563-I566 WeakPolarHBondContact O-CB 3.38Å; Q563-I566 PolarHBondContact O-N 2.9Å; Q563-L567 HydrophobicContact CG-CD1 3.85Å; Q563-L567 WeakPolarHBondContact O-CD1 3.31Å; Q563-L567 PolarHBondContact O-N 2.99Å
564	T	68.8	Low	61.7	Low	40 Å²	40	65.2 Å²	65.2	25%	0.245	36%	0.362	C	S	.	.	H	α-helix	trans	-64.5	-46.3	179.8	-58.8	0	0	0	0	111.1	F560 E561 V562 I566 L567 E568	F560-T564 VanDerWaalsContact O-CB 3.3Å; F560-T564 WeakPolarHBondContact O-CB 3.37Å; F560-T564 PolarHBondContact O-N 2.68Å; F560-T564 PolarHBondContact O-OG1 3.04Å; E561-T564 PolarHBondContact O-N 2.77Å; V562-T564 VanDerWaalsContact C-N 3.32Å; V562-T564 PolarHBondContact O-N 3.42Å; T564-I566 VanDerWaalsContact C-N 3.33Å; T564-I566 PolarHBondContact O-N 3.37Å; T564-L567 CarbonylContact O-C 3.58Å; T564-L567 WeakPolarHBondContact O-CB 3.42Å; T564-L567 PolarHBondContact O-N 3.22Å; T564-L567 VanDerWaalsContact O-N 3.14Å; T564-E568 HydrophobicContact CG2-CG 4.27Å; T564-E568 WeakPolarHBondContact O-CB 3.2Å; T564-E568 WeakPolarHBondContact O-CG 3.43Å; T564-E568 PolarHBondContact O-N 3.48Å
565	Q	66.5	Low	59.6	Low	108 Å²	108	65.3 Å²	65.3	51%	0.505	38%	0.38	S	S	.	.	H	α-helix	trans	-61.4	-40.1	175.5	-73.4	176.5	11.6	0	0	112	E561 V562 E568 S569	E561-Q565 WeakPolarHBondContact O-CB 3.33Å; E561-Q565 WeakPolarHBondContact O-CG 3.3Å; E561-Q565 PolarHBondContact O-N 2.91Å; V562-Q565 PolarHBondContact O-N 3.18Å; Q565-E568 PolarHBondContact O-N 3.23Å; Q565-S569 VanDerWaalsContact O-CB 3.28Å; Q565-S569 WeakPolarHBondContact O-CB 3.27Å; Q565-S569 PolarHBondContact O-N 3.36Å; Q565-S569 PolarHBondContact O-OG 2.93Å
566	I	63.5	Low	57.7	Low	69 Å²	69	71.6 Å²	71.6	35%	0.354	42%	0.419	S	S	.	.	H	α-helix	trans	-58.6	-50.5	172.9	-72.1	167.6	0	0	0	109.3	V562 Q563 T564 E568 S569 F570	V562-I566 HydrophobicContact CG1-CD1 3.83Å; V562-I566 HydrophobicContact CG1-CG1 4.45Å; V562-I566 WeakPolarHBondContact O-CB 3.3Å; V562-I566 WeakPolarHBondContact O-CD1 3.45Å; V562-I566 WeakPolarHBondContact O-CG1 3.16Å; V562-I566 PolarHBondContact O-N 3.38Å; Q563-I566 WeakPolarHBondContact O-CB 3.38Å; Q563-I566 PolarHBondContact O-N 2.9Å; T564-I566 VanDerWaalsContact C-N 3.33Å; T564-I566 PolarHBondContact O-N 3.37Å; I566-E568 PolarHBondContact O-N 3.29Å; I566-S569 PolarHBondContact O-N 3.02Å; I566-S569 PolarHBondContact O-OG 3.05Å; I566-F570 HydrophobicContact CG2-CD2 4.44Å; I566-F570 HydrophobicContact CG2-CE2 3.58Å; I566-F570 HydrophobicContact CG2-CZ 4.35Å; I566-F570 WeakPolarHBondContact O-CD2 3.31Å; I566-F570 WeakPolarHBondContact O-CE2 3.44Å
567	L	49.7	Very low	54.9	Low	79 Å²	79	83.5 Å²	83.5	41%	0.414	46%	0.464	S	S	.	.	H	α-helix	trans	-61.1	-42.8	177.4	-93.5	125.6	0	0	0	113.4	Q563 T564 F570	Q563-L567 HydrophobicContact CG-CD1 3.85Å; Q563-L567 WeakPolarHBondContact O-CD1 3.31Å; Q563-L567 PolarHBondContact O-N 2.99Å; T564-L567 CarbonylContact O-C 3.58Å; T564-L567 WeakPolarHBondContact O-CB 3.42Å; T564-L567 PolarHBondContact O-N 3.22Å; T564-L567 VanDerWaalsContact O-N 3.14Å; L567-F570 PolarHBondContact O-N 2.97Å
568	E	50.5	Low	52.5	Low	110 Å²	110	86.2 Å²	86.2	51%	0.514	48%	0.475	S	S	.	.	H	α-helix	trans	-68.4	-37.9	-179.3	-74.6	179.7	169.2	0	0	112.1	T564 Q565 I566 F570 T571 A572	T564-E568 HydrophobicContact CG2-CG 4.27Å; T564-E568 WeakPolarHBondContact O-CB 3.2Å; T564-E568 WeakPolarHBondContact O-CG 3.43Å; T564-E568 PolarHBondContact O-N 3.48Å; Q565-E568 PolarHBondContact O-N 3.23Å; I566-E568 PolarHBondContact O-N 3.29Å; E568-F570 PolarHBondContact O-N 3.41Å; E568-F570 VanDerWaalsContact O-N 3.15Å; E568-T571 PolarHBondContact O-N 3.31Å; E568-T571 PolarHBondContact O-OG1 3.23Å; E568-A572 PolarHBondContact O-N 3.44Å; E568-A572 VanDerWaalsContact O-N 3.1Å
569	S	45.9	Very low	50.3	Low	67 Å²	67	87.9 Å²	87.9	47%	0.469	49%	0.494	S	S	.	.	H	α-helix	trans	-59.6	-27	178.7	74.9	0	0	0	0	113.4	Q565 I566	Q565-S569 VanDerWaalsContact O-CB 3.28Å; Q565-S569 WeakPolarHBondContact O-CB 3.27Å; Q565-S569 PolarHBondContact O-N 3.36Å; Q565-S569 PolarHBondContact O-OG 2.93Å; I566-S569 PolarHBondContact O-N 3.02Å; I566-S569 PolarHBondContact O-OG 3.05Å
570	F	37.8	Very low	48.1	Very low	45 Å²	45	94 Å²	94	20%	0.197	53%	0.53	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-17.9	175.8	-62.6	-64.4	0	0	0	114.1	A48 L50 K148 I566 L567 E568	A48-F570 HydrophobicContact CB-CE1 3.93Å; A48-F570 HydrophobicContact CB-CZ 3.7Å; L50-F570 HydrophobicContact CD2-CB 4.41Å; L50-F570 HydrophobicContact CD2-CD1 3.86Å; L50-F570 HydrophobicContact CD2-CG 4.37Å; K148-F570 PolarHBondContact NZ-O 3.42Å; K148-F570 VanDerWaalsContact NZ-O 3.15Å; I566-F570 HydrophobicContact CG2-CD2 4.44Å; I566-F570 HydrophobicContact CG2-CE2 3.58Å; I566-F570 HydrophobicContact CG2-CZ 4.35Å; I566-F570 WeakPolarHBondContact O-CD2 3.31Å; I566-F570 WeakPolarHBondContact O-CE2 3.44Å; L567-F570 PolarHBondContact O-N 2.97Å; E568-F570 PolarHBondContact O-N 3.41Å; E568-F570 VanDerWaalsContact O-N 3.15Å
571	T	40.4	Very low	45.8	Very low	63 Å²	63	100.7 Å²	100.7	39%	0.387	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100	-28.8	-176.5	64.3	0	0	0	0	113.4	E568 N573 S574	E568-T571 PolarHBondContact O-N 3.31Å; E568-T571 PolarHBondContact O-OG1 3.23Å; T571-N573 VanDerWaalsContact C-N 3.29Å; T571-N573 PolarHBondContact O-N 2.94Å; T571-S574 PolarHBondContact O-N 3.18Å; T571-S574 PolarHBondContact O-OG 3.06Å
572	A	37.3	Very low	43.4	Very low	76 Å²	76	102.9 Å²	102.9	63%	0.628	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-19.7	-179.1	0	0	0	0	0	114.5	E568 S574	E568-A572 PolarHBondContact O-N 3.44Å; E568-A572 VanDerWaalsContact O-N 3.1Å; A572-S574 PolarHBondContact O-N 3.47Å; A572-S574 VanDerWaalsContact O-N 3.12Å
573	N	35.7	Very low	41.4	Very low	154 Å²	154	109.4 Å²	109.4	82%	0.824	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	15.7	177.3	-91.3	9.4	0	0	0	114.8	T571	T571-N573 VanDerWaalsContact C-N 3.29Å; T571-N573 PolarHBondContact O-N 2.94Å
574	S	31	Very low	39.5	Very low	60 Å²	60	111.5 Å²	111.5	42%	0.42	62%	0.622	S	S	.	*	S	Bend	trans	-134.8	68.8	179.6	23.2	0	0	0	0	109.9	K148 T571 A572	K148-S574 PolarHBondContact NZ-OG 3.47Å; T571-S574 PolarHBondContact O-N 3.18Å; T571-S574 PolarHBondContact O-OG 3.06Å; A572-S574 PolarHBondContact O-N 3.47Å; A572-S574 VanDerWaalsContact O-N 3.12Å
575	G	30.1	Very low	37.6	Very low	62 Å²	62	116.5 Å²	116.5	64%	0.639	64%	0.642	S	S	*	*	S	Bend	trans	-170.1	110.6	178	0	0	0	0	0	111	R577	G575-R577 PolarHBondContact O-N 3.32Å
576	T	32.4	Very low	35.9	Very low	146 Å²	146	120.1 Å²	120.1	90%	0.896	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-49.2	123.1	177.2	40.8	0	0	0	0	113.3	S578	T576-S578 PolarHBondContact O-N 3.29Å
577	R	27.6	Very low	34.3	Very low	252 Å²	252	120 Å²	120	95%	0.951	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-59	116.2	164.4	-93	176.2	164	171.1	-4.7	110	G575	G575-R577 PolarHBondContact O-N 3.32Å
578	S	28.7	Very low	33.4	Very low	103 Å²	103	124.6 Å²	124.6	72%	0.72	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-73.1	135.7	162.8	173.7	0	0	0	0	109.9	T576	T576-S578 PolarHBondContact O-N 3.29Å
579	P	33.6	Very low	32.4	Very low	121 Å²	121	127.6 Å²	127.6	79%	0.786	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-81.5	123.3	174.7	31	-28.1	0	0	0	110.3
580	V	30.2	Very low	31.8	Very low	132 Å²	132	128.3 Å²	128.3	80%	0.8	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-79.5	124.7	167.8	172.6	0	0	0	0	108.3	L582	V580-L582 PolarHBondContact O-N 3.25Å
581	Q	32.3	Very low	31.4	Very low	188 Å²	188	132.5 Å²	132.5	88%	0.879	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-63.2	123.6	168.1	-96	167.7	-62.7	0	0	110
582	L	28	Very low	31.1	Very low	158 Å²	158	135.4 Å²	135.4	83%	0.827	76%	0.755	S	S	*	*			trans	-97.3	111.3	170	-110.2	146.6	0	0	0	107.7	V580	V580-L582 PolarHBondContact O-N 3.25Å
583	E	31	Very low	30.8	Very low	188 Å²	188	137.6 Å²	137.6	88%	0.879	76%	0.756	S	S	*	*			trans	-99.3	131	158	-81.2	-173.7	156.4	0	0	109
584	V	28	Very low	30.7	Very low	120 Å²	120	136.7 Å²	136.7	73%	0.727	76%	0.756	S	S	*	*			trans	-95.1	131.9	178.8	171.4	0	0	0	0	107.4
585	E	30.7	Very low	30.7	Very low	145 Å²	145	137.6 Å²	137.6	68%	0.678	77%	0.767	S	S	*	*				-179.7	118.5	123.3	-96.4	-167.6	141.2	0	0	114.2
586	K	29.9	Very low	30.6	Very low	185 Å²	185	141.7 Å²	141.7	80%	0.804	77%	0.774	S	S	*	*			trans	54	130.5	131.1	-66.8	171.7	-177.2	153.2	0	122.1
587	G	30.7	Very low	30.6	Very low	65 Å²	65	144 Å²	144	67%	0.67	78%	0.775	S	S	*	*			trans	137.3	82.2	143.1	0	0	0	0	0	114.5
588	Q	30.7	Very low	30.5	Very low	176 Å²	176	136.7 Å²	136.7	82%	0.822	76%	0.762	S	S	*	*				80.4	108.1	111.1	-78.2	-179.8	-33.3	0	0	115.5
589	M	29.1	Very low	30.5	Very low	174 Å²	174	138.6 Å²	138.6	86%	0.857	77%	0.769	S	S	*	*				86.5	112.2	104.7	-76.5	-158	166.7	0	0	111.9
590	A	32.8	Very low	30.1	Very low	82 Å²	82	137.9 Å²	137.9	68%	0.678	77%	0.766	S	S	*	*				134.9	152.6	78.1	0	0	0	0	0	103.4
591	N	30.4	Very low	29.9	Very low	133 Å²	133	138.9 Å²	138.9	71%	0.711	77%	0.766	S	S	*	*			cis	-178	156.9	9.6	-116.7	2.7	0	0	0	105.7
592	N	33.3	Very low	29.8	Very low	123 Å²	123	137.3 Å²	137.3	66%	0.658	76%	0.764	S	S	*	*			trans	74.8	144.1	142.2	-61.6	10.4	0	0	0	118.3
593	D	30.5	Very low	29.8	Very low	123 Å²	123	134.9 Å²	134.9	66%	0.658	76%	0.76	S	S	*	*			cis	177.7	153.7	-7	-107.7	-32.6	0	0	0	107.5
594	V	33.2	Very low	29.7	Very low	134 Å²	134	133.6 Å²	133.6	81%	0.812	76%	0.759	S	S	*	*			trans	71.4	142.6	139.6	171.5	0	0	0	0	117.4
595	A	31.7	Very low	29.6	Very low	79 Å²	79	133.1 Å²	133.1	65%	0.653	76%	0.759	S	S	*	*			cis	-172.8	134.8	-12.4	0	0	0	0	0	104.5
596	D	27.2	Very low	29.5	Very low	149 Å²	149	133.7 Å²	133.7	80%	0.797	77%	0.767	S	S	*	*				62.5	108.9	101.3	-142.9	14.3	0	0	0	115.2
597	Q	32.5	Very low	29.3	Very low	193 Å²	193	133.1 Å²	133.1	90%	0.902	77%	0.766	S	S	*	*			trans	-172.6	121.9	135.3	-104	167.1	42.2	0	0	113
598	S	25.2	Very low	29.3	Very low	99 Å²	99	136.6 Å²	136.6	69%	0.692	78%	0.775	S	S	*	*			trans	-70.6	159.5	167.5	49.4	0	0	0	0	112.6
599	V	29.2	Very low	29.5	Very low	143 Å²	143	135.2 Å²	135.2	87%	0.867	77%	0.768	S	S	*	*			trans	-178.7	148.1	130.8	154.7	0	0	0	0	108.6
600	C	25.2	Very low	30.1	Very low	106 Å²	106	131.4 Å²	131.4	72%	0.716	76%	0.759	S	S	*	*			trans	-96.8	179.4	-156.1	-51.3	0	0	0	0	114.8
601	L	26.6	Very low	30.3	Very low	154 Å²	154	129.2 Å²	129.2	81%	0.806	74%	0.738	S	S	*	*			trans	92.4	101.6	150.7	-61.8	159	0	0	0	117.2
602	N	30.7	Very low	30.6	Very low	154 Å²	154	127.9 Å²	127.9	82%	0.824	74%	0.735	S	S	*	*				-170.2	143.1	96.3	-96.4	-21	0	0	0	113.2
603	S	26.6	Very low	30.7	Very low	107 Å²	107	124.8 Å²	124.8	75%	0.748	72%	0.72	S	S	*	*			trans	-58.2	140.7	-177.1	41.9	0	0	0	0	116.2
604	N	28.5	Very low	30.8	Very low	161 Å²	161	122 Å²	122	86%	0.861	72%	0.715	S	S	*	*			trans	-151.6	138.7	139.6	-118.4	-10.4	0	0	0	110.5
605	P	26.8	Very low	30.6	Very low	111 Å²	111	123 Å²	123	72%	0.721	72%	0.715	S	S	*	*			trans	-88.3	119.4	-173.4	34	-28.3	0	0	0	110
606	N	28.5	Very low	30.5	Very low	157 Å²	157	121.6 Å²	121.6	84%	0.84	70%	0.701	S	S	*	*			trans	-154	96.3	153.5	-104.7	-11.7	0	0	0	107.4	T608	N606-T608 PolarHBondContact O-N 3.31Å; N606-T608 VanDerWaalsContact O-N 3.1Å
607	E	26	Very low	30.6	Very low	172 Å²	172	124 Å²	124	80%	0.804	70%	0.704	S	S	*	*			trans	-59.2	108	176.2	-70.9	177.7	141.1	0	0	110.2	H609	E607-H609 PolarHBondContact O-N 3.38Å; E607-H609 IonicContact OE2-NE2 3.03Å
608	T	29.9	Very low	30.3	Very low	139 Å²	139	118.9 Å²	118.9	85%	0.853	68%	0.679	S	S	*	*			trans	-79.2	94.8	168.3	45.1	0	0	0	0	109.1	N606 S610	N606-T608 PolarHBondContact O-N 3.31Å; N606-T608 VanDerWaalsContact O-N 3.1Å; T608-S610 PolarHBondContact O-N 2.52Å
609	H	34.6	Very low	30.5	Very low	146 Å²	146	122 Å²	122	68%	0.676	68%	0.677	S	S	*	*			trans	-70.9	118	171.8	-73.5	-78.3	0	0	0	110.8	E607	E607-H609 PolarHBondContact O-N 3.38Å; E607-H609 IonicContact OE2-NE2 3.03Å
610	S	42	Very low	30.3	Very low	95 Å²	95	121.4 Å²	121.4	66%	0.664	67%	0.673	S	S	*	*			trans	-61.2	133.7	171	60.5	0	0	0	0	110.7	T608 T612	T608-S610 PolarHBondContact O-N 2.52Å; S610-T612 PolarHBondContact O-N 3.08Å
611	C	36.9	Very low	30.3	Very low	36 Å²	36	121.2 Å²	121.2	24%	0.243	67%	0.673	C	S	.	*			trans	-66.8	106.3	175.5	-82	0	0	0	0	110.7	C544	C544-C611 VanDerWaalsContact SG-SG 3.67Å
612	T	36.6	Very low	30.2	Very low	105 Å²	105	122.5 Å²	122.5	64%	0.644	68%	0.677	S	S	*	*			trans	-83.3	116.7	166.3	34.5	0	0	0	0	109.2	S610 A614	S610-T612 PolarHBondContact O-N 3.08Å; T612-A614 VanDerWaalsContact C-N 3.33Å; T612-A614 PolarHBondContact O-N 3.13Å
613	V	35.7	Very low	30	Very low	57 Å²	57	122.3 Å²	122.3	35%	0.345	67%	0.674	S	S	.	*			trans	-71.1	95.4	165.5	179.1	0	0	0	0	106.8	V562 N615	V562-V613 HydrophobicContact CB-CG2 4.2Å; V562-V613 HydrophobicContact CG1-CB 4.4Å; V562-V613 HydrophobicContact CG1-CG2 3.58Å; V613-N615 PolarHBondContact O-N 2.91Å
614	A	32.5	Very low	30	Very low	66 Å²	66	121.5 Å²	121.5	55%	0.545	67%	0.674	S	S	.	*			trans	-59.9	128.5	165.8	0	0	0	0	0	107.5	T612 S616	T612-A614 VanDerWaalsContact C-N 3.33Å; T612-A614 PolarHBondContact O-N 3.13Å; A614-S616 WeakPolarHBondContact O-CA 3.2Å; A614-S616 PolarHBondContact O-N 2.99Å
615	N	30.3	Very low	29.9	Very low	154 Å²	154	119 Å²	119	82%	0.824	67%	0.667	S	S	*	*			trans	-32.2	101.7	174.8	-75	-33.7	0	0	0	110.7	V613 K617	V613-N615 PolarHBondContact O-N 2.91Å; N615-K617 VanDerWaalsContact C-N 3.32Å; N615-K617 PolarHBondContact O-N 3.32Å
616	S	28.4	Very low	30.1	Very low	50 Å²	50	119.9 Å²	119.9	35%	0.35	67%	0.673	S	S	.	*			trans	-71.9	87	-160.9	149.6	0	0	0	0	109.9	A614 F618	A614-S616 WeakPolarHBondContact O-CA 3.2Å; A614-S616 PolarHBondContact O-N 2.99Å; S616-F618 PolarHBondContact O-N 3.21Å; S616-F618 WeakPolarHBondContact OG-CD2 3.33Å; S616-F618 WeakPolarHBondContact OG-CE2 3.39Å; S616-F618 WeakPolarHBondContact OG-CG 3.36Å
617	K	29.2	Very low	30.1	Very low	200 Å²	200	119.9 Å²	119.9	87%	0.87	67%	0.671	S	S	*	*			trans	-67.7	74.4	152.2	-71.2	179.9	177	179	0	107.8	N615	N615-K617 VanDerWaalsContact C-N 3.32Å; N615-K617 PolarHBondContact O-N 3.32Å
618	F	27	Very low	30.3	Very low	85 Å²	85	116 Å²	116	37%	0.373	67%	0.669	S	S	.	*			trans	-114.9	114.9	173.7	-72.7	-128.2	0	0	0	103.7	N541 S616	N541-F618 HydrophobicContact CB-CZ 4.32Å; N541-F618 WeakPolarHBondContact OD1-CZ 3.48Å; S616-F618 PolarHBondContact O-N 3.21Å; S616-F618 WeakPolarHBondContact OG-CD2 3.33Å; S616-F618 WeakPolarHBondContact OG-CE2 3.39Å; S616-F618 WeakPolarHBondContact OG-CG 3.36Å
619	Y	29.4	Very low	30.2	Very low	165 Å²	165	115 Å²	115	65%	0.647	67%	0.666	S	S	*	*	S	Bend	cis	-116.3	155	26.8	-78.9	-128.7	0	0	0	113.8	E55 S621	E55-Y619 HydrophobicContact CB-CE2 4.26Å; E55-Y619 HydrophobicContact CG-CD2 4.16Å; E55-Y619 HydrophobicContact CG-CE2 4.11Å; E55-Y619 VanDerWaalsContact OE1-CB 3.23Å; E55-Y619 WeakPolarHBondContact OE1-CB 3.35Å; E55-Y619 WeakPolarHBondContact OE1-CD1 3.27Å; E55-Y619 WeakPolarHBondContact OE1-CD2 3.48Å; E55-Y619 WeakPolarHBondContact OE2-CD2 3.44Å; E55-Y619 WeakPolarHBondContact OE2-CE2 3.39Å; Y619-S621 PolarHBondContact O-N 2.84Å
620	V	25.5	Very low	29.8	Very low	130 Å²	130	116.4 Å²	116.4	79%	0.788	68%	0.677	S	S	*	*			trans	-69.4	123.8	174.6	170.7	0	0	0	0	110.6	M622	V620-M622 PolarHBondContact O-N 2.96Å
621	S	23.8	Very low	29.4	Very low	102 Å²	102	117.1 Å²	117.1	71%	0.713	68%	0.683	S	S	*	*			trans	-28.8	114.8	158.1	166.3	0	0	0	0	114.1	Y619	Y619-S621 PolarHBondContact O-N 2.84Å
622	M	24.5	Very low	29	Very low	180 Å²	180	118.8 Å²	118.8	89%	0.887	71%	0.705	S	S	*	*			trans	-114.2	71.1	162	-69.9	-135.5	-61.7	0	0	110.9	V620	V620-M622 PolarHBondContact O-N 2.96Å
623	I	27.2	Very low	28.7	Very low	150 Å²	150	120.3 Å²	120.3	77%	0.769	72%	0.715	S	S	*	*			trans	-139.4	105.8	150.5	-55.7	-179.4	0	0	0	107
624	A	26.8	Very low	28.4	Very low	90 Å²	90	121.9 Å²	121.9	74%	0.744	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-69.9	136.7	166.9	0	0	0	0	0	109.2
625	P	26.3	Very low	28.4	Very low	110 Å²	110	124 Å²	124	71%	0.714	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-75.5	151.7	171.3	32.4	-31	0	0	0	109.5	I627	P625-I627 PolarHBondContact O-N 2.92Å
626	P	31.2	Very low	28.4	Very low	128 Å²	128	123.6 Å²	123.6	83%	0.831	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-67.3	127.7	174.9	28.3	-30.8	0	0	0	109.3	A628	P626-A628 PolarHBondContact O-N 3.32Å
627	I	29.2	Very low	28.7	Very low	157 Å²	157	128.1 Å²	128.1	81%	0.805	76%	0.763	S	S	*	*			trans	-67.4	108.9	172.1	-62.9	170.3	0	0	0	107.8	P625	P625-I627 PolarHBondContact O-N 2.92Å
628	A	29.6	Very low	28.7	Very low	92 Å²	92	123.1 Å²	123.1	76%	0.76	76%	0.758	S	S	*	*			trans	-92.3	108.1	162.9	0	0	0	0	0	108.6	P626 L630	P626-A628 PolarHBondContact O-N 3.32Å; A628-L630 PolarHBondContact O-N 2.91Å
629	C	28.2	Very low	28.8	Very low	116 Å²	116	124.7 Å²	124.7	78%	0.784	78%	0.779	S	S	*	*			trans	-65.3	123.4	172	-67.9	0	0	0	0	110.7
630	L	25.9	Very low	29	Very low	176 Å²	176	121.4 Å²	121.4	92%	0.921	78%	0.778	S	S	*	*			trans	-80.5	123.4	165.3	-84.9	149.6	0	0	0	109.9	A628	A628-L630 PolarHBondContact O-N 2.91Å
631	S	34	Very low	29.1	Very low	111 Å²	111	120.8 Å²	120.8	78%	0.776	77%	0.774	S	S	*	*			trans	-160.1	112.7	152.2	55.3	0	0	0	0	111.8
632	G	28.1	Very low	29.4	Very low	70 Å²	70	123.9 Å²	123.9	72%	0.722	78%	0.783	S	S	*	*			trans	59.5	144.1	147.7	0	0	0	0	0	119
633	T	29.1	Very low	29.4	Very low	138 Å²	138	126.9 Å²	126.9	85%	0.847	78%	0.784	S	S	*	*			cis	-175.4	137.6	8.9	23.4	0	0	0	0	106.5
634	A	29.3	Very low	29.4	Very low	89 Å²	89	125.3 Å²	125.3	74%	0.736	79%	0.787	S	S	*	*			trans	65.1	133.2	140.2	0	0	0	0	0	123.6
635	S	33.6	Very low	29.4	Very low	110 Å²	110	127.4 Å²	127.4	77%	0.769	79%	0.791	S	S	*	*			trans	80.2	143	145.9	74.5	0	0	0	0	118.1
636	N	30.3	Very low	29.7	Very low	147 Å²	147	130 Å²	130	79%	0.786	80%	0.799	S	S	*	*			cis	-170.5	170.1	-25.8	-116.6	-2.4	0	0	0	105
637	D	34	Very low	29.6	Very low	145 Å²	145	133.6 Å²	133.6	78%	0.775	80%	0.801	S	S	*	*			trans	95.3	100.8	169	-52.7	-25.1	0	0	0	115.1
638	A	30	Very low	29.6	Very low	94 Å²	94	135.1 Å²	135.1	78%	0.777	81%	0.805	S	S	*	*				64.9	127.3	68	0	0	0	0	0	111.1
639	C	28.7	Very low	29.5	Very low	118 Å²	118	138 Å²	138	80%	0.797	81%	0.808	S	S	*	*			cis	-171.3	-165.2	18.6	-148.5	0	0	0	0	106.9
640	P	33.3	Very low	29.5	Very low	97 Å²	97	139 Å²	139	63%	0.63	81%	0.809	S	S	*	*				-129.6	175.9	-96.4	42.5	-25.7	0	0	0	116.6
641	T	27.4	Very low	29.6	Very low	117 Å²	117	135.3 Å²	135.3	72%	0.718	80%	0.798	S	S	*	*			trans	59	116.6	146.5	49.6	0	0	0	0	120.9
642	N	30	Very low	29.4	Very low	166 Å²	166	134.9 Å²	134.9	89%	0.888	80%	0.795	S	S	*	*				-151.5	134.4	120.8	-124.1	-20.4	0	0	0	112.5
643	W	24.8	Very low	29.4	Very low	243 Å²	243	137.4 Å²	137.4	92%	0.92	80%	0.802	S	S	*	*			trans	-74	136.6	-179.3	-74.3	-37.2	0	0	0	112.1
644	S	28.8	Very low	29.3	Very low	118 Å²	118	135.5 Å²	135.5	83%	0.825	79%	0.793	S	S	*	*			trans	-159.8	119.5	136.1	23	0	0	0	0	110.7
645	T	26.6	Very low	29.1	Very low	134 Å²	134	138.5 Å²	138.5	82%	0.822	80%	0.796	S	S	*	*			trans	-39.8	122.8	169.7	41.4	0	0	0	0	114.7
646	N	30.8	Very low	28.6	Very low	165 Å²	165	138.5 Å²	138.5	88%	0.882	79%	0.792	S	S	*	*			trans	-142.4	124.3	146.1	-94.4	-32.3	0	0	0	109.5
647	K	29.7	Very low	28.5	Very low	203 Å²	203	136.8 Å²	136.8	88%	0.883	79%	0.786	S	S	*	*			trans	-65.9	134.8	-175.2	-77.4	173.5	172.3	171	0	110.8	D649	K647-D649 PolarHBondContact O-N 3.48Å
648	E	28.9	Very low	28.1	Very low	188 Å²	188	134.9 Å²	134.9	88%	0.879	78%	0.78	S	S	*	*			trans	-71.3	116.9	167.7	-68.5	177.6	141.9	0	0	110.1	V650	E648-V650 PolarHBondContact O-N 3.38Å
649	D	28.4	Very low	27.9	Very low	154 Å²	154	139.5 Å²	139.5	82%	0.824	78%	0.777	S	S	*	*			trans	-78.2	98.2	168.9	-88.2	-28.8	0	0	0	110	K647 S651	K647-D649 PolarHBondContact O-N 3.48Å; D649-S651 PolarHBondContact O-N 3.05Å
650	V	27.3	Very low	27.8	Very low	135 Å²	135	142.5 Å²	142.5	82%	0.818	78%	0.777	S	S	*	*			trans	-77	101.2	158.8	179.3	0	0	0	0	107.1	E648	E648-V650 PolarHBondContact O-N 3.38Å
651	S	29.3	Very low	27.6	Very low	99 Å²	99	142.9 Å²	142.9	69%	0.692	77%	0.774	S	S	*	*			trans	-108.8	95.5	177.1	-164.8	0	0	0	0	110.6	D649	D649-S651 PolarHBondContact O-N 3.05Å
652	S	29.4	Very low	27.7	Very low	102 Å²	102	143.5 Å²	143.5	71%	0.713	78%	0.777	S	S	*	*			trans	-75.5	117.7	161.9	44	0	0	0	0	109.3	C654	S652-C654 VanDerWaalsContact C-N 3.33Å; S652-C654 PolarHBondContact O-N 3.24Å
653	S	28.9	Very low	27.8	Very low	123 Å²	123	140.2 Å²	140.2	86%	0.86	76%	0.763	S	S	*	*			trans	-74.2	86.1	170	43.6	0	0	0	0	109.9	L655	S653-L655 PolarHBondContact O-N 3.18Å
654	C	26.2	Very low	28.3	Very low	99 Å²	99	137.3 Å²	137.3	67%	0.669	76%	0.756	S	S	*	*			trans	-76.3	111.2	167.3	178.4	0	0	0	0	109.3	S652 T656	S652-C654 VanDerWaalsContact C-N 3.33Å; S652-C654 PolarHBondContact O-N 3.24Å; C654-T656 PolarHBondContact O-N 3.45Å
655	L	25	Very low	28.8	Very low	152 Å²	152	138.8 Å²	138.8	80%	0.796	75%	0.75	S	S	*	*			trans	-79	95.4	166.3	-164.4	93.4	0	0	0	108.1	S653 V657	S653-L655 PolarHBondContact O-N 3.18Å; L655-V657 HydrophobicContact CD2-CG2 3.88Å; L655-V657 PolarHBondContact O-N 3.34Å; L655-V657 VanDerWaalsContact O-N 3.13Å
656	T	23.9	Very low	29.6	Very low	110 Å²	110	140.7 Å²	140.7	68%	0.675	75%	0.75	S	S	*	*			trans	-77.7	95.5	173.1	-50.7	0	0	0	0	109.1	C654 V658	C654-T656 PolarHBondContact O-N 3.45Å; T656-V658 HydrophobicContact CG2-CG2 4.38Å; T656-V658 PolarHBondContact O-N 2.94Å
657	V	27	Very low	30	Very low	110 Å²	110	140.2 Å²	140.2	67%	0.667	74%	0.742	S	S	*	*			trans	-73.7	106.2	165.6	179.6	0	0	0	0	107.6	L655 R659	L655-V657 HydrophobicContact CD2-CG2 3.88Å; L655-V657 PolarHBondContact O-N 3.34Å; L655-V657 VanDerWaalsContact O-N 3.13Å; V657-R659 PolarHBondContact O-N 2.79Å; V657-R659 VanDerWaalsContact O-N 3.15Å
658	V	25.7	Very low	30.5	Very low	105 Å²	105	134.1 Å²	134.1	64%	0.636	73%	0.73	S	S	*	*			trans	-75.2	101.5	167.8	-177	0	0	0	0	107.1	T656 F660	T656-V658 HydrophobicContact CG2-CG2 4.38Å; T656-V658 PolarHBondContact O-N 2.94Å; V658-F660 HydrophobicContact CG1-CD2 4.26Å; V658-F660 HydrophobicContact CG1-CE2 3.76Å; V658-F660 HydrophobicContact CG1-CZ 3.91Å
659	R	25.5	Very low	31.1	Very low	192 Å²	192	128 Å²	128	73%	0.725	71%	0.711	S	S	*	*			trans	-91.6	112.6	174.6	-158.3	178	179.6	138	3.5	108.1	V657 D661	V657-R659 PolarHBondContact O-N 2.79Å; V657-R659 VanDerWaalsContact O-N 3.15Å; R659-D661 VanDerWaalsContact C-N 3.35Å; R659-D661 WeakPolarHBondContact CD-OD1 3.36Å; R659-D661 WeakPolarHBondContact CD-OD2 3.29Å; R659-D661 WeakPolarHBondContact CG-OD1 3.33Å; R659-D661 IonicContact NE-OD1 3.82Å; R659-D661 PolarHBondContact NE-OD1 3.2Å; R659-D661 IonicContact NE-OD2 2.69Å; R659-D661 PolarHBondContact O-N 3.12Å
660	F	28.2	Very low	31.8	Very low	181 Å²	181	126.7 Å²	126.7	79%	0.794	70%	0.704	S	S	*	*			trans	-82.9	85.7	165.6	-65.6	-84.4	0	0	0	107.6	V658 V662	V658-F660 HydrophobicContact CG1-CD2 4.26Å; V658-F660 HydrophobicContact CG1-CE2 3.76Å; V658-F660 HydrophobicContact CG1-CZ 3.91Å; F660-V662 PolarHBondContact O-N 3.24Å
661	D	29	Very low	32.6	Very low	105 Å²	105	127.7 Å²	127.7	56%	0.561	70%	0.701	S	S	*	*			trans	-76.6	104.1	169	-71.6	-41.9	0	0	0	107.9	R659 V663	R659-D661 VanDerWaalsContact C-N 3.35Å; R659-D661 WeakPolarHBondContact CD-OD1 3.36Å; R659-D661 WeakPolarHBondContact CD-OD2 3.29Å; R659-D661 WeakPolarHBondContact CG-OD1 3.33Å; R659-D661 IonicContact NE-OD1 3.82Å; R659-D661 PolarHBondContact NE-OD1 3.2Å; R659-D661 IonicContact NE-OD2 2.69Å; R659-D661 PolarHBondContact O-N 3.12Å; D661-V663 VanDerWaalsContact C-N 3.33Å; D661-V663 PolarHBondContact O-N 3.5Å
662	V	29.5	Very low	33.4	Very low	130 Å²	130	126.6 Å²	126.6	79%	0.788	70%	0.698	S	S	*	*			trans	-71.2	97.2	163.1	178.7	0	0	0	0	106.6	F660 K664	F660-V662 PolarHBondContact O-N 3.24Å; V662-K664 PolarHBondContact O-N 3.33Å
663	V	31.5	Very low	34.2	Very low	97 Å²	97	130.7 Å²	130.7	59%	0.588	70%	0.703	S	S	*	*			trans	-65.6	103.1	178.1	-178.9	0	0	0	0	109	D661 E665	D661-V663 VanDerWaalsContact C-N 3.33Å; D661-V663 PolarHBondContact O-N 3.5Å; V663-E665 HydrophobicContact CG1-CB 3.53Å; V663-E665 HydrophobicContact CG1-CG 3.38Å; V663-E665 WeakPolarHBondContact CG1-OE2 3.48Å; V663-E665 PolarHBondContact O-N 3.23Å; V663-E665 VanDerWaalsContact O-N 3.1Å
664	K	35.7	Very low	35	Very low	181 Å²	181	133 Å²	133	79%	0.787	70%	0.7	S	S	*	*			trans	-79.4	51.1	166.8	-76.2	-169.2	173.9	-172.7	0	111.6	V662	V662-K664 PolarHBondContact O-N 3.33Å
665	E	39.1	Very low	35.8	Very low	150 Å²	150	137.8 Å²	137.8	70%	0.701	71%	0.71	S	S	*	*			trans	-90.3	-5.9	177.7	-78.2	-179.4	158.2	0	0	114.1	V663	V663-E665 HydrophobicContact CG1-CB 3.53Å; V663-E665 HydrophobicContact CG1-CG 3.38Å; V663-E665 WeakPolarHBondContact CG1-OE2 3.48Å; V663-E665 PolarHBondContact O-N 3.23Å; V663-E665 VanDerWaalsContact O-N 3.1Å
666	E	41.9	Very low	36.5	Very low	173 Å²	173	134 Å²	134	81%	0.808	70%	0.701	S	S	*	*	H	α-helix	trans	-83.8	-13.1	-177.9	-79.6	-168.3	141.3	0	0	115.7
667	E	40.5	Very low	37.2	Very low	155 Å²	155	138.9 Å²	138.9	72%	0.724	71%	0.713	S	S	*	*	H	α-helix	trans	-85.5	-27.1	176.4	-88.2	-176.4	137.5	0	0	113.8
668	A	39	Very low	37.6	Very low	76 Å²	76	139.9 Å²	139.9	63%	0.628	72%	0.72	S	S	*	*	H	α-helix	trans	-81.8	-30.6	178.9	0	0	0	0	0	112.8
669	A	42.8	Very low	38.2	Very low	58 Å²	58	142.1 Å²	142.1	48%	0.479	73%	0.727	S	S	.	*	H	α-helix	trans	-76.5	-23.1	178.6	0	0	0	0	0	113.5
670	L	43.3	Very low	39	Very low	127 Å²	127	138.9 Å²	138.9	67%	0.665	72%	0.724	S	S	*	*	H	α-helix	trans	-79.3	-31.3	177.5	-121.4	87.8	0	0	0	113
671	M	44.1	Very low	39.4	Very low	157 Å²	157	136.4 Å²	136.4	77%	0.773	72%	0.719	S	S	*	*	H	α-helix	trans	-80.2	-22.1	177.2	-73.3	-149.2	176.3	0	0	113.7
672	A	45.4	Very low	39.6	Very low	75 Å²	75	138.3 Å²	138.3	62%	0.62	73%	0.729	S	S	*	*	H	α-helix	trans	-81.1	-21.4	178.1	0	0	0	0	0	113.9
673	K	46.9	Very low	39.9	Very low	188 Å²	188	140.7 Å²	140.7	82%	0.817	74%	0.737	S	S	*	*	S	Bend	trans	-91.4	-6.5	-179.2	-80.6	-176.9	175.2	177.3	0	115.4
674	Q	44.9	Very low	39.9	Very low	173 Å²	173	145 Å²	145	81%	0.808	75%	0.75	S	S	*	*	S	Bend	trans	-92.1	0.6	177.3	-81.6	-178.1	-15.8	0	0	114.5
675	K	43	Very low	39.9	Very low	198 Å²	198	143.4 Å²	143.4	86%	0.861	76%	0.755	S	S	*	*	S	Bend	trans	-110.9	8.3	-173.1	-110.5	178.9	179.6	178.6	0	116
676	A	40.4	Very low	39.7	Very low	74 Å²	74	140.2 Å²	140.2	61%	0.612	76%	0.755	S	S	*	*	S	Bend	trans	-143	87	179.6	0	0	0	0	0	109.9
677	F	37.6	Very low	39.1	Very low	212 Å²	212	137.1 Å²	137.1	93%	0.93	75%	0.752	S	S	*	*			trans	-178.1	88.2	149.7	-105.2	-74.8	0	0	0	109.1
678	T	34.6	Very low	38.7	Very low	131 Å²	131	138.1 Å²	138.1	80%	0.804	76%	0.762	S	S	*	*			trans	-134.5	99.6	163.8	45.4	0	0	0	0	107.1
679	L	40.2	Very low	38.4	Very low	152 Å²	152	139.3 Å²	139.3	80%	0.796	77%	0.766	S	S	*	*			trans	175.5	132.3	139.9	-119.9	81.7	0	0	0	110.9
680	D	40.3	Very low	38.1	Very low	124 Å²	124	143.3 Å²	143.3	66%	0.663	79%	0.787	S	S	*	*			trans	69.8	107.7	152	-72.4	-32.3	0	0	0	123.5
681	N	38.2	Very low	37.6	Very low	128 Å²	128	142.4 Å²	142.4	68%	0.684	79%	0.791	S	S	*	*				73.4	110.2	124.7	-62	-21.7	0	0	0	122.4
682	D	32.2	Very low	37.1	Very low	146 Å²	146	139.5 Å²	139.5	78%	0.781	79%	0.792	S	S	*	*				55.6	95.6	128.6	-65	-23.4	0	0	0	120.2
683	L	37	Very low	36.7	Very low	179 Å²	179	147.7 Å²	147.7	94%	0.937	81%	0.807	S	S	*	*				-165.1	133.3	128.4	-106.9	137.5	0	0	0	112	V685	L683-V685 PolarHBondContact O-N 2.94Å
684	Q	30.7	Very low	36.2	Very low	188 Å²	188	150 Å²	150	88%	0.879	81%	0.81	S	S	*	*			trans	-62.2	120.2	-173.2	-65.6	169.4	-5.6	0	0	113.4
685	V	35	Very low	35.8	Very low	147 Å²	147	147.1 Å²	147.1	89%	0.891	81%	0.807	S	S	*	*			trans	-142.5	133.9	150.6	-177.6	0	0	0	0	109.4	L683	L683-V685 PolarHBondContact O-N 2.94Å
686	A	35.5	Very low	35.6	Very low	83 Å²	83	143.4 Å²	143.4	69%	0.686	81%	0.805	S	S	*	*			trans	-62	138	-169	0	0	0	0	0	115.9
687	S	28.5	Very low	35.7	Very low	109 Å²	109	144.3 Å²	144.3	76%	0.762	80%	0.803	S	S	*	*			trans	35.2	101.3	140	65.9	0	0	0	0	119.4
688	L	33.1	Very low	35.9	Very low	175 Å²	175	141.8 Å²	141.8	92%	0.916	79%	0.794	S	S	*	*			trans	-139.3	110.3	146.5	-78.1	172.3	0	0	0	109.7
689	S	32.9	Very low	36.5	Very low	102 Å²	102	139 Å²	139	71%	0.713	77%	0.774	S	S	*	*			trans	-64.8	136.1	173.5	41.8	0	0	0	0	111.6	S691	S689-S691 PolarHBondContact O-N 3.19Å
690	P	36.1	Very low	37	Very low	142 Å²	142	137.4 Å²	137.4	92%	0.922	76%	0.761	S	S	*	*	S	Bend	trans	-79.3	71.8	175.7	32.6	-31.9	0	0	0	109.9
691	S	32	Very low	37.8	Very low	108 Å²	108	136.3 Å²	136.3	76%	0.755	75%	0.748	S	S	*	*			trans	-129.9	70.5	172.7	-166.1	0	0	0	0	109.6	S689	S689-S691 PolarHBondContact O-N 3.19Å
692	A	35.3	Very low	38.8	Very low	96 Å²	96	135.6 Å²	135.6	79%	0.793	74%	0.74	S	S	*	*			trans	-144.9	63.8	166.5	0	0	0	0	0	109	R694	A692-R694 PolarHBondContact O-N 3.34Å
693	R	36.5	Very low	40.5	Very low	247 Å²	247	132.7 Å²	132.7	93%	0.932	73%	0.728	S	S	*	*			trans	-63.8	117	161.1	-75.1	-174.5	-171.9	-156.8	1.4	106.8
694	R	36.3	Very low	42.1	Very low	236 Å²	236	126.3 Å²	126.3	89%	0.891	70%	0.697	S	S	*	*			trans	-56.8	130	171.5	-72.8	179.9	175.6	-176.3	-1.3	108.5	A692 S696	A692-R694 PolarHBondContact O-N 3.34Å; R694-S696 PolarHBondContact O-N 3.3Å
695	P	37.4	Very low	44.2	Very low	113 Å²	113	119 Å²	119	73%	0.734	66%	0.661	S	S	*	*			trans	-70.9	113.7	166.4	28.5	-28	0	0	0	107.2	V697	P695-V697 PolarHBondContact O-N 2.82Å; P695-V697 VanDerWaalsContact O-N 3.08Å
696	S	37.3	Very low	46.1	Very low	119 Å²	119	117.7 Å²	117.7	83%	0.832	65%	0.645	S	S	*	*			trans	-65.6	102.2	164.3	48	0	0	0	0	107.5	R694 E698	R694-S696 PolarHBondContact O-N 3.3Å; S696-E698 PolarHBondContact O-N 2.88Å
697	V	43.1	Very low	47.8	Very low	94 Å²	94	114.5 Å²	114.5	57%	0.57	62%	0.617	S	S	*	*			trans	-75.3	114.7	169.4	178.5	0	0	0	0	106.7	P695 L699 L725	P695-V697 PolarHBondContact O-N 2.82Å; P695-V697 VanDerWaalsContact O-N 3.08Å; V697-L699 PolarHBondContact O-N 2.99Å; V697-L725 HydrophobicContact CG1-CD2 4.38Å
698	E	41.9	Very low	50	Low	158 Å²	158	111.4 Å²	111.4	74%	0.738	59%	0.592	S	S	*	*			trans	-71.8	104.7	176.3	-168.3	175.1	-159.9	0	0	108.6	S696 K700	S696-E698 PolarHBondContact O-N 2.88Å; E698-K700 PolarHBondContact O-N 3.45Å
699	L	46.9	Very low	51.9	Low	72 Å²	72	108 Å²	108	38%	0.377	58%	0.582	S	S	.	*			trans	-73.4	113.4	173.6	-74.4	166.1	0	0	0	108.6	V697 Y701	V697-L699 PolarHBondContact O-N 2.99Å; L699-Y701 HydrophobicContact CB-CD2 4.47Å; L699-Y701 HydrophobicContact CB-CE2 3.77Å
700	K	50.6	Low	53.5	Low	119 Å²	119	104.8 Å²	104.8	52%	0.517	56%	0.562	S	S	.	*			trans	-84.1	121.5	170.8	-67.7	176.7	-169.6	151.5	0	109	E698 V720 E722	E698-K700 PolarHBondContact O-N 3.45Å; K700-V720 HydrophobicContact CB-CB 4.32Å; K700-V720 HydrophobicContact CB-CG2 4.11Å; K700-V720 WeakPolarHBondContact O-CB 3.33Å; K700-V720 VanDerWaalsContact O-CG2 3.32Å; K700-V720 WeakPolarHBondContact O-CG2 3.19Å; K700-V720 PolarHBondContact O-N 3.44Å; K700-E722 IonicContact NZ-OE1 3.39Å; K700-E722 PolarHBondContact NZ-OE1 3.26Å
701	Y	56.7	Low	54.7	Low	102 Å²	102	99.1 Å²	99.1	40%	0.4	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	139	168.8	-63.7	-83	0	0	0	109	L699 V717 D719	L699-Y701 HydrophobicContact CB-CD2 4.47Å; L699-Y701 HydrophobicContact CB-CE2 3.77Å; Y701-V717 HydrophobicContact CD1-CG1 3.78Å; Y701-V717 HydrophobicContact CG-CG1 4.09Å; Y701-D719 WeakPolarHBondContact CE1-OD1 3.39Å
702	E	59.6	Low	56.5	Low	112 Å²	112	99.9 Å²	99.9	52%	0.523	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	111.2	166.5	-171.2	179.9	177	0	0	107.5	T704 A718 V720	E702-T704 HydrophobicContact CG-CG2 4.16Å; E702-A718 HydrophobicContact CB-CB 4.49Å; E702-A718 PolarHBondContact N-O 2.94Å; E702-A718 PolarHBondContact O-N 3.43Å; E702-V720 HydrophobicContact CB-CG2 3.97Å
703	V	68.1	Low	58.1	Low	85 Å²	85	96.5 Å²	96.5	52%	0.515	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	106	174.7	-174.5	0	0	0	0	107.8	Y715 V717	V703-Y715 HydrophobicContact CG1-CD1 4.12Å; V703-V717 HydrophobicContact CG2-CG1 4.47Å; V703-V717 HydrophobicContact CG2-CG2 4.27Å
704	T	71.4	Confident	60	Low	46 Å²	46	92.5 Å²	92.5	28%	0.282	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	130.5	174.4	52.3	0	0	0	0	109.9	E702 Y715 R716	E702-T704 HydrophobicContact CG-CG2 4.16Å; T704-Y715 WeakPolarHBondContact O-CA 3.21Å; T704-R716 PolarHBondContact N-O 3.48Å; T704-R716 PolarHBondContact O-N 2.91Å; T704-R716 WeakPolarHBondContact OG1-CB 2.71Å; T704-R716 PolarHBondContact OG1-O 3.4Å
705	R	74.8	Confident	61.8	Low	34 Å²	34	86.8 Å²	86.8	13%	0.128	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	131.3	177.3	-176.8	-179.1	134.2	-148.8	1.8	109.6	T333 D337 D340 T713 Y715	T333-R705 PolarHBondContact OG1-NH1 2.79Å; D337-R705 IonicContact OD1-CZ 3.59Å; D337-R705 VanDerWaalsContact OD1-CZ 3.3Å; D337-R705 IonicContact OD1-NH1 2.71Å; D337-R705 PolarHBondContact OD1-NH1 3.3Å; D337-R705 IonicContact OD1-NH2 3.35Å; D337-R705 IonicContact OD2-CZ 3.61Å; D337-R705 IonicContact OD2-NE 3.01Å; D337-R705 IonicContact OD2-NH1 3.31Å; D337-R705 PolarHBondContact OD2-NH1 2.93Å; D340-R705 IonicContact OD1-CZ 3.77Å; D340-R705 VanDerWaalsContact OD1-CZ 3.31Å; D340-R705 IonicContact OD1-NH1 3.6Å; D340-R705 PolarHBondContact OD1-NH1 2.98Å; D340-R705 IonicContact OD1-NH2 3.3Å; D340-R705 PolarHBondContact OD1-NH2 3.43Å; R705-T713 HydrophobicContact CG-CG2 3.47Å; R705-T713 VanDerWaalsContact CG-CG2 3.47Å; R705-Y715 HydrophobicContact CB-CD1 4.27Å; R705-Y715 HydrophobicContact CB-CE1 4.28Å; R705-Y715 HydrophobicContact CG-CD1 4.27Å; R705-Y715 HydrophobicContact CG-CE1 3.94Å
706	Q	73.2	Confident	63.5	Low	119 Å²	119	89.4 Å²	89.4	56%	0.556	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	127.4	175.8	-66.7	-173.6	-17.4	0	0	109.8	T713 R714	Q706-T713 CarbonylContact O-C 3.37Å; Q706-T713 WeakPolarHBondContact O-CA 3.17Å; Q706-R714 PolarHBondContact N-O 3.19Å; Q706-R714 PolarHBondContact O-N 2.8Å
707	V	72.3	Confident	65	Low	16 Å²	16	88.1 Å²	88.1	10%	0.097	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.4	174.3	179.7	0	0	0	0	108	A339 I343 F712 T713	A339-V707 HydrophobicContact CB-CB 4.38Å; A339-V707 HydrophobicContact CB-CG2 3.78Å; I343-V707 HydrophobicContact CD1-CG2 4.04Å; I343-V707 HydrophobicContact CG1-CG1 4.25Å; I343-V707 HydrophobicContact CG1-CG2 4.23Å; V707-F712 WeakPolarHBondContact CA-O 3.26Å; V707-T713 HydrophobicContact CG2-CG2 4.13Å
708	D	75.5	Confident	65.9	Low	45 Å²	45	85.5 Å²	85.5	24%	0.241	42%	0.424	C	S	.	.			trans	-77.3	173.8	177.6	69.8	21.4	0	0	0	112.3	A710 G711 F712 R714	D708-A710 PolarHBondContact O-N 2.88Å; D708-A710 VanDerWaalsContact O-N 3.15Å; D708-A710 WeakPolarHBondContact OD1-CA 3.22Å; D708-A710 WeakPolarHBondContact OD1-CB 3.4Å; D708-A710 PolarHBondContact OD1-N 3.48Å; D708-G711 PolarHBondContact O-N 2.95Å; D708-G711 PolarHBondContact OD1-N 2.88Å; D708-G711 VanDerWaalsContact OD1-N 3.13Å; D708-F712 PolarHBondContact N-O 3.37Å; D708-F712 VanDerWaalsContact N-O 3.07Å; D708-F712 PolarHBondContact OD1-N 3.47Å; D708-R714 IonicContact OD2-CZ 2.91Å; D708-R714 IonicContact OD2-NH2 3.37Å; D708-R714 PolarHBondContact OD2-NH2 2.82Å
709	S	71.5	Confident	66.5	Low	102 Å²	102	84 Å²	84	71%	0.713	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-18.3	-179.1	55.3	0	0	0	0	113.9	G711	S709-G711 VanDerWaalsContact C-N 3.34Å
710	A	67.6	Low	66.8	Low	35 Å²	35	83.4 Å²	83.4	29%	0.289	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-4.2	175.6	0	0	0	0	0	111.9	P457 D708 F712	P457-A710 HydrophobicContact CG-CB 3.63Å; P457-A710 VanDerWaalsContact CG-O 3.24Å; P457-A710 WeakPolarHBondContact CG-O 3.28Å; D708-A710 PolarHBondContact O-N 2.88Å; D708-A710 VanDerWaalsContact O-N 3.15Å; D708-A710 WeakPolarHBondContact OD1-CA 3.22Å; D708-A710 WeakPolarHBondContact OD1-CB 3.4Å; D708-A710 PolarHBondContact OD1-N 3.48Å; A710-F712 VanDerWaalsContact C-N 3.33Å; A710-F712 HydrophobicContact CB-CD2 3.79Å; A710-F712 HydrophobicContact CB-CE2 4.17Å
711	G	60	Low	66.6	Low	24 Å²	24	82.4 Å²	82.4	25%	0.247	43%	0.434	C	S	.	.			trans	82.4	9.3	-178.4	0	0	0	0	0	113.6	Q346 D708 S709 T713	Q346-G711 VanDerWaalsContact OE1-CA 3.31Å; D708-G711 PolarHBondContact O-N 2.95Å; D708-G711 PolarHBondContact OD1-N 2.88Å; D708-G711 VanDerWaalsContact OD1-N 3.13Å; S709-G711 VanDerWaalsContact C-N 3.34Å; G711-T713 PolarHBondContact O-N 3.14Å
712	F	70.3	Confident	66.1	Low	124 Å²	124	82.2 Å²	82.2	54%	0.544	44%	0.437	S	S	.	.			trans	-76.5	121.9	172.2	-72.8	-83.3	0	0	0	110	P457 V707 D708 A710	P457-F712 HydrophobicContact CB-CE2 4.29Å; V707-F712 WeakPolarHBondContact CA-O 3.26Å; D708-F712 PolarHBondContact N-O 3.37Å; D708-F712 VanDerWaalsContact N-O 3.07Å; D708-F712 PolarHBondContact OD1-N 3.47Å; A710-F712 VanDerWaalsContact C-N 3.33Å; A710-F712 HydrophobicContact CB-CD2 3.79Å; A710-F712 HydrophobicContact CB-CE2 4.17Å
713	T	69.4	Low	65.5	Low	24 Å²	24	85.6 Å²	85.6	15%	0.147	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	126	171.8	-45.3	0	0	0	0	110	D331 R705 Q706 V707 G711 Y715	D331-T713 HydrophobicContact CB-CG2 3.98Å; D331-T713 WeakPolarHBondContact CB-OG1 3.2Å; D331-T713 VanDerWaalsContact CG-CB 3.46Å; D331-T713 VanDerWaalsContact CG-OG1 3.26Å; D331-T713 WeakPolarHBondContact OD2-CB 3.39Å; D331-T713 PolarHBondContact OD2-OG1 3.32Å; R705-T713 HydrophobicContact CG-CG2 3.47Å; R705-T713 VanDerWaalsContact CG-CG2 3.47Å; Q706-T713 CarbonylContact O-C 3.37Å; Q706-T713 WeakPolarHBondContact O-CA 3.17Å; V707-T713 HydrophobicContact CG2-CG2 4.13Å; G711-T713 PolarHBondContact O-N 3.14Å; T713-Y715 HydrophobicContact CG2-CD2 4.43Å; T713-Y715 HydrophobicContact CG2-CE1 4.32Å; T713-Y715 HydrophobicContact CG2-CE2 3.78Å
714	R	75.7	Confident	64.6	Low	164 Å²	164	86.9 Å²	86.9	62%	0.619	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.8	132	170.1	-65.5	-176.3	-168.8	147.9	12.1	109.2	Q706 D708	Q706-R714 PolarHBondContact N-O 3.19Å; Q706-R714 PolarHBondContact O-N 2.8Å; D708-R714 IonicContact OD2-CZ 2.91Å; D708-R714 IonicContact OD2-NH2 3.37Å; D708-R714 PolarHBondContact OD2-NH2 2.82Å
715	Y	75.1	Confident	63.6	Low	116 Å²	116	88.3 Å²	88.3	46%	0.455	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	129.2	172.4	-59.1	-89.4	0	0	0	108.6	D331 V703 T704 R705 T713	D331-Y715 WeakPolarHBondContact OD1-CE2 3.33Å; D331-Y715 PolarHBondContact OD1-OH 3.32Å; V703-Y715 HydrophobicContact CG1-CD1 4.12Å; T704-Y715 WeakPolarHBondContact O-CA 3.21Å; R705-Y715 HydrophobicContact CB-CD1 4.27Å; R705-Y715 HydrophobicContact CB-CE1 4.28Å; R705-Y715 HydrophobicContact CG-CD1 4.27Å; R705-Y715 HydrophobicContact CG-CE1 3.94Å; T713-Y715 HydrophobicContact CG2-CD2 4.43Å; T713-Y715 HydrophobicContact CG2-CE1 4.32Å; T713-Y715 HydrophobicContact CG2-CE2 3.78Å
716	R	73.4	Confident	62.6	Low	168 Å²	168	88.1 Å²	88.1	63%	0.634	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115	115.6	172.9	-177.4	-175.9	-152.8	150.6	4.4	108	T704	T704-R716 PolarHBondContact N-O 3.48Å; T704-R716 PolarHBondContact O-N 2.91Å; T704-R716 WeakPolarHBondContact OG1-CB 2.71Å; T704-R716 PolarHBondContact OG1-O 3.4Å
717	V	68.7	Low	61.8	Low	92 Å²	92	82.8 Å²	82.8	56%	0.558	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	119.9	174.7	-171.6	0	0	0	0	107.5	Y701 V703	Y701-V717 HydrophobicContact CD1-CG1 3.78Å; Y701-V717 HydrophobicContact CG-CG1 4.09Å; V703-V717 HydrophobicContact CG2-CG1 4.47Å; V703-V717 HydrophobicContact CG2-CG2 4.27Å
718	A	61.3	Low	61.1	Low	39 Å²	39	86.4 Å²	86.4	32%	0.322	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	140	169.5	0	0	0	0	0	108.9	E702 V720	E702-A718 HydrophobicContact CB-CB 4.49Å; E702-A718 PolarHBondContact N-O 2.94Å; E702-A718 PolarHBondContact O-N 3.43Å; A718-V720 PolarHBondContact O-N 3.32Å
719	D	54.7	Low	60.4	Low	125 Å²	125	87.6 Å²	87.6	67%	0.668	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.2	124.9	169.4	-68.5	-26	0	0	0	107.8	Y701 A721	Y701-D719 WeakPolarHBondContact CE1-OD1 3.39Å; D719-A721 PolarHBondContact O-N 3.2Å
720	V	53.9	Low	60.1	Low	61 Å²	61	86.6 Å²	86.6	37%	0.37	48%	0.481	S	S	.	.			trans	-67.5	109	164.1	-177.2	0	0	0	0	104.8	K700 E702 A718 E722	K700-V720 HydrophobicContact CB-CB 4.32Å; K700-V720 HydrophobicContact CB-CG2 4.11Å; K700-V720 WeakPolarHBondContact O-CB 3.33Å; K700-V720 VanDerWaalsContact O-CG2 3.32Å; K700-V720 WeakPolarHBondContact O-CG2 3.19Å; K700-V720 PolarHBondContact O-N 3.44Å; E702-V720 HydrophobicContact CB-CG2 3.97Å; A718-V720 PolarHBondContact O-N 3.32Å; V720-E722 HydrophobicContact CG1-CG 4.43Å; V720-E722 PolarHBondContact O-N 3.11Å
721	A	45.3	Very low	59.7	Low	98 Å²	98	92.1 Å²	92.1	81%	0.81	51%	0.505	S	S	*	.			trans	-67	76.7	177.1	0	0	0	0	0	109.6	D719	D719-A721 PolarHBondContact O-N 3.2Å
722	E	47.5	Very low	59.9	Low	98 Å²	98	91.4 Å²	91.4	46%	0.458	50%	0.496	S	S	.	.			trans	-72.3	127.4	160.7	-77.5	-170.4	178.6	0	0	107.9	K700 V720 S724	K700-E722 IonicContact NZ-OE1 3.39Å; K700-E722 PolarHBondContact NZ-OE1 3.26Å; V720-E722 HydrophobicContact CG1-CG 4.43Å; V720-E722 PolarHBondContact O-N 3.11Å; E722-S724 PolarHBondContact O-N 3.46Å
723	E	46.2	Very low	59.9	Low	182 Å²	182	90 Å²	90	85%	0.85	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	123.6	-170.3	-65.7	173.7	143.5	0	0	113.1
724	S	48.3	Very low	59.7	Low	113 Å²	113	93.5 Å²	93.5	79%	0.79	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	57.3	158.8	64.8	0	0	0	0	118	E722 G726	E722-S724 PolarHBondContact O-N 3.46Å; S724-G726 PolarHBondContact O-N 3.16Å
725	L	50.7	Low	59.1	Low	75 Å²	75	91.7 Å²	91.7	39%	0.393	51%	0.506	S	S	.	.			trans	-74.1	94.7	170.3	-80.3	144.2	0	0	0	111.9	V697 T742	V697-L725 HydrophobicContact CG1-CD2 4.38Å; L725-T742 WeakPolarHBondContact O-CG2 3.2Å
726	G	54.3	Low	58.7	Low	30 Å²	30	92.3 Å²	92.3	31%	0.309	52%	0.516	S	S	.	.			trans	-63.4	166.9	172.7	0	0	0	0	0	114.5	S724 S728 R750	S724-G726 PolarHBondContact O-N 3.16Å; G726-S728 PolarHBondContact O-N 2.88Å; G726-R750 PolarHBondContact O-NH2 3.49Å
727	C	55.7	Low	58.4	Low	7 Å²	7	87.2 Å²	87.2	5%	0.047	51%	0.509	C	S	.	.			trans	-60	122.1	172.9	-150.9	0	0	0	0	108.2	C732 Y735 C746	C727-C732 HydrophobicContact CB-CB 4.3Å; C727-C732 WeakPolarHBondContact CB-SG 3.49Å; C727-C732 WeakPolarHBondContact SG-CB 3.23Å; C727-C732 CovalentContact SG-SG 2.09Å; C727-C732 PolarHBondContact SG-SG 3.11Å; C727-Y735 WeakPolarHBondContact O-CD2 3.41Å; C727-C746 PolarHBondContact SG-SG 2.9Å
728	S	58.3	Low	58.2	Low	93 Å²	93	86.1 Å²	86.1	65%	0.65	52%	0.517	S	S	*	.			trans	-102.4	7.6	-179.6	63.7	0	0	0	0	113.3	G726 R750	G726-S728 PolarHBondContact O-N 2.88Å; S728-R750 PolarHBondContact OG-NH2 3.48Å
729	N	61.7	Low	58.3	Low	69 Å²	69	89.1 Å²	89.1	37%	0.369	52%	0.524	S	S	.	.			trans	-96.3	114.2	-177.8	179	-1.6	0	0	0	109	L731 C732 Y735	N729-L731 PolarHBondContact O-N 3.41Å; N729-L731 VanDerWaalsContact O-N 3.07Å; N729-L731 WeakPolarHBondContact OD1-CB 3.44Å; N729-L731 PolarHBondContact OD1-N 3.03Å; N729-C732 HydrophobicContact CB-CB 3.9Å; N729-C732 WeakPolarHBondContact O-CB 3.43Å; N729-C732 PolarHBondContact O-N 3.27Å; N729-Y735 VanDerWaalsContact O-CB 3.23Å; N729-Y735 WeakPolarHBondContact O-CB 3.46Å
730	S	63.4	Low	58.5	Low	82 Å²	82	88 Å²	88	57%	0.573	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-15.6	179.9	55.9	0	0	0	0	114.1
731	L	60.3	Low	58.8	Low	151 Å²	151	88.7 Å²	88.7	79%	0.791	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-3.2	175.6	-57.2	170.8	0	0	0	112.9	N729 S733	N729-L731 PolarHBondContact O-N 3.41Å; N729-L731 VanDerWaalsContact O-N 3.07Å; N729-L731 WeakPolarHBondContact OD1-CB 3.44Å; N729-L731 PolarHBondContact OD1-N 3.03Å; L731-S733 PolarHBondContact O-N 3.05Å
732	C	64.8	Low	59.3	Low	8 Å²	8	85.5 Å²	85.5	5%	0.054	50%	0.501	C	S	.	.			trans	-74.8	120.6	176.7	173.5	0	0	0	0	109.7	C727 N729 R734 Y735 I736 C743	C727-C732 HydrophobicContact CB-CB 4.3Å; C727-C732 WeakPolarHBondContact CB-SG 3.49Å; C727-C732 WeakPolarHBondContact SG-CB 3.23Å; C727-C732 CovalentContact SG-SG 2.09Å; C727-C732 PolarHBondContact SG-SG 3.11Å; N729-C732 HydrophobicContact CB-CB 3.9Å; N729-C732 WeakPolarHBondContact O-CB 3.43Å; N729-C732 PolarHBondContact O-N 3.27Å; C732-R734 PolarHBondContact O-N 3.42Å; C732-R734 VanDerWaalsContact O-N 3.11Å; C732-Y735 WeakPolarHBondContact O-CA 3.47Å; C732-Y735 VanDerWaalsContact O-CB 3.31Å; C732-Y735 WeakPolarHBondContact O-CB 3.38Å; C732-Y735 PolarHBondContact O-N 3.16Å; C732-I736 WeakPolarHBondContact O-CG1 3.48Å; C732-I736 PolarHBondContact O-N 3.4Å; C732-C743 VanDerWaalsContact SG-SG 3.66Å
733	S	70.1	Confident	60	Low	94 Å²	94	81.9 Å²	81.9	66%	0.657	49%	0.486	S	S	*	.	H	α-helix	trans	-55.2	-31.2	175	57.5	0	0	0	0	113	L731 A737	L731-S733 PolarHBondContact O-N 3.05Å; S733-A737 VanDerWaalsContact O-CB 3.22Å; S733-A737 WeakPolarHBondContact O-CB 3.47Å; S733-A737 PolarHBondContact O-N 2.82Å
734	R	64.2	Low	60.3	Low	98 Å²	98	75.6 Å²	75.6	37%	0.37	47%	0.47	S	S	.	.	H	α-helix	trans	-72.1	-31.1	173.5	-73.4	-158.7	177.9	170.4	-2.5	114.3	C732 G738 H739 T741 T742 C743	C732-R734 PolarHBondContact O-N 3.42Å; C732-R734 VanDerWaalsContact O-N 3.11Å; R734-G738 PolarHBondContact O-N 3.32Å; R734-H739 HydrophobicContact CB-CB 4.09Å; R734-H739 HydrophobicContact CG-CB 4.41Å; R734-H739 PolarHBondContact O-N 2.85Å; R734-T741 WeakPolarHBondContact CD-O 3.33Å; R734-T741 PolarHBondContact NH1-OG1 3Å; R734-T742 PolarHBondContact NH1-O 2.78Å; R734-T742 VanDerWaalsContact NH1-O 3.09Å; R734-C743 HydrophobicContact CG-CB 4.21Å
735	Y	64.2	Low	60.5	Low	127 Å²	127	77.1 Å²	77.1	50%	0.498	47%	0.469	S	S	.	.	H	α-helix	trans	-67.2	-47.1	171.2	179	-105.9	0	0	0	110.4	C727 N729 C732 A737 G738	C727-Y735 WeakPolarHBondContact O-CD2 3.41Å; N729-Y735 VanDerWaalsContact O-CB 3.23Å; N729-Y735 WeakPolarHBondContact O-CB 3.46Å; C732-Y735 WeakPolarHBondContact O-CA 3.47Å; C732-Y735 VanDerWaalsContact O-CB 3.31Å; C732-Y735 WeakPolarHBondContact O-CB 3.38Å; C732-Y735 PolarHBondContact O-N 3.16Å; Y735-A737 PolarHBondContact O-N 3.07Å; Y735-G738 PolarHBondContact O-N 2.76Å
736	I	65.3	Low	60.6	Low	128 Å²	128	74 Å²	74	66%	0.656	45%	0.453	S	S	*	.	H	α-helix	trans	-61.7	-34.4	177.9	-61.4	169.6	0	0	0	110.9	C732 G738	C732-I736 WeakPolarHBondContact O-CG1 3.48Å; C732-I736 PolarHBondContact O-N 3.4Å; I736-G738 VanDerWaalsContact C-N 3.33Å
737	A	68.2	Low	60.5	Low	61 Å²	61	76.4 Å²	76.4	50%	0.504	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	5.2	177.6	0	0	0	0	0	114.8	S733 Y735 H739	S733-A737 VanDerWaalsContact O-CB 3.22Å; S733-A737 WeakPolarHBondContact O-CB 3.47Å; S733-A737 PolarHBondContact O-N 2.82Å; Y735-A737 PolarHBondContact O-N 3.07Å; A737-H739 VanDerWaalsContact C-N 3.27Å; A737-H739 PolarHBondContact O-N 3.28Å
738	G	63.8	Low	60	Low	69 Å²	69	80.8 Å²	80.8	71%	0.711	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	23.2	176.8	0	0	0	0	0	114.8	R734 Y735 I736	R734-G738 PolarHBondContact O-N 3.32Å; Y735-G738 PolarHBondContact O-N 2.76Å; I736-G738 VanDerWaalsContact C-N 3.33Å
739	H	63.3	Low	59.5	Low	102 Å²	102	81.4 Å²	81.4	47%	0.472	49%	0.489	S	S	.	.			trans	-75	134.5	179.1	-72.1	-55.8	0	0	0	111.6	R734 A737 T741	R734-H739 HydrophobicContact CB-CB 4.09Å; R734-H739 HydrophobicContact CG-CB 4.41Å; R734-H739 PolarHBondContact O-N 2.85Å; A737-H739 VanDerWaalsContact C-N 3.27Å; A737-H739 PolarHBondContact O-N 3.28Å; H739-T741 PolarHBondContact O-N 3.4Å
740	S	59.6	Low	58.7	Low	101 Å²	101	82.2 Å²	82.2	71%	0.706	49%	0.487	S	S	*	.	S	Bend	trans	-73	-6.6	175.3	55	0	0	0	0	114.2
741	T	58.7	Low	57.4	Low	76 Å²	76	87.4 Å²	87.4	47%	0.466	51%	0.505	S	S	.	.	S	Bend	trans	-110.3	129.2	-178	55.4	0	0	0	0	111.9	R734 H739	R734-T741 WeakPolarHBondContact CD-O 3.33Å; R734-T741 PolarHBondContact NH1-OG1 3Å; H739-T741 PolarHBondContact O-N 3.4Å
742	T	57.3	Low	57.2	Low	32 Å²	32	84.3 Å²	84.3	20%	0.196	49%	0.49	C	S	.	.			trans	-59.4	141.1	173.4	38.7	0	0	0	0	111.5	L725 R734	L725-T742 WeakPolarHBondContact O-CG2 3.2Å; R734-T742 PolarHBondContact NH1-O 2.78Å; R734-T742 VanDerWaalsContact NH1-O 3.09Å
743	C	60.9	Low	56.8	Low	22 Å²	22	88.3 Å²	88.3	15%	0.149	51%	0.513	C	S	.	.			trans	-77.4	154.2	170.4	73.1	0	0	0	0	110.5	C732 R734 L745 C746 I747	C732-C743 VanDerWaalsContact SG-SG 3.66Å; R734-C743 HydrophobicContact CG-CB 4.21Å; C743-L745 PolarHBondContact O-N 2.84Å; C743-L745 VanDerWaalsContact O-N 3.13Å; C743-C746 PolarHBondContact O-N 3.42Å; C743-C746 PolarHBondContact SG-N 2.65Å; C743-C746 PolarHBondContact SG-SG 2.82Å; C743-I747 PolarHBondContact O-N 3.41Å
744	G	53.6	Low	56.1	Low	50 Å²	50	87.9 Å²	87.9	52%	0.515	51%	0.505	S	S	.	.	H	α-helix	trans	-53.3	-34.9	-179.4	0	0	0	0	0	113.9	I747 T748	G744-I747 WeakPolarHBondContact O-CB 3.36Å; G744-I747 PolarHBondContact O-N 3.38Å; G744-T748 PolarHBondContact O-N 3.4Å; G744-T748 PolarHBondContact O-OG1 3.09Å
745	L	51.5	Low	55.6	Low	145 Å²	145	87.4 Å²	87.4	76%	0.759	51%	0.513	S	S	*	.	H	α-helix	trans	-66.6	-33.4	175.1	-87.1	141.4	0	0	0	113.8	C743 I747 S749	C743-L745 PolarHBondContact O-N 2.84Å; C743-L745 VanDerWaalsContact O-N 3.13Å; L745-I747 VanDerWaalsContact C-N 3.31Å; L745-S749 WeakPolarHBondContact O-CB 3.43Å; L745-S749 PolarHBondContact O-N 2.74Å; L745-S749 VanDerWaalsContact O-N 3.11Å
746	C	53.6	Low	55.1	Low	10 Å²	10	84.9 Å²	84.9	7%	0.068	51%	0.514	C	S	.	.	H	α-helix	trans	-78.2	-19.3	174.4	-70.9	0	0	0	0	112.4	C727 C743 R750	C727-C746 PolarHBondContact SG-SG 2.9Å; C743-C746 PolarHBondContact O-N 3.42Å; C743-C746 PolarHBondContact SG-N 2.65Å; C743-C746 PolarHBondContact SG-SG 2.82Å; C746-R750 WeakPolarHBondContact O-CB 3.27Å; C746-R750 WeakPolarHBondContact O-CD 3.27Å; C746-R750 VanDerWaalsContact O-CG 3.23Å; C746-R750 WeakPolarHBondContact O-CG 3.34Å
747	I	51.4	Low	54.4	Low	79 Å²	79	82 Å²	82	41%	0.405	51%	0.505	S	S	.	.	H	α-helix	trans	-76.1	-45.5	169.8	-61.6	170.6	0	0	0	109.5	C743 G744 L745 S749 R750 M751	C743-I747 PolarHBondContact O-N 3.41Å; G744-I747 WeakPolarHBondContact O-CB 3.36Å; G744-I747 PolarHBondContact O-N 3.38Å; L745-I747 VanDerWaalsContact C-N 3.31Å; I747-S749 VanDerWaalsContact C-N 3.29Å; I747-S749 PolarHBondContact O-N 2.82Å; I747-R750 PolarHBondContact O-N 3.1Å; I747-R750 VanDerWaalsContact O-N 3.15Å; I747-M751 PolarHBondContact O-N 3.25Å
748	T	45.9	Very low	53.4	Low	99 Å²	99	83.5 Å²	83.5	61%	0.607	51%	0.505	S	S	*	.	H	α-helix	trans	-69.2	-25.4	-179.8	-5.3	0	0	0	0	113.6	G744 R750	G744-T748 PolarHBondContact O-N 3.4Å; G744-T748 PolarHBondContact O-OG1 3.09Å; T748-R750 VanDerWaalsContact C-N 3.34Å
749	S	48	Very low	52.6	Low	106 Å²	106	84.6 Å²	84.6	74%	0.741	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-3.7	175.9	-161.6	0	0	0	0	113.4	L745 I747	L745-S749 WeakPolarHBondContact O-CB 3.43Å; L745-S749 PolarHBondContact O-N 2.74Å; L745-S749 VanDerWaalsContact O-N 3.11Å; I747-S749 VanDerWaalsContact C-N 3.29Å; I747-S749 PolarHBondContact O-N 2.82Å
750	R	43.9	Very low	51.7	Low	86 Å²	86	83.2 Å²	83.2	33%	0.325	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-21.5	177.2	-80.4	-178.9	-179.8	175	3.1	113.3	G726 S728 C746 I747 T748	G726-R750 PolarHBondContact O-NH2 3.49Å; S728-R750 PolarHBondContact OG-NH2 3.48Å; C746-R750 WeakPolarHBondContact O-CB 3.27Å; C746-R750 WeakPolarHBondContact O-CD 3.27Å; C746-R750 VanDerWaalsContact O-CG 3.23Å; C746-R750 WeakPolarHBondContact O-CG 3.34Å; I747-R750 PolarHBondContact O-N 3.1Å; I747-R750 VanDerWaalsContact O-N 3.15Å; T748-R750 VanDerWaalsContact C-N 3.34Å
751	M	36.6	Very low	51	Low	192 Å²	192	81.5 Å²	81.5	95%	0.946	47%	0.471	S	S	*	.			trans	-79.8	0	165.8	-72.8	-176.4	169.2	0	0	110.4	I747	I747-M751 PolarHBondContact O-N 3.25Å

Retrieved 751 of 751 residues in 2055 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).