A0A061HUW2_CRIGR Loading...

Kelch-like 4

AlphaFold DB , UniProt , Accession A0A061HUW2, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Klhl4, Length 717 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.6	Very low	31.6	Very low	257 Å²	257	148.9 Å²	148.9	100%	1.266	80%	0.801	S	S	*	*				0	156.5	0	-80.2	175.5	162.2	0	0	109
2	S	30.8	Very low	31.8	Very low	112 Å²	112	147.7 Å²	147.7	78%	0.783	78%	0.783	S	S	*	*			trans	-105.6	148	-170.9	44.2	0	0	0	0	112.8
3	V	27.5	Very low	31.7	Very low	152 Å²	152	146.4 Å²	146.4	92%	0.921	77%	0.77	S	S	*	*			trans	-136.2	127.2	140	-177.1	0	0	0	0	106.2
4	S	30.5	Very low	32.3	Very low	109 Å²	109	143.9 Å²	143.9	76%	0.762	76%	0.756	S	S	*	*			trans	-110.1	132.7	175.7	-175.4	0	0	0	0	109.3	K6	S4-K6 PolarHBondContact O-N 3.35Å
5	G	27.4	Very low	32.5	Very low	69 Å²	69	137 Å²	137	71%	0.711	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-75.9	120.6	177.8	0	0	0	0	0	111.3	K7	G5-K7 PolarHBondContact O-N 3.1Å
6	K	28.9	Very low	32.5	Very low	206 Å²	206	139.8 Å²	139.8	90%	0.896	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-65.2	122.6	166	-71.2	-175.4	176.6	-176.9	0	108.8	S4	S4-K6 PolarHBondContact O-N 3.35Å
7	K	32	Very low	32.4	Very low	189 Å²	189	137.3 Å²	137.3	82%	0.822	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-78.6	130.5	158.9	-71.8	-176.6	176	-178.7	0	108.1	G5	G5-K7 PolarHBondContact O-N 3.1Å
8	E	30.5	Very low	32.9	Very low	195 Å²	195	135.4 Å²	135.4	91%	0.911	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-69.8	142.1	166.3	-67.4	179.5	112.7	0	0	109.7
9	F	36.9	Very low	33	Very low	187 Å²	187	133.4 Å²	133.4	82%	0.82	67%	0.671	S	S	*	*			trans	-90.3	112	177.7	-84.8	-116.9	0	0	0	109.1	V11	F9-V11 PolarHBondContact O-N 3.1Å
10	D	37.2	Very low	32.9	Very low	88 Å²	88	136.7 Å²	136.7	47%	0.471	68%	0.675	S	S	.	*			trans	-78.3	88.2	176.2	-174.1	17.9	0	0	0	112	K12 Q13	D10-K12 PolarHBondContact O-N 3.38Å; D10-K12 VanDerWaalsContact O-N 3.1Å; D10-K12 WeakPolarHBondContact OD1-CB 3.42Å; D10-K12 WeakPolarHBondContact OD1-CG 3.22Å; D10-K12 PolarHBondContact OD1-N 3.43Å; D10-Q13 WeakPolarHBondContact O-CB 3.32Å; D10-Q13 PolarHBondContact O-N 3.42Å
11	V	34.9	Very low	32.9	Very low	74 Å²	74	140.1 Å²	140.1	45%	0.448	68%	0.68	S	S	.	*	H	α-helix	trans	-53.3	-26.9	173.7	177.4	0	0	0	0	112.3	F9 Q13 L15	F9-V11 PolarHBondContact O-N 3.1Å; V11-Q13 PolarHBondContact O-N 2.6Å; V11-L15 HydrophobicContact CG1-CD1 3.66Å; V11-L15 PolarHBondContact O-N 3.42Å
12	K	34.8	Very low	33.3	Very low	134 Å²	134	135.2 Å²	135.2	58%	0.583	65%	0.652	S	S	*	*	H	α-helix	trans	-67.2	-24.9	178.8	-56.2	171.6	179.6	173	0	112.2	D10 R16	D10-K12 PolarHBondContact O-N 3.38Å; D10-K12 VanDerWaalsContact O-N 3.1Å; D10-K12 WeakPolarHBondContact OD1-CB 3.42Å; D10-K12 WeakPolarHBondContact OD1-CG 3.22Å; D10-K12 PolarHBondContact OD1-N 3.43Å; K12-R16 WeakPolarHBondContact O-CB 3.37Å; K12-R16 WeakPolarHBondContact O-CD 3.3Å; K12-R16 VanDerWaalsContact O-CG 3.24Å; K12-R16 WeakPolarHBondContact O-CG 3.44Å; K12-R16 PolarHBondContact O-N 2.65Å
13	Q	30.4	Very low	33.1	Very low	131 Å²	131	133.4 Å²	133.4	61%	0.612	64%	0.639	S	S	*	*	H	α-helix	trans	-76.3	-40.3	-177.5	-156.7	170.3	23.5	0	0	111.9	D10 V11 L17	D10-Q13 WeakPolarHBondContact O-CB 3.32Å; D10-Q13 PolarHBondContact O-N 3.42Å; V11-Q13 PolarHBondContact O-N 2.6Å; Q13-L17 WeakPolarHBondContact O-CG 3.21Å; Q13-L17 PolarHBondContact O-N 3.36Å; Q13-L17 VanDerWaalsContact O-N 3.13Å
14	I	39	Very low	33.1	Very low	112 Å²	112	134.4 Å²	134.4	57%	0.574	63%	0.634	S	S	*	*	H	α-helix	trans	-66.9	-44.1	177	-63.7	173.6	0	0	0	110.8	R16 L17 R18	I14-R16 PolarHBondContact O-N 2.88Å; I14-L17 WeakPolarHBondContact O-CB 3.39Å; I14-L17 PolarHBondContact O-N 2.81Å; I14-R18 PolarHBondContact O-N 2.97Å
15	L	36.1	Very low	33	Very low	40 Å²	40	134.7 Å²	134.7	21%	0.209	63%	0.633	C	S	.	*	H	α-helix	trans	-70.6	-31.7	-178.4	-66.8	162.6	0	0	0	112.1	V11 L17 W19 L321	V11-L15 HydrophobicContact CG1-CD1 3.66Å; V11-L15 PolarHBondContact O-N 3.42Å; L15-L17 VanDerWaalsContact C-N 3.32Å; L15-W19 PolarHBondContact O-N 2.72Å; L15-L321 HydrophobicContact CB-CD1 4.29Å; L15-L321 HydrophobicContact CD1-CD1 3.58Å; L15-L321 HydrophobicContact CD2-CD1 4.41Å; L15-L321 HydrophobicContact CG-CD1 4.29Å
16	R	32.2	Very low	33	Very low	182 Å²	182	137.2 Å²	137.2	69%	0.687	64%	0.64	S	S	*	*	H	α-helix	trans	-68.5	-26.5	168.5	-78	173	170	172	-4.2	113.6	K12 I14 R20	K12-R16 WeakPolarHBondContact O-CB 3.37Å; K12-R16 WeakPolarHBondContact O-CD 3.3Å; K12-R16 VanDerWaalsContact O-CG 3.24Å; K12-R16 WeakPolarHBondContact O-CG 3.44Å; K12-R16 PolarHBondContact O-N 2.65Å; I14-R16 PolarHBondContact O-N 2.88Å; R16-R20 PolarHBondContact O-N 3.12Å
17	L	31.6	Very low	32.9	Very low	97 Å²	97	136.9 Å²	136.9	51%	0.508	64%	0.641	S	S	.	*	H	α-helix	trans	-74.4	-45.5	172.8	-77.1	162.8	0	0	0	111.2	Q13 I14 L15 W19 R20 W21	Q13-L17 WeakPolarHBondContact O-CG 3.21Å; Q13-L17 PolarHBondContact O-N 3.36Å; Q13-L17 VanDerWaalsContact O-N 3.13Å; I14-L17 WeakPolarHBondContact O-CB 3.39Å; I14-L17 PolarHBondContact O-N 2.81Å; L15-L17 VanDerWaalsContact C-N 3.32Å; L17-W19 PolarHBondContact O-N 2.93Å; L17-R20 PolarHBondContact O-N 3.25Å; L17-R20 VanDerWaalsContact O-N 3.15Å; L17-W21 VanDerWaalsContact O-CD1 3.32Å; L17-W21 PolarHBondContact O-N 3.47Å
18	R	41	Very low	32.6	Very low	103 Å²	103	131.4 Å²	131.4	39%	0.389	64%	0.639	S	S	.	*	H	α-helix	trans	-50.2	-53.1	173.7	-93.8	-172.9	168.5	-178.9	-3.4	111.8	I14 R20 W21 F22 E252	I14-R18 PolarHBondContact O-N 2.97Å; R18-R20 PolarHBondContact O-N 2.77Å; R18-W21 PolarHBondContact O-N 3.42Å; R18-F22 WeakPolarHBondContact O-CD2 3.43Å; R18-E252 IonicContact CZ-OE1 2.6Å; R18-E252 IonicContact CZ-OE2 2.95Å; R18-E252 IonicContact NH2-OE1 2.6Å; R18-E252 PolarHBondContact NH2-OE1 3.3Å; R18-E252 IonicContact NH2-OE2 2.8Å; R18-E252 PolarHBondContact NH2-OE2 2.71Å
19	W	35	Very low	32.3	Very low	97 Å²	97	127.6 Å²	127.6	37%	0.367	63%	0.634	S	S	.	*	H	α-helix	trans	-68.1	-27.8	-178.9	-76.3	105.8	0	0	0	114.7	L15 L17 S23 P323	L15-W19 PolarHBondContact O-N 2.72Å; L17-W19 PolarHBondContact O-N 2.93Å; W19-S23 WeakPolarHBondContact O-CB 3.28Å; W19-S23 PolarHBondContact O-OG 3.41Å; W19-P323 VanDerWaalsContact CH2-CD 3.46Å; W19-P323 HydrophobicContact CH2-CG 3.93Å; W19-P323 HydrophobicContact CZ3-CG 4.13Å
20	R	31.2	Very low	32	Very low	199 Å²	199	124.5 Å²	124.5	75%	0.751	63%	0.632	S	S	*	*	H	α-helix	trans	-72.9	-26.7	179.9	-91.2	-173.6	167.8	-168.7	-4.1	114.1	R16 L17 R18	R16-R20 PolarHBondContact O-N 3.12Å; L17-R20 PolarHBondContact O-N 3.25Å; L17-R20 VanDerWaalsContact O-N 3.15Å; R18-R20 PolarHBondContact O-N 2.77Å
21	W	32.1	Very low	31.4	Very low	210 Å²	210	127.9 Å²	127.9	80%	0.795	65%	0.65	S	S	*	*	H	α-helix	trans	-76.7	-26.6	-178.8	-80.3	53.2	0	0	0	113.1	L17 R18	L17-W21 VanDerWaalsContact O-CD1 3.32Å; L17-W21 PolarHBondContact O-N 3.47Å; R18-W21 PolarHBondContact O-N 3.42Å
22	F	39.6	Very low	30.9	Very low	154 Å²	154	130.9 Å²	130.9	68%	0.675	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	11.7	-177.8	-57.7	-68.6	0	0	0	114.4	R18	R18-F22 WeakPolarHBondContact O-CD2 3.43Å
23	S	27.3	Very low	30.4	Very low	73 Å²	73	128.2 Å²	128.2	51%	0.51	68%	0.679	S	S	.	*			trans	-113.1	49.1	-173.2	-62.7	0	0	0	0	114.4	W19	W19-S23 WeakPolarHBondContact O-CB 3.28Å; W19-S23 PolarHBondContact O-OG 3.41Å
24	H	25.5	Very low	30.1	Very low	173 Å²	173	127.2 Å²	127.2	80%	0.801	69%	0.687	S	S	*	*			trans	-122.8	102.6	171.7	-85.1	-61.7	0	0	0	112.1
25	P	29.4	Very low	29.3	Very low	115 Å²	115	128 Å²	128	75%	0.747	70%	0.701	S	S	*	*			trans	-71	140.7	167.3	30.4	-33.3	0	0	0	110.3	Q27	P25-Q27 PolarHBondContact O-N 3.24Å
26	S	27.9	Very low	28.8	Very low	122 Å²	122	132.9 Å²	132.9	85%	0.853	73%	0.726	S	S	*	*			trans	-68.2	119.1	177.6	40.4	0	0	0	0	111.4	G28	S26-G28 PolarHBondContact O-N 3Å; S26-G28 VanDerWaalsContact O-N 3.1Å
27	Q	26.2	Very low	28.3	Very low	199 Å²	199	132.3 Å²	132.3	93%	0.93	73%	0.732	S	S	*	*			trans	-78.1	93.7	173	-73.8	-163.2	-5	0	0	111	P25	P25-Q27 PolarHBondContact O-N 3.24Å
28	G	25	Very low	27.9	Very low	75 Å²	75	135.3 Å²	135.3	77%	0.773	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-81.4	122.5	158.6	0	0	0	0	0	110.3	S26	S26-G28 PolarHBondContact O-N 3Å; S26-G28 VanDerWaalsContact O-N 3.1Å
29	S	24.8	Very low	27.1	Very low	115 Å²	115	138.6 Å²	138.6	80%	0.804	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-78.8	159.4	174.1	69.6	0	0	0	0	111.2
30	P	30.8	Very low	26.5	Very low	121 Å²	121	137 Å²	137	79%	0.786	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-86.1	153.6	-151.4	33	-36.7	0	0	0	114.2
31	N	23.7	Very low	26.2	Very low	159 Å²	159	137.4 Å²	137.4	85%	0.85	78%	0.78	S	S	*	*			trans	-145.2	151	148.5	-127.8	-20.2	0	0	0	112.9
32	T	26.1	Very low	25.9	Very low	137 Å²	137	134.6 Å²	134.6	84%	0.84	78%	0.776	S	S	*	*			trans	-64.2	137.5	-165.7	51.2	0	0	0	0	115.4
33	G	24.1	Very low	25.3	Very low	78 Å²	78	135.5 Å²	135.5	80%	0.804	78%	0.782	S	S	*	*			trans	-167.4	93.7	168.1	0	0	0	0	0	112.3
34	S	23.2	Very low	25.2	Very low	111 Å²	111	144.3 Å²	144.3	78%	0.776	80%	0.804	S	S	*	*			trans	-79	139.1	179.7	-176.4	0	0	0	0	111.8
35	C	22.2	Very low	25.1	Very low	128 Å²	128	139.4 Å²	139.4	87%	0.865	80%	0.8	S	S	*	*			trans	-134.2	122.4	160.5	-166.7	0	0	0	0	108.5
36	L	25.1	Very low	24.9	Very low	142 Å²	142	140.1 Å²	140.1	74%	0.743	80%	0.802	S	S	*	*			trans	-113.9	167.5	-179	-89.2	168	0	0	0	110.8
37	Q	23.3	Very low	25	Very low	171 Å²	171	140.6 Å²	140.6	80%	0.799	80%	0.802	S	S	*	*			trans	-63.4	146.9	175.5	-57.5	154	-77	0	0	111.7
38	Q	23.5	Very low	25.1	Very low	160 Å²	160	137 Å²	137	75%	0.748	79%	0.794	S	S	*	*				172.2	131.5	120.4	-91.2	-169.9	-69.8	0	0	109
39	E	23.3	Very low	25.3	Very low	171 Å²	171	143.1 Å²	143.1	80%	0.799	80%	0.802	S	S	*	*				60.2	122.6	81.1	-62.7	-170.9	124	0	0	115.5
40	G	22.3	Very low	25.4	Very low	65 Å²	65	140.8 Å²	140.8	67%	0.67	80%	0.797	S	S	*	*			trans	115.7	125.6	133.3	0	0	0	0	0	120.6
41	Y	25.8	Very low	25.1	Very low	206 Å²	206	146.5 Å²	146.5	81%	0.808	80%	0.802	S	S	*	*			trans	72.8	106	135.6	-77.2	-89.6	0	0	0	123.7
42	E	24.1	Very low	25.3	Very low	151 Å²	151	146 Å²	146	71%	0.706	80%	0.799	S	S	*	*				72.9	124.1	118.3	-81.7	-173.8	-170	0	0	125.9
43	H	27	Very low	25.4	Very low	173 Å²	173	149.3 Å²	149.3	80%	0.801	80%	0.802	S	S	*	*				50.7	105.8	129.4	-81.3	27	0	0	0	122.2
44	R	25.3	Very low	25.4	Very low	259 Å²	259	152.5 Å²	152.5	98%	0.977	80%	0.8	S	S	*	*				-176.2	159.2	128.8	-99.1	165	-170.6	-157.2	4.4	108
45	G	23.9	Very low	25.7	Very low	69 Å²	69	156.4 Å²	156.4	71%	0.711	81%	0.806	S	S	*	*			cis	177.1	154.2	-3.4	0	0	0	0	0	109.1
46	T	26	Very low	26	Very low	131 Å²	131	154.8 Å²	154.8	80%	0.804	80%	0.796	S	S	*	*			trans	-74.1	161.7	-174.7	51.6	0	0	0	0	114.3
47	P	29.5	Very low	26.2	Very low	131 Å²	131	159.9 Å²	159.9	85%	0.851	81%	0.806	S	S	*	*				-124.3	167.3	126.7	36.7	-32.3	0	0	0	113.5
48	V	27.6	Very low	26.5	Very low	125 Å²	125	158.5 Å²	158.5	76%	0.758	80%	0.804	S	S	*	*			trans	-127.7	135.7	-169.5	171.6	0	0	0	0	112
49	Q	29.8	Very low	26.9	Very low	202 Å²	202	162.8 Å²	162.8	94%	0.944	81%	0.813	S	S	*	*			trans	-169.8	145.8	155.9	-103.2	168.3	56.4	0	0	108.3
50	G	26	Very low	27.1	Very low	67 Å²	67	161.9 Å²	161.9	69%	0.691	81%	0.814	S	S	*	*			cis	158.1	128.6	-12.2	0	0	0	0	0	113.3
51	R	26.3	Very low	27.3	Very low	240 Å²	240	162.7 Å²	162.7	91%	0.906	82%	0.822	S	S	*	*			trans	104.2	112.3	167.5	-64.3	179.8	161.5	173.6	-4.1	120.2
52	L	26.6	Very low	27.5	Very low	150 Å²	150	159.9 Å²	159.9	79%	0.785	82%	0.82	S	S	*	*				47.8	119.6	121.5	-59.5	164.5	0	0	0	120.7
53	K	28	Very low	27.7	Very low	205 Å²	205	161.3 Å²	161.3	89%	0.891	82%	0.824	S	S	*	*				-167.7	153.1	91.4	-103	178.7	-177.5	179.6	0	113.1
54	N	25.3	Very low	27.8	Very low	145 Å²	145	163.2 Å²	163.2	78%	0.775	83%	0.83	S	S	*	*			trans	-80.3	155.4	172.6	-60.4	-17.7	0	0	0	111.1
55	H	29.1	Very low	27.8	Very low	193 Å²	193	154.1 Å²	154.1	89%	0.894	82%	0.817	S	S	*	*				-151.1	132.9	124.6	-113.6	-70	0	0	0	111.8
56	S	27.9	Very low	27.9	Very low	95 Å²	95	158.2 Å²	158.2	66%	0.664	82%	0.822	S	S	*	*			trans	-95.1	156.9	176.7	53.3	0	0	0	0	111.8
57	R	30.3	Very low	28.1	Very low	249 Å²	249	157.4 Å²	157.4	94%	0.94	82%	0.822	S	S	*	*			trans	-161.5	98.6	146.2	-117.2	173.6	-173.7	-178.5	2.6	112.5
58	D	29.3	Very low	28.8	Very low	142 Å²	142	156.8 Å²	156.8	76%	0.759	82%	0.818	S	S	*	*			trans	-66.6	154.1	160.9	-63.5	-75.4	0	0	0	111.5
59	R	30.7	Very low	28.9	Very low	249 Å²	249	157.1 Å²	157.1	94%	0.94	82%	0.82	S	S	*	*			trans	-149.5	125.1	138	-122	177.8	-176.4	-165.2	-1	112.3
60	N	28.5	Very low	28.8	Very low	153 Å²	153	155 Å²	155	82%	0.818	81%	0.81	S	S	*	*			trans	-69.9	153.4	-178.8	-72.2	-60.6	0	0	0	113.4
61	G	26.9	Very low	28.9	Very low	82 Å²	82	160.7 Å²	160.7	85%	0.845	82%	0.818	S	S	*	*			trans	-163.6	94.9	168	0	0	0	0	0	111.7
62	L	29.2	Very low	29	Very low	146 Å²	146	155 Å²	155	76%	0.764	81%	0.806	S	S	*	*			trans	-111.9	151	-167.6	-102.7	167.6	0	0	0	114.3
63	K	29.1	Very low	29.1	Very low	181 Å²	181	154.2 Å²	154.2	79%	0.787	80%	0.801	S	S	*	*			trans	88.5	147.6	148.6	-76.8	169.6	174.2	175.8	0	121.9
64	K	29	Very low	29.1	Very low	214 Å²	214	152.2 Å²	152.2	93%	0.93	80%	0.799	S	S	*	*			trans	76.6	142.7	170.9	-56	178.6	-178.6	179.5	0	115.9
65	G	24.6	Very low	29.2	Very low	67 Å²	67	151.2 Å²	151.2	69%	0.691	80%	0.798	S	S	*	*			cis	156.7	144.6	-12.5	0	0	0	0	0	115
66	N	25.9	Very low	29.3	Very low	155 Å²	155	148 Å²	148	83%	0.829	79%	0.794	S	S	*	*			trans	67.7	106.2	165.6	-67	10.5	0	0	0	120.8
67	S	29.8	Very low	29.2	Very low	114 Å²	114	150 Å²	150	80%	0.797	80%	0.803	S	S	*	*				70.8	157.9	114	-57.1	0	0	0	0	121.9
68	P	45.4	Very low	29.8	Very low	119 Å²	119	144.3 Å²	144.3	77%	0.773	80%	0.798	S	S	*	*			trans	-105.6	172.4	-158.1	41.2	-35.9	0	0	0	115.1
69	V	29.4	Very low	29.6	Very low	131 Å²	131	140.8 Å²	140.8	79%	0.794	80%	0.795	S	S	*	*			trans	-133.1	128.7	169	177.6	0	0	0	0	109.9
70	H	27.2	Very low	30.1	Very low	159 Å²	159	135.3 Å²	135.3	74%	0.736	79%	0.792	S	S	*	*			trans	-78.6	147.1	166.1	-88	-102.7	0	0	0	110.6
71	H	28.8	Very low	30.1	Very low	185 Å²	185	132.6 Å²	132.6	86%	0.856	79%	0.79	S	S	*	*			trans	-141.3	170.1	142.8	-99.6	-64	0	0	0	110.9
72	N	28.1	Very low	30.3	Very low	122 Å²	122	134.8 Å²	134.8	65%	0.652	79%	0.79	S	S	*	*			trans	-138.6	145.6	-141.4	-117.9	-2.4	0	0	0	112.4
73	I	28.5	Very low	30.1	Very low	133 Å²	133	134 Å²	134	68%	0.682	79%	0.791	S	S	*	*			trans	53	117.4	144.8	-46.9	158.3	0	0	0	117.6
74	L	27.9	Very low	30	Very low	162 Å²	162	133.8 Å²	133.8	85%	0.848	79%	0.793	S	S	*	*				-176.9	129.9	113.8	-98.2	173.9	0	0	0	113
75	T	26.8	Very low	29.8	Very low	125 Å²	125	131.1 Å²	131.1	77%	0.767	78%	0.784	S	S	*	*			trans	-89.8	157.5	159.9	47.4	0	0	0	0	110.1
76	P	30.9	Very low	29.9	Very low	124 Å²	124	138.8 Å²	138.8	81%	0.805	79%	0.792	S	S	*	*				-145.9	142.6	129.2	35.7	-20.7	0	0	0	115.5
77	V	27.4	Very low	29.8	Very low	139 Å²	139	137.8 Å²	137.8	84%	0.842	79%	0.791	S	S	*	*			trans	-157.2	150.5	172.6	173.1	0	0	0	0	106.1
78	P	43.1	Very low	29.5	Very low	128 Å²	128	138.4 Å²	138.4	83%	0.831	79%	0.785	S	S	*	*			cis	-120.3	-178.2	-8.6	33.3	-15.1	0	0	0	114.3
79	G	25.3	Very low	28.5	Very low	69 Å²	69	141 Å²	141	71%	0.711	79%	0.787	S	S	*	*			trans	-149	150.8	165	0	0	0	0	0	111.3
80	P	39.9	Very low	28.2	Very low	134 Å²	134	141.2 Å²	141.2	87%	0.87	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-94.8	165.9	-155	36.5	-37.8	0	0	0	116.8
81	A	28.8	Very low	28.1	Very low	95 Å²	95	145 Å²	145	79%	0.785	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-91.7	160.9	176.1	0	0	0	0	0	113.6
82	P	30.9	Very low	27.9	Very low	128 Å²	128	143.8 Å²	143.8	83%	0.831	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-99.5	150.1	162.3	36.3	-30.1	0	0	0	112.6
83	T	24.9	Very low	27.8	Very low	130 Å²	130	145.4 Å²	145.4	80%	0.798	79%	0.79	S	S	*	*			trans	-105.6	135	178.4	50.8	0	0	0	0	113.1
84	H	27.8	Very low	27.6	Very low	176 Å²	176	146.5 Å²	146.5	82%	0.815	79%	0.792	S	S	*	*			trans	-155.2	160.8	149.2	-85.6	-85.6	0	0	0	108.5
85	Q	25	Very low	27.5	Very low	159 Å²	159	146.5 Å²	146.5	74%	0.743	79%	0.792	S	S	*	*			cis	-169.5	136.1	-37.2	-179.7	168.8	3	0	0	104.8
86	R	25.3	Very low	27.4	Very low	227 Å²	227	146.5 Å²	146.5	86%	0.857	79%	0.792	S	S	*	*			trans	-70.4	142.9	-177.2	-74.8	-179.1	174.9	171.6	-2.8	112
87	V	24	Very low	27.2	Very low	134 Å²	134	148.3 Å²	148.3	81%	0.812	79%	0.793	S	S	*	*			trans	-122.1	127.5	151.7	178.4	0	0	0	0	107.4
88	L	23.2	Very low	27.2	Very low	128 Å²	128	147.7 Å²	147.7	67%	0.67	79%	0.79	S	S	*	*			trans	-95.5	140.7	164.3	-84.1	77.5	0	0	0	108.4
89	Q	25.6	Very low	26.3	Very low	174 Å²	174	149.2 Å²	149.2	81%	0.813	79%	0.785	S	S	*	*			trans	-135.2	123.7	147.2	-75.7	-165.5	-21.3	0	0	109.2
90	N	23	Very low	26.2	Very low	134 Å²	134	153.5 Å²	153.5	72%	0.717	79%	0.791	S	S	*	*			trans	-84.9	140.9	167.2	-64.3	-21.4	0	0	0	108.4
91	W	25.2	Very low	25.5	Very low	238 Å²	238	155 Å²	155	90%	0.902	79%	0.786	S	S	*	*			trans	-135.6	143	150.2	-83.9	94.8	0	0	0	109
92	Q	23.4	Very low	25.3	Very low	160 Å²	160	154.4 Å²	154.4	75%	0.748	78%	0.782	S	S	*	*			trans	-113.5	170.7	-178.9	-56.6	177.8	-83.2	0	0	109.8
93	Q	26.1	Very low	24.9	Very low	157 Å²	157	155 Å²	155	73%	0.734	78%	0.778	S	S	*	*			trans	70.6	152.9	162.3	-64.6	173.5	-14	0	0	114.8
94	Q	25.5	Very low	25	Very low	155 Å²	155	157.4 Å²	157.4	72%	0.724	78%	0.78	S	S	*	*			cis	-152.5	162	-5	-128.8	156.4	-1.1	0	0	111.3
95	N	25.4	Very low	24.7	Very low	162 Å²	162	156.1 Å²	156.1	87%	0.866	78%	0.779	S	S	*	*			trans	-77.1	134.6	166.1	-64.5	-24.9	0	0	0	110.4
96	V	25.3	Very low	24.7	Very low	125 Å²	125	154.3 Å²	154.3	76%	0.758	78%	0.779	S	S	*	*			trans	-142.2	136.8	156.2	179	0	0	0	0	109.4	V98	V96-V98 HydrophobicContact CG1-CG2 3.97Å
97	I	26.8	Very low	24.5	Very low	162 Å²	162	147.6 Å²	147.6	83%	0.831	77%	0.767	S	S	*	*			trans	-112.4	130.8	169.9	-59.6	172	0	0	0	107.3
98	V	26.1	Very low	24.5	Very low	127 Å²	127	150.6 Å²	150.6	77%	0.77	77%	0.769	S	S	*	*			trans	-141.2	133.9	168	174.2	0	0	0	0	110.3	V96	V96-V98 HydrophobicContact CG1-CG2 3.97Å
99	H	24.9	Very low	24.6	Very low	160 Å²	160	149.4 Å²	149.4	74%	0.741	78%	0.777	S	S	*	*			trans	-92.1	159.7	169.4	-106.9	-88.5	0	0	0	111
100	L	24.1	Very low	24.7	Very low	158 Å²	158	147.4 Å²	147.4	83%	0.827	78%	0.777	S	S	*	*			trans	142.4	121.3	156.3	-79.6	157.8	0	0	0	107.6
101	Q	23.5	Very low	24.8	Very low	166 Å²	166	146.8 Å²	146.8	78%	0.776	78%	0.78	S	S	*	*			cis	90	113.7	22.8	-156.7	176.8	12.9	0	0	115.7
102	A	25.4	Very low	24.9	Very low	83 Å²	83	144.6 Å²	144.6	69%	0.686	78%	0.78	S	S	*	*			trans	63.1	111.7	156.7	0	0	0	0	0	121.1
103	N	22.9	Very low	25	Very low	141 Å²	141	145.6 Å²	145.6	75%	0.754	79%	0.785	S	S	*	*				-179.6	122.9	105.8	-84.8	3.1	0	0	0	107.6
104	E	25.6	Very low	25	Very low	180 Å²	180	145.6 Å²	145.6	84%	0.841	79%	0.79	S	S	*	*				60.5	108	80.4	-70.1	-158.5	145.6	0	0	114.5
105	D	22.9	Very low	24.9	Very low	149 Å²	149	145.5 Å²	145.5	80%	0.797	79%	0.793	S	S	*	*				-158.3	156.6	116.8	-136	-36.7	0	0	0	114.2
106	T	24.2	Very low	24.9	Very low	121 Å²	121	145 Å²	145	74%	0.742	79%	0.79	S	S	*	*			trans	-24.6	160.8	170.7	44.4	0	0	0	0	121.9
107	S	22.2	Very low	24.9	Very low	86 Å²	86	146.7 Å²	146.7	60%	0.601	79%	0.787	S	S	*	*			cis	-168.8	171.7	-2.9	50.4	0	0	0	0	114.8
108	K	24.1	Very low	24.9	Very low	197 Å²	197	146.5 Å²	146.5	86%	0.857	78%	0.783	S	S	*	*			trans	64.2	116.1	152.8	-71.3	162.7	-176.8	174.3	0	120.1
109	A	24.6	Very low	24.8	Very low	102 Å²	102	144.7 Å²	144.7	84%	0.843	78%	0.781	S	S	*	*				178.4	162.2	98.7	0	0	0	0	0	113.1
110	V	26.8	Very low	24.8	Very low	133 Å²	133	147.5 Å²	147.5	81%	0.806	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-79.9	144.5	-172.1	173.6	0	0	0	0	113.1
111	P	26.7	Very low	24.9	Very low	120 Å²	120	145.3 Å²	145.3	78%	0.779	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-91.5	138.1	159	35.1	-29.9	0	0	0	111.7
112	E	25.9	Very low	25	Very low	193 Å²	193	145.3 Å²	145.3	90%	0.902	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-95	139.9	168.6	-76.1	-169.5	133.3	0	0	111.6
113	E	26	Very low	25.1	Very low	180 Å²	180	151.9 Å²	151.9	84%	0.841	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-79.3	154.2	162.9	-62.4	-179.4	113.1	0	0	110.6
114	N	25.7	Very low	25.2	Very low	157 Å²	157	149.8 Å²	149.8	84%	0.84	77%	0.772	S	S	*	*				-167.4	124.8	126.9	-110.5	-71.5	0	0	0	111.9
115	L	24	Very low	25.1	Very low	154 Å²	154	144.5 Å²	144.5	81%	0.806	77%	0.765	S	S	*	*	S	Bend		-174.7	116.7	125.9	-97.7	167.4	0	0	0	110.7
116	L	25.3	Very low	25.2	Very low	151 Å²	151	145.4 Å²	145.4	79%	0.791	77%	0.77	S	S	*	*			trans	73.1	76.3	152.8	-55.7	171.3	0	0	0	120.4
117	K	25.5	Very low	25.4	Very low	160 Å²	160	147.3 Å²	147.3	70%	0.696	78%	0.775	S	S	*	*				12.5	121.1	120.6	-77.6	174.8	153.4	-76.4	0	118
118	E	26.4	Very low	25.6	Very low	159 Å²	159	151.3 Å²	151.3	74%	0.743	78%	0.784	S	S	*	*				105.6	142.4	93.2	-81.6	167.5	172	0	0	111.9
119	A	24.6	Very low	25.8	Very low	88 Å²	88	148.8 Å²	148.8	73%	0.727	78%	0.777	S	S	*	*			cis	-135.7	159.3	-0.5	0	0	0	0	0	108.9
120	R	24	Very low	25.9	Very low	219 Å²	219	152 Å²	152	83%	0.826	78%	0.776	S	S	*	*				56.9	134.8	51.9	-80.2	-167.7	171.5	-149	14.9	113.4
121	E	27.8	Very low	25.8	Very low	112 Å²	112	149.6 Å²	149.6	52%	0.523	78%	0.779	S	S	.	*			cis	-147.3	177.5	3.6	-124.8	168.4	-118.4	0	0	108.1
122	K	25.6	Very low	25.8	Very low	167 Å²	167	151.2 Å²	151.2	73%	0.726	78%	0.781	S	S	*	*			cis	-151.2	165.5	20.3	-121.5	171.8	-171.9	71.5	0	106.7
123	R	25.6	Very low	25.8	Very low	220 Å²	220	148 Å²	148	83%	0.83	77%	0.77	S	S	*	*			cis	74.1	132	20.7	-74.9	-157.7	-179.3	-146	2.2	118.1
124	S	25.1	Very low	25.8	Very low	98 Å²	98	146 Å²	146	69%	0.685	77%	0.765	S	S	*	*			cis	170.7	144.7	-24.4	42.6	0	0	0	0	109.2
125	G	25.2	Very low	25.9	Very low	68 Å²	68	146.1 Å²	146.1	70%	0.701	76%	0.764	S	S	*	*			trans	92	155.7	175.7	0	0	0	0	0	113.8
126	D	25.1	Very low	26.1	Very low	169 Å²	169	147.5 Å²	147.5	90%	0.904	77%	0.766	S	S	*	*			cis	-142.5	-172.3	9.8	-71.4	-42.4	0	0	0	112
127	L	28.1	Very low	26.3	Very low	161 Å²	161	146.5 Å²	146.5	84%	0.843	76%	0.762	S	S	*	*			trans	-146.3	156.9	-173.2	-140.7	156.7	0	0	0	111.7
128	E	26.5	Very low	26.3	Very low	170 Å²	170	144.5 Å²	144.5	79%	0.794	77%	0.768	S	S	*	*			trans	74.3	133.6	-176.7	-45.5	-172.8	166	0	0	113.4
129	M	27.6	Very low	26.5	Very low	143 Å²	143	147.7 Å²	147.7	70%	0.704	77%	0.773	S	S	*	*			cis	-157.3	152.8	43.9	-86.9	-78.2	-87.7	0	0	113.5
130	M	26.2	Very low	27	Very low	169 Å²	169	147.5 Å²	147.5	83%	0.833	77%	0.771	S	S	*	*			trans	50.4	126.7	148.8	-60.5	-65.8	-176.3	0	0	122.2
131	G	25.2	Very low	27.2	Very low	83 Å²	83	149.2 Å²	149.2	86%	0.856	78%	0.778	S	S	*	*			trans	178.9	139.2	162.9	0	0	0	0	0	111
132	D	26.1	Very low	27.5	Very low	155 Å²	155	150.3 Å²	150.3	83%	0.829	79%	0.786	S	S	*	*			trans	-117.3	178.4	-169	-147.1	-20.7	0	0	0	112.8
133	D	27.3	Very low	27.9	Very low	125 Å²	125	152.5 Å²	152.5	67%	0.668	79%	0.791	S	S	*	*			trans	72.8	98.7	165.6	-83.4	-47.4	0	0	0	121.2
134	N	25.9	Very low	28.1	Very low	137 Å²	137	146.8 Å²	146.8	73%	0.733	79%	0.791	S	S	*	*				63.8	153.7	107.1	-81.3	-52.7	0	0	0	124.9
135	I	28.1	Very low	28.7	Very low	161 Å²	161	150.9 Å²	150.9	83%	0.826	80%	0.799	S	S	*	*			trans	95.4	151.1	159.3	-69.2	154.7	0	0	0	119.4
136	E	27.7	Very low	29.1	Very low	182 Å²	182	156.5 Å²	156.5	85%	0.85	81%	0.807	S	S	*	*			trans	-89	171.9	-152.2	-56.2	169.6	103.4	0	0	117.2
137	D	28.1	Very low	29.8	Very low	130 Å²	130	154.4 Å²	154.4	70%	0.695	80%	0.803	S	S	*	*			trans	52.7	117.8	151	-164.4	28.6	0	0	0	120.2
138	S	26.6	Very low	30.5	Very low	118 Å²	118	154.4 Å²	154.4	83%	0.825	80%	0.799	S	S	*	*				-157.1	134.7	123.2	20.4	0	0	0	0	112.4
139	R	31.1	Very low	31.1	Very low	226 Å²	226	155.2 Å²	155.2	85%	0.853	80%	0.803	S	S	*	*			trans	-69.8	157.1	174.6	-71.8	173.7	162	127.6	-9.1	113.1
140	A	33.8	Very low	31.7	Very low	84 Å²	84	156.5 Å²	156.5	69%	0.694	81%	0.809	S	S	*	*			trans	64.9	107.8	151.6	0	0	0	0	0	118.5
141	R	28.6	Very low	32.2	Very low	255 Å²	255	156.1 Å²	156.1	96%	0.962	81%	0.81	S	S	*	*			trans	-125.9	148.4	137.4	-69.7	-166.6	178.2	-174.8	1.2	109.8
142	I	33.7	Very low	33.4	Very low	135 Å²	135	158.1 Å²	158.1	69%	0.692	80%	0.8	S	S	*	*			trans	-135.6	141.4	-168.8	-79.1	172.5	0	0	0	107.3
143	Y	35.5	Very low	34.3	Very low	214 Å²	214	157.1 Å²	157.1	84%	0.839	80%	0.799	S	S	*	*			trans	58	117.1	179	-60.8	-55.1	0	0	0	118.2
144	A	29	Very low	35.3	Very low	100 Å²	100	156.4 Å²	156.4	83%	0.826	81%	0.805	S	S	*	*			trans	-149.7	112	138.5	0	0	0	0	0	107.2
145	E	38.1	Very low	36.5	Very low	183 Å²	183	157.5 Å²	157.5	86%	0.855	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-103.9	131.1	165.3	-70	-179.5	143.2	0	0	107.1
146	E	32	Very low	38.3	Very low	186 Å²	186	157.3 Å²	157.3	87%	0.869	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-103.4	136.9	168.9	-67.1	-170.8	150.9	0	0	109.1
147	P	41.2	Very low	39.9	Very low	126 Å²	126	156 Å²	156	82%	0.818	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-84.5	126.6	-176.3	32	-33.2	0	0	0	112.3
148	E	42.7	Very low	42.5	Very low	161 Å²	161	159 Å²	159	75%	0.752	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-72	142.1	169.2	-71.5	-169.6	134.6	0	0	111.6	R161	E148-R161 IonicContact OE1-NH1 2.69Å
149	E	38.7	Very low	45	Very low	187 Å²	187	160.6 Å²	160.6	87%	0.874	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-73.5	128.6	178	-64	-174.5	128.4	0	0	112.2	N151	E149-N151 PolarHBondContact O-N 3.48Å
150	M	40.4	Very low	47.6	Very low	169 Å²	169	152.4 Å²	152.4	83%	0.833	78%	0.778	S	S	*	*			trans	-79	107.6	173.2	-75.2	-172.7	-73.8	0	0	111.6	I152	M150-I152 HydrophobicContact CB-CD1 4.48Å; M150-I152 HydrophobicContact CB-CG1 4.45Å; M150-I152 HydrophobicContact SD-CD1 4.49Å
151	N	36.5	Very low	49.9	Very low	161 Å²	161	157.4 Å²	157.4	86%	0.861	78%	0.779	S	S	*	*			trans	-94.1	123.2	159.1	-101.1	-51.2	0	0	0	109.6	E149	E149-N151 PolarHBondContact O-N 3.48Å
152	I	51.4	Low	52.7	Low	126 Å²	126	150.6 Å²	150.6	65%	0.646	76%	0.762	S	S	*	*			trans	-128.4	116.6	-177.3	-59	172.1	0	0	0	110.2	M150	M150-I152 HydrophobicContact CB-CD1 4.48Å; M150-I152 HydrophobicContact CB-CG1 4.45Å; M150-I152 HydrophobicContact SD-CD1 4.49Å
153	T	43.9	Very low	55.4	Low	133 Å²	133	149.8 Å²	149.8	82%	0.816	76%	0.755	S	S	*	*			trans	-154.2	112.5	150.9	23.1	0	0	0	0	110.3
154	S	48.5	Very low	57.8	Low	111 Å²	111	142.6 Å²	142.6	78%	0.776	74%	0.739	S	S	*	*	S	Bend	trans	45.2	88.5	163.9	57.1	0	0	0	0	116.1
155	E	50.8	Low	60.5	Low	159 Å²	159	142.6 Å²	142.6	74%	0.743	73%	0.725	S	S	*	*				-134	160.7	52.3	-67.7	-176.7	168.8	0	0	114.1	H157	E155-H157 VanDerWaalsContact C-N 3.26Å; E155-H157 PolarHBondContact O-N 3.36Å; E155-H157 IonicContact OE2-CE1 2.7Å; E155-H157 IonicContact OE2-ND1 3.7Å
156	D	65.9	Low	62.9	Low	158 Å²	158	140.6 Å²	140.6	85%	0.845	71%	0.711	S	S	*	*			trans	-78.7	55.5	-170.5	-63.4	-46.6	0	0	0	114.6
157	H	62	Low	65.7	Low	153 Å²	153	134 Å²	134	71%	0.708	68%	0.684	S	S	*	*			trans	-121	100.9	-177.7	-67.2	111.8	0	0	0	112.9	E155 H159	E155-H157 VanDerWaalsContact C-N 3.26Å; E155-H157 PolarHBondContact O-N 3.36Å; E155-H157 IonicContact OE2-CE1 2.7Å; E155-H157 IonicContact OE2-ND1 3.7Å; H157-H159 PolarHBondContact O-N 3.33Å
158	F	82.2	Confident	68	Low	193 Å²	193	131.3 Å²	131.3	85%	0.846	66%	0.662	S	S	*	*			trans	-74.5	114.8	171	172.6	-100.3	0	0	0	111.2
159	H	79.3	Confident	70.3	Confident	152 Å²	152	126.5 Å²	126.5	70%	0.704	65%	0.646	S	S	*	*			trans	-114.6	93.6	179.2	-173.6	-60.7	0	0	0	112	H157 R161	H157-H159 PolarHBondContact O-N 3.33Å; H159-R161 PolarHBondContact O-N 2.87Å; H159-R161 VanDerWaalsContact O-N 3.14Å
160	S	85.1	Confident	72.7	Confident	54 Å²	54	121.9 Å²	121.9	38%	0.378	62%	0.623	S	S	.	*			trans	-70.7	106.9	172	-179.9	0	0	0	0	110.9	N162 H163	S160-N162 VanDerWaalsContact C-N 3.33Å; S160-N162 PolarHBondContact O-N 3.05Å; S160-H163 WeakPolarHBondContact O-CB 3.42Å; S160-H163 PolarHBondContact O-N 2.96Å
161	R	81.8	Confident	75.2	Confident	189 Å²	189	116.6 Å²	116.6	71%	0.713	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	-41.1	-172.1	-68.7	177.3	177.4	143.2	-2.5	114.1	E148 H159	E148-R161 IonicContact OE1-NH1 2.69Å; H159-R161 PolarHBondContact O-N 2.87Å; H159-R161 VanDerWaalsContact O-N 3.14Å
162	N	87.9	Confident	77.8	Confident	112 Å²	112	111.5 Å²	111.5	60%	0.599	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	17	-171.9	-55.9	6.1	0	0	0	112.6	S160 A164 D165 Y166	S160-N162 VanDerWaalsContact C-N 3.33Å; S160-N162 PolarHBondContact O-N 3.05Å; N162-A164 VanDerWaalsContact C-N 3.33Å; N162-A164 PolarHBondContact O-N 3.2Å; N162-D165 PolarHBondContact O-N 3.27Å; N162-Y166 WeakPolarHBondContact O-CB 3.37Å; N162-Y166 PolarHBondContact O-N 3.44Å; N162-Y166 VanDerWaalsContact O-N 3.12Å
163	H	90	Very high	79.7	Confident	119 Å²	119	109 Å²	109	55%	0.551	56%	0.556	S	S	*	*	H	α-helix	trans	-62.3	-38.1	-173.4	-175.6	70	0	0	0	113.1	S160 T167	S160-H163 WeakPolarHBondContact O-CB 3.42Å; S160-H163 PolarHBondContact O-N 2.96Å; H163-T167 VanDerWaalsContact O-CB 3.24Å; H163-T167 WeakPolarHBondContact O-CB 3.24Å; H163-T167 PolarHBondContact O-N 2.94Å; H163-T167 VanDerWaalsContact O-N 3.08Å; H163-T167 PolarHBondContact O-OG1 2.98Å
164	A	86.5	Confident	82	Confident	62 Å²	62	107.1 Å²	107.1	51%	0.512	54%	0.535	S	S	.	.	H	α-helix	trans	-64.2	-52.7	177.9	0	0	0	0	0	111.5	N162 Y166 T167 L168	N162-A164 VanDerWaalsContact C-N 3.33Å; N162-A164 PolarHBondContact O-N 3.2Å; A164-Y166 PolarHBondContact O-N 3.18Å; A164-T167 PolarHBondContact O-N 3.17Å; A164-T167 VanDerWaalsContact O-N 3.1Å; A164-L168 PolarHBondContact O-N 2.95Å
165	D	86.6	Confident	84	Confident	100 Å²	100	103.2 Å²	103.2	54%	0.535	51%	0.505	S	S	.	.	H	α-helix	trans	-62.7	-41.1	-177	-52.1	-45.5	0	0	0	112.1	N162 T167 S169	N162-D165 PolarHBondContact O-N 3.27Å; D165-T167 VanDerWaalsContact C-N 3.33Å; D165-S169 VanDerWaalsContact O-CB 3.23Å; D165-S169 WeakPolarHBondContact O-CB 3.38Å; D165-S169 PolarHBondContact O-N 3.39Å; D165-S169 PolarHBondContact O-OG 2.93Å
166	Y	87.9	Confident	85.8	Confident	142 Å²	142	101.6 Å²	101.6	56%	0.557	50%	0.495	S	S	*	.	H	α-helix	trans	-66.4	-35.5	175.8	-179.3	-105.5	0	0	0	112.2	N162 A164 K170	N162-Y166 WeakPolarHBondContact O-CB 3.37Å; N162-Y166 PolarHBondContact O-N 3.44Å; N162-Y166 VanDerWaalsContact O-N 3.12Å; A164-Y166 PolarHBondContact O-N 3.18Å; Y166-K170 HydrophobicContact CE1-CD 4.12Å; Y166-K170 VanDerWaalsContact CE1-CE 3.44Å; Y166-K170 PolarHBondContact O-N 2.7Å; Y166-K170 VanDerWaalsContact O-N 3.07Å; Y166-K170 WeakPolarHBondContact OH-CE 3.4Å; Y166-K170 PolarHBondContact OH-NZ 3.47Å
167	T	89.9	Confident	87	Confident	47 Å²	47	99.2 Å²	99.2	29%	0.288	48%	0.479	S	S	.	.	H	α-helix	trans	-72.3	-45.2	177.2	-61.3	0	0	0	0	111.5	H163 A164 D165 S169 K170 M171	H163-T167 VanDerWaalsContact O-CB 3.24Å; H163-T167 WeakPolarHBondContact O-CB 3.24Å; H163-T167 PolarHBondContact O-N 2.94Å; H163-T167 VanDerWaalsContact O-N 3.08Å; H163-T167 PolarHBondContact O-OG1 2.98Å; A164-T167 PolarHBondContact O-N 3.17Å; A164-T167 VanDerWaalsContact O-N 3.1Å; D165-T167 VanDerWaalsContact C-N 3.33Å; T167-S169 VanDerWaalsContact C-N 3.33Å; T167-S169 PolarHBondContact O-N 3.36Å; T167-K170 WeakPolarHBondContact O-CB 3.15Å; T167-K170 PolarHBondContact O-N 2.87Å; T167-K170 VanDerWaalsContact O-N 3.15Å; T167-M171 HydrophobicContact CG2-CE 3.88Å; T167-M171 WeakPolarHBondContact O-CG 3.43Å; T167-M171 PolarHBondContact O-N 3.38Å
168	L	90.1	Very high	88.3	Confident	69 Å²	69	99.3 Å²	99.3	36%	0.361	48%	0.478	S	S	.	.	H	α-helix	trans	-60.7	-41.3	172.1	-79.4	163.7	0	0	0	111.4	A164 K170 M171 Q172	A164-L168 PolarHBondContact O-N 2.95Å; L168-K170 VanDerWaalsContact C-N 3.3Å; L168-K170 PolarHBondContact O-N 2.6Å; L168-M171 HydrophobicContact CD2-SD 4.5Å; L168-M171 CarbonylContact O-C 3.52Å; L168-M171 PolarHBondContact O-N 3.38Å; L168-M171 VanDerWaalsContact O-N 3.13Å; L168-Q172 WeakPolarHBondContact O-CB 3.34Å; L168-Q172 PolarHBondContact O-N 3Å
169	S	90	Very high	88.6	Confident	60 Å²	60	95 Å²	95	42%	0.42	46%	0.458	S	S	.	.	H	α-helix	trans	-59.9	-36.8	174	-63.3	0	0	0	0	112.8	D165 T167 N173	D165-S169 VanDerWaalsContact O-CB 3.23Å; D165-S169 WeakPolarHBondContact O-CB 3.38Å; D165-S169 PolarHBondContact O-N 3.39Å; D165-S169 PolarHBondContact O-OG 2.93Å; T167-S169 VanDerWaalsContact C-N 3.33Å; T167-S169 PolarHBondContact O-N 3.36Å; S169-N173 PolarHBondContact O-N 3.27Å; S169-N173 VanDerWaalsContact O-N 3.13Å; S169-N173 PolarHBondContact O-ND2 2.82Å
170	K	90.4	Very high	89	Confident	90 Å²	90	94.1 Å²	94.1	39%	0.391	46%	0.458	S	S	.	.	H	α-helix	trans	-68.1	-43.9	171.8	-79.9	-177.4	175.9	173.9	0	112.3	Y166 T167 L168 Q172 N173 Y174	Y166-K170 HydrophobicContact CE1-CD 4.12Å; Y166-K170 VanDerWaalsContact CE1-CE 3.44Å; Y166-K170 PolarHBondContact O-N 2.7Å; Y166-K170 VanDerWaalsContact O-N 3.07Å; Y166-K170 WeakPolarHBondContact OH-CE 3.4Å; Y166-K170 PolarHBondContact OH-NZ 3.47Å; T167-K170 WeakPolarHBondContact O-CB 3.15Å; T167-K170 PolarHBondContact O-N 2.87Å; T167-K170 VanDerWaalsContact O-N 3.15Å; L168-K170 VanDerWaalsContact C-N 3.3Å; L168-K170 PolarHBondContact O-N 2.6Å; K170-Q172 VanDerWaalsContact C-N 3.31Å; K170-Q172 PolarHBondContact O-N 2.9Å; K170-N173 PolarHBondContact O-N 2.85Å; K170-N173 VanDerWaalsContact O-N 3.09Å; K170-Y174 PolarHBondContact O-N 2.81Å
171	M	91.8	Very high	89.2	Confident	58 Å²	58	93.2 Å²	93.2	29%	0.286	45%	0.452	S	S	.	.	H	α-helix	trans	-60.9	-39.9	175.1	-66.7	173.6	175.7	0	0	111.8	T167 L168 N173 Y174 L175 V198 Y240	T167-M171 HydrophobicContact CG2-CE 3.88Å; T167-M171 WeakPolarHBondContact O-CG 3.43Å; T167-M171 PolarHBondContact O-N 3.38Å; L168-M171 HydrophobicContact CD2-SD 4.5Å; L168-M171 CarbonylContact O-C 3.52Å; L168-M171 PolarHBondContact O-N 3.38Å; L168-M171 VanDerWaalsContact O-N 3.13Å; M171-N173 VanDerWaalsContact C-N 3.28Å; M171-N173 PolarHBondContact O-N 3.11Å; M171-Y174 PolarHBondContact O-N 3.15Å; M171-L175 PolarHBondContact O-N 2.89Å; M171-V198 HydrophobicContact SD-CG2 3.85Å; M171-Y240 HydrophobicContact CB-CD1 4.01Å; M171-Y240 HydrophobicContact CB-CE1 4.16Å
172	Q	91.5	Very high	89.6	Confident	54 Å²	54	87.9 Å²	87.9	25%	0.252	44%	0.437	S	S	.	.	H	α-helix	trans	-63.1	-33.5	174	-158.9	-143.9	23	0	0	112.1	L168 K170 L175 K176 T241	L168-Q172 WeakPolarHBondContact O-CB 3.34Å; L168-Q172 PolarHBondContact O-N 3Å; K170-Q172 VanDerWaalsContact C-N 3.31Å; K170-Q172 PolarHBondContact O-N 2.9Å; Q172-L175 WeakPolarHBondContact O-CB 3.49Å; Q172-K176 VanDerWaalsContact CD-CE 3.43Å; Q172-K176 VanDerWaalsContact O-CG 3.31Å; Q172-K176 WeakPolarHBondContact O-CG 3.3Å; Q172-K176 PolarHBondContact O-N 3.45Å; Q172-K176 VanDerWaalsContact OE1-CE 3.28Å; Q172-T241 HydrophobicContact CG-CG2 4.28Å
173	N	91.5	Very high	89.8	Confident	75 Å²	75	82.7 Å²	82.7	40%	0.401	41%	0.41	S	S	.	.	H	α-helix	trans	-74.8	-38.4	174.7	-70.8	-25.4	0	0	0	112.1	S169 K170 M171 L175 K176 E177	S169-N173 PolarHBondContact O-N 3.27Å; S169-N173 VanDerWaalsContact O-N 3.13Å; S169-N173 PolarHBondContact O-ND2 2.82Å; K170-N173 PolarHBondContact O-N 2.85Å; K170-N173 VanDerWaalsContact O-N 3.09Å; M171-N173 VanDerWaalsContact C-N 3.28Å; M171-N173 PolarHBondContact O-N 3.11Å; N173-L175 VanDerWaalsContact C-N 3.29Å; N173-L175 PolarHBondContact O-N 2.82Å; N173-K176 PolarHBondContact O-N 3.33Å; N173-K176 PolarHBondContact OD1-NZ 3.1Å; N173-E177 WeakPolarHBondContact O-CG 3.47Å; N173-E177 PolarHBondContact O-N 3.4Å
174	Y	91.6	Very high	89.9	Confident	93 Å²	93	79.1 Å²	79.1	37%	0.365	39%	0.394	S	S	.	.	H	α-helix	trans	-60.5	-38.3	171.1	-61.5	-28.5	0	0	0	112.2	K170 M171 E177 K178 K179 L180	K170-Y174 PolarHBondContact O-N 2.81Å; M171-Y174 PolarHBondContact O-N 3.15Å; Y174-E177 CarbonylContact O-C 3.48Å; Y174-E177 PolarHBondContact O-N 3.4Å; Y174-K178 WeakPolarHBondContact O-CA 3.33Å; Y174-K178 PolarHBondContact O-N 3.12Å; Y174-K179 HydrophobicContact CD1-CB 4.49Å; Y174-K179 PolarHBondContact O-N 3.45Å; Y174-L180 HydrophobicContact CD2-CD1 4.34Å; Y174-L180 HydrophobicContact CE2-CD1 4.42Å
175	L	90.8	Very high	90.2	Very high	28 Å²	28	76.1 Å²	76.1	15%	0.147	37%	0.37	C	S	.	.	H	α-helix	trans	-58.7	-49.1	172.1	-170.5	78.1	0	0	0	112.3	M171 Q172 N173 E177 K178 P193 Y240	M171-L175 PolarHBondContact O-N 2.89Å; Q172-L175 WeakPolarHBondContact O-CB 3.49Å; N173-L175 VanDerWaalsContact C-N 3.29Å; N173-L175 PolarHBondContact O-N 2.82Å; L175-E177 VanDerWaalsContact C-N 3.32Å; L175-E177 PolarHBondContact O-N 2.86Å; L175-K178 PolarHBondContact O-N 3.17Å; L175-K178 VanDerWaalsContact O-N 3.13Å; L175-P193 WeakPolarHBondContact CD1-O 3.43Å; L175-Y240 HydrophobicContact CB-CE1 4.49Å; L175-Y240 HydrophobicContact CD1-CE1 4.49Å; L175-Y240 HydrophobicContact CD1-CE2 3.87Å; L175-Y240 HydrophobicContact CD2-CD2 3.63Å; L175-Y240 HydrophobicContact CD2-CE2 3.76Å; L175-Y240 HydrophobicContact CD2-CG 4.07Å; L175-Y240 HydrophobicContact CG-CE2 4.37Å
176	K	89.6	Confident	90.4	Very high	125 Å²	125	72.5 Å²	72.5	54%	0.543	35%	0.35	S	S	.	.	H	α-helix	trans	-60.7	-40.2	177.5	-67	164.9	-158.4	162.9	0	112.1	Q172 N173 K178	Q172-K176 VanDerWaalsContact CD-CE 3.43Å; Q172-K176 VanDerWaalsContact O-CG 3.31Å; Q172-K176 WeakPolarHBondContact O-CG 3.3Å; Q172-K176 PolarHBondContact O-N 3.45Å; Q172-K176 VanDerWaalsContact OE1-CE 3.28Å; N173-K176 PolarHBondContact O-N 3.33Å; N173-K176 PolarHBondContact OD1-NZ 3.1Å; K176-K178 VanDerWaalsContact C-N 3.3Å
177	E	91.3	Very high	90.6	Very high	109 Å²	109	65.7 Å²	65.7	51%	0.509	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-3.2	178.3	-63.8	-174.3	119.8	0	0	113.8	N173 Y174 L175 K179	N173-E177 WeakPolarHBondContact O-CG 3.47Å; N173-E177 PolarHBondContact O-N 3.4Å; Y174-E177 CarbonylContact O-C 3.48Å; Y174-E177 PolarHBondContact O-N 3.4Å; L175-E177 VanDerWaalsContact C-N 3.32Å; L175-E177 PolarHBondContact O-N 2.86Å; E177-K179 HydrophobicContact CB-CD 4Å; E177-K179 HydrophobicContact CB-CG 4Å; E177-K179 PolarHBondContact O-N 3.37Å; E177-K179 IonicContact OE1-NZ 3.78Å; E177-K179 PolarHBondContact OE1-NZ 2.67Å; E177-K179 WeakPolarHBondContact OE2-CD 3.47Å; E177-K179 VanDerWaalsContact OE2-CE 3.31Å; E177-K179 WeakPolarHBondContact OE2-CE 3.35Å; E177-K179 IonicContact OE2-NZ 3.64Å; E177-K179 PolarHBondContact OE2-NZ 2.98Å
178	K	89.4	Confident	90.4	Very high	154 Å²	154	66.9 Å²	66.9	67%	0.67	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	33.4	-173.6	-54.9	-176	-178.4	-177.4	0	114	Y174 L175 K176 P193	Y174-K178 WeakPolarHBondContact O-CA 3.33Å; Y174-K178 PolarHBondContact O-N 3.12Å; L175-K178 PolarHBondContact O-N 3.17Å; L175-K178 VanDerWaalsContact O-N 3.13Å; K176-K178 VanDerWaalsContact C-N 3.3Å; K178-P193 HydrophobicContact CD-CG 4.37Å; K178-P193 HydrophobicContact CG-CG 4.24Å
179	K	87.1	Confident	90.2	Very high	102 Å²	102	70.7 Å²	70.7	44%	0.443	36%	0.361	S	S	.	.			trans	-89.4	143.9	174.2	-65.9	174.7	-172.2	161.8	0	109.3	Y174 E177 C181 H195	Y174-K179 HydrophobicContact CD1-CB 4.49Å; Y174-K179 PolarHBondContact O-N 3.45Å; E177-K179 HydrophobicContact CB-CD 4Å; E177-K179 HydrophobicContact CB-CG 4Å; E177-K179 PolarHBondContact O-N 3.37Å; E177-K179 IonicContact OE1-NZ 3.78Å; E177-K179 PolarHBondContact OE1-NZ 2.67Å; E177-K179 WeakPolarHBondContact OE2-CD 3.47Å; E177-K179 VanDerWaalsContact OE2-CE 3.31Å; E177-K179 WeakPolarHBondContact OE2-CE 3.35Å; E177-K179 IonicContact OE2-NZ 3.64Å; E177-K179 PolarHBondContact OE2-NZ 2.98Å; K179-C181 PolarHBondContact O-N 2.99Å; K179-C181 PolarHBondContact O-SG 3.02Å; K179-H195 PolarHBondContact O-NE2 3.1Å; K179-H195 VanDerWaalsContact O-NE2 3.13Å
180	L	88.1	Confident	90.3	Very high	134 Å²	134	70.5 Å²	70.5	70%	0.702	36%	0.355	S	S	*	.	S	Bend	trans	57.2	11	174.8	-53.5	177.9	0	0	0	116.6	Y174 D182 H195	Y174-L180 HydrophobicContact CD2-CD1 4.34Å; Y174-L180 HydrophobicContact CE2-CD1 4.42Å; L180-D182 PolarHBondContact O-N 3.34Å; L180-H195 PolarHBondContact O-CD2 3.19Å
181	C	89.2	Confident	90.4	Very high	36 Å²	36	71.7 Å²	71.7	24%	0.243	36%	0.36	C	S	.	.			trans	-70	125.8	174.4	-58.2	0	0	0	0	109.9	K179 P193 A194 H195	K179-C181 PolarHBondContact O-N 2.99Å; K179-C181 PolarHBondContact O-SG 3.02Å; C181-P193 HydrophobicContact CB-CB 4.16Å; C181-A194 VanDerWaalsContact CA-O 3.27Å; C181-A194 WeakPolarHBondContact CA-O 3.46Å; C181-A194 WeakPolarHBondContact CB-O 3.38Å; C181-H195 PolarHBondContact SG-CE1 3.03Å
182	D	90.4	Very high	90.5	Very high	76 Å²	76	69.5 Å²	69.5	41%	0.406	35%	0.349	S	S	.	.			trans	-119.5	8.3	-172	63.9	-10.8	0	0	0	112.9	L180 A194 H195 R196	L180-D182 PolarHBondContact O-N 3.34Å; D182-A194 PolarHBondContact N-O 3.01Å; D182-H195 VanDerWaalsContact OD1-CA 3.22Å; D182-H195 WeakPolarHBondContact OD1-CA 3.44Å; D182-R196 PolarHBondContact O-NE 3.45Å; D182-R196 VanDerWaalsContact O-NE 3.12Å; D182-R196 WeakPolarHBondContact OD1-CG 3.29Å; D182-R196 PolarHBondContact OD1-N 3.32Å; D182-R196 WeakPolarHBondContact OD2-CD 3.41Å
183	V	91.4	Very high	90.6	Very high	4 Å²	4	68.3 Å²	68.3	2%	0.024	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	145.2	168.7	64.7	0	0	0	0	111.1	L185 A194 R196 L199 F210 V222	V183-L185 HydrophobicContact CG2-CD2 4.1Å; V183-A194 HydrophobicContact CG1-CB 4.05Å; V183-A194 PolarHBondContact N-O 3.46Å; V183-A194 PolarHBondContact O-N 3.07Å; V183-R196 HydrophobicContact CB-CG 3.79Å; V183-R196 HydrophobicContact CG1-CG 3.73Å; V183-L199 HydrophobicContact CG1-CD1 4.21Å; V183-F210 HydrophobicContact CG1-CZ 4.38Å; V183-F210 HydrophobicContact CG2-CE1 4.44Å; V183-F210 HydrophobicContact CG2-CZ 4.15Å; V183-V222 HydrophobicContact CG2-CB 4.33Å; V183-V222 HydrophobicContact CG2-CG2 3.86Å
184	L	92.5	Very high	90.7	Very high	43 Å²	43	64.7 Å²	64.7	23%	0.225	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	102.7	175.5	-170.8	60.3	0	0	0	109.2	K191 P193 E220 E221 V222	L184-K191 HydrophobicContact CD1-CB 4.07Å; L184-K191 HydrophobicContact CD2-CB 4.49Å; L184-K191 HydrophobicContact CD2-CD 4.05Å; L184-K191 HydrophobicContact CG-CB 4.32Å; L184-P193 HydrophobicContact CD1-CB 4.03Å; L184-E220 PolarHBondContact N-O 3.13Å; L184-E221 HydrophobicContact CD2-CG 4.28Å; L184-E221 WeakPolarHBondContact O-CA 3.33Å; L184-V222 PolarHBondContact O-N 2.87Å
185	L	92.5	Very high	90.8	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	133.1	177	-58	-178.5	0	0	0	110	V183 K191 I192 L199 F206 V222 L232 V236	V183-L185 HydrophobicContact CG2-CD2 4.1Å; L185-K191 WeakPolarHBondContact O-CA 3.4Å; L185-I192 HydrophobicContact CB-CB 4.4Å; L185-I192 PolarHBondContact N-O 2.89Å; L185-I192 PolarHBondContact O-N 3.32Å; L185-L199 HydrophobicContact CD1-CD1 3.95Å; L185-F206 HydrophobicContact CD1-CE1 4.29Å; L185-F206 HydrophobicContact CD1-CZ 3.8Å; L185-F206 HydrophobicContact CD2-CE1 4.1Å; L185-F206 HydrophobicContact CD2-CZ 4.42Å; L185-V222 CarbonylContact C-O 3.58Å; L185-V222 WeakPolarHBondContact CA-O 3.36Å; L185-V222 HydrophobicContact CD2-CB 4.12Å; L185-V222 HydrophobicContact CD2-CG1 4.38Å; L185-L232 HydrophobicContact CB-CD2 4.28Å; L185-L232 HydrophobicContact CD1-CD1 4.34Å; L185-L232 HydrophobicContact CD1-CD2 4.44Å; L185-V236 HydrophobicContact CD1-CG2 3.89Å
186	I	91.6	Very high	90.8	Very high	23 Å²	23	61.5 Å²	61.5	12%	0.118	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	111.4	179.8	-54.1	-177.3	0	0	0	109.1	L190 K191 E221 V222 R223 M224	I186-L190 WeakPolarHBondContact CA-O 3.38Å; I186-K191 HydrophobicContact CD1-CD 4.38Å; I186-K191 HydrophobicContact CG1-CG 4.2Å; I186-E221 HydrophobicContact CD1-CB 3.92Å; I186-E221 HydrophobicContact CD1-CG 4.22Å; I186-E221 WeakPolarHBondContact CD1-OE2 3.33Å; I186-V222 PolarHBondContact N-O 3.24Å; I186-R223 HydrophobicContact CB-CG 4.32Å; I186-M224 PolarHBondContact O-N 3.44Å
187	A	90.8	Very high	90.9	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	111.6	171.7	0	0	0	0	0	109.4	H189 L190 M224 P229 L232	A187-H189 PolarHBondContact O-N 3.07Å; A187-L190 PolarHBondContact N-O 3.42Å; A187-L190 VanDerWaalsContact N-O 3.11Å; A187-L190 PolarHBondContact O-N 3.3Å; A187-M224 HydrophobicContact CB-CB 4.42Å; A187-P229 HydrophobicContact CB-CB 4.24Å; A187-P229 HydrophobicContact CB-CG 4.34Å; A187-P229 WeakPolarHBondContact O-CB 3.42Å; A187-P229 WeakPolarHBondContact O-CG 3.43Å; A187-L232 HydrophobicContact CB-CB 4.5Å; A187-L232 HydrophobicContact CB-CD2 3.61Å
188	G	86.5	Confident	90.9	Very high	72 Å²	72	57.1 Å²	57.1	74%	0.742	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	-100.5	-176.9	0	0	0	0	0	112.8
189	H	86.5	Confident	91.1	Very high	149 Å²	149	50 Å²	50	69%	0.69	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-9.8	-178.6	68.8	-86.6	0	0	0	114.3	A187	A187-H189 PolarHBondContact O-N 3.07Å
190	L	91.4	Very high	91.3	Very high	56 Å²	56	46.5 Å²	46.5	29%	0.293	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	135.2	178.1	-74.1	175.6	0	0	0	111	I186 A187 I192 P229	I186-L190 WeakPolarHBondContact CA-O 3.38Å; A187-L190 PolarHBondContact N-O 3.42Å; A187-L190 VanDerWaalsContact N-O 3.11Å; A187-L190 PolarHBondContact O-N 3.3Å; L190-I192 HydrophobicContact CB-CG1 4.34Å; L190-P229 HydrophobicContact CB-CB 4.15Å; L190-P229 HydrophobicContact CD1-CB 3.73Å; L190-P229 HydrophobicContact CG-CB 4.09Å
191	K	92.4	Very high	91.5	Very high	115 Å²	115	44 Å²	44	50%	0.5	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	111.1	168.6	-65.2	-159.4	168.4	-161.4	0	108.8	L184 L185 I186 E221	L184-K191 HydrophobicContact CD1-CB 4.07Å; L184-K191 HydrophobicContact CD2-CB 4.49Å; L184-K191 HydrophobicContact CD2-CD 4.05Å; L184-K191 HydrophobicContact CG-CB 4.32Å; L185-K191 WeakPolarHBondContact O-CA 3.4Å; I186-K191 HydrophobicContact CD1-CD 4.38Å; I186-K191 HydrophobicContact CG1-CG 4.2Å; K191-E221 IonicContact NZ-OE1 3.42Å; K191-E221 PolarHBondContact NZ-OE1 3.04Å; K191-E221 IonicContact NZ-OE2 3.43Å
192	I	93.6	Very high	91.7	Very high	11 Å²	11	45 Å²	45	6%	0.056	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	104.1	-172.2	-56.6	161	0	0	0	107.9	L185 L190 L232 N233 V236	L185-I192 HydrophobicContact CB-CB 4.4Å; L185-I192 PolarHBondContact N-O 2.89Å; L185-I192 PolarHBondContact O-N 3.32Å; L190-I192 HydrophobicContact CB-CG1 4.34Å; I192-L232 HydrophobicContact CD1-CB 4.21Å; I192-L232 HydrophobicContact CD1-CD2 3.92Å; I192-L232 HydrophobicContact CD1-CG 3.88Å; I192-N233 HydrophobicContact CD1-CB 3.82Å; I192-N233 HydrophobicContact CG1-CB 4.35Å; I192-V236 HydrophobicContact CG2-CB 4.22Å; I192-V236 HydrophobicContact CG2-CG1 3.92Å; I192-V236 HydrophobicContact CG2-CG2 4.24Å
193	P	93.5	Very high	91.9	Very high	29 Å²	29	41.6 Å²	41.6	19%	0.188	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	143.5	173.5	30.2	-33.8	0	0	0	109.3	L175 K178 C181 L184	L175-P193 WeakPolarHBondContact CD1-O 3.43Å; K178-P193 HydrophobicContact CD-CG 4.37Å; K178-P193 HydrophobicContact CG-CG 4.24Å; C181-P193 HydrophobicContact CB-CB 4.16Å; L184-P193 HydrophobicContact CD1-CB 4.03Å
194	A	94.3	Very high	91.9	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	179.4	178.1	0	0	0	0	0	111.4	C181 D182 V183 L199 V236	C181-A194 VanDerWaalsContact CA-O 3.27Å; C181-A194 WeakPolarHBondContact CA-O 3.46Å; C181-A194 WeakPolarHBondContact CB-O 3.38Å; D182-A194 PolarHBondContact N-O 3.01Å; V183-A194 HydrophobicContact CG1-CB 4.05Å; V183-A194 PolarHBondContact N-O 3.46Å; V183-A194 PolarHBondContact O-N 3.07Å; A194-L199 HydrophobicContact CB-CD1 3.69Å; A194-L199 HydrophobicContact CB-CG 4.19Å; A194-V236 HydrophobicContact CB-CG1 4.28Å
195	H	93.7	Very high	91.8	Very high	20 Å²	20	47.8 Å²	47.8	9%	0.093	27%	0.271	C	S	.	.			trans	-116.5	121.5	174.8	-55	72	0	0	0	109	K179 L180 C181 D182 L197 V198 L199 Y240	K179-H195 PolarHBondContact O-NE2 3.1Å; K179-H195 VanDerWaalsContact O-NE2 3.13Å; L180-H195 PolarHBondContact O-CD2 3.19Å; C181-H195 PolarHBondContact SG-CE1 3.03Å; D182-H195 VanDerWaalsContact OD1-CA 3.22Å; D182-H195 WeakPolarHBondContact OD1-CA 3.44Å; H195-L197 VanDerWaalsContact C-N 3.29Å; H195-L197 PolarHBondContact O-N 2.84Å; H195-V198 HydrophobicContact CB-CB 4.47Å; H195-V198 HydrophobicContact CB-CG2 4.18Å; H195-V198 PolarHBondContact O-N 3.18Å; H195-L199 PolarHBondContact O-N 3.06Å; H195-L199 VanDerWaalsContact O-N 3.15Å; H195-Y240 VanDerWaalsContact CB-OH 3.28Å; H195-Y240 WeakPolarHBondContact CB-OH 3.22Å; H195-Y240 PolarHBondContact N-OH 3.3Å; H195-Y240 AromaticContact ND1-CE1 3.79Å; H195-Y240 AromaticContact ND1-CZ 3.69Å; H195-Y240 PolarHBondContact ND1-OH 3.1Å
196	R	91.3	Very high	91.8	Very high	33 Å²	33	48 Å²	48	13%	0.125	27%	0.272	C	S	.	.	H	α-helix	trans	-52	-47.1	-177.7	-70.8	165.2	161.2	-96.1	-6.4	111.7	D182 V183 V198 L199 S200 F210 E216 A217 Q219	D182-R196 PolarHBondContact O-NE 3.45Å; D182-R196 VanDerWaalsContact O-NE 3.12Å; D182-R196 WeakPolarHBondContact OD1-CG 3.29Å; D182-R196 PolarHBondContact OD1-N 3.32Å; D182-R196 WeakPolarHBondContact OD2-CD 3.41Å; V183-R196 HydrophobicContact CB-CG 3.79Å; V183-R196 HydrophobicContact CG1-CG 3.73Å; R196-V198 VanDerWaalsContact C-N 3.32Å; R196-V198 PolarHBondContact O-N 3.17Å; R196-L199 PolarHBondContact O-N 3.14Å; R196-S200 WeakPolarHBondContact O-CB 3.26Å; R196-S200 PolarHBondContact O-N 3.14Å; R196-S200 PolarHBondContact O-OG 2.94Å; R196-S200 VanDerWaalsContact O-OG 3.13Å; R196-F210 HydrophobicContact CB-CD2 3.7Å; R196-F210 HydrophobicContact CB-CE2 4.11Å; R196-F210 HydrophobicContact CB-CG 4.25Å; R196-F210 HydrophobicContact CG-CD1 4.46Å; R196-F210 HydrophobicContact CG-CD2 3.79Å; R196-F210 HydrophobicContact CG-CE2 3.89Å; R196-F210 HydrophobicContact CG-CG 4.12Å; R196-F210 HydrophobicContact CG-CZ 4.27Å; R196-F210 VanDerWaalsContact NH1-CD1 3.26Å; R196-E216 PolarHBondContact NH2-O 2.91Å; R196-A217 PolarHBondContact NH1-O 2.83Å; R196-A217 PolarHBondContact NH2-O 3.35Å; R196-Q219 PolarHBondContact NH2-O 2.94Å
197	L	90.7	Very high	91.7	Very high	130 Å²	130	48 Å²	48	68%	0.681	28%	0.275	S	S	*	.	H	α-helix	trans	-55.2	-42.3	178.5	179.8	62.9	0	0	0	113.2	H195 A201	H195-L197 VanDerWaalsContact C-N 3.29Å; H195-L197 PolarHBondContact O-N 2.84Å; L197-A201 VanDerWaalsContact O-CB 3.28Å; L197-A201 WeakPolarHBondContact O-CB 3.47Å; L197-A201 PolarHBondContact O-N 2.79Å
198	V	92.6	Very high	91.6	Very high	12 Å²	12	50.2 Å²	50.2	7%	0.073	29%	0.293	C	S	.	.	H	α-helix	trans	-74.9	-39.1	-178.1	-179.7	0	0	0	0	110.8	M171 H195 R196 A201 V202 A239 Y240	M171-V198 HydrophobicContact SD-CG2 3.85Å; H195-V198 HydrophobicContact CB-CB 4.47Å; H195-V198 HydrophobicContact CB-CG2 4.18Å; H195-V198 PolarHBondContact O-N 3.18Å; R196-V198 VanDerWaalsContact C-N 3.32Å; R196-V198 PolarHBondContact O-N 3.17Å; V198-A201 PolarHBondContact O-N 2.95Å; V198-V202 WeakPolarHBondContact O-CG2 3.5Å; V198-V202 PolarHBondContact O-N 3.29Å; V198-A239 HydrophobicContact CG1-CB 4.4Å; V198-A239 WeakPolarHBondContact CG1-O 3.44Å; V198-Y240 HydrophobicContact CB-CE1 3.9Å; V198-Y240 HydrophobicContact CG1-CD1 3.98Å; V198-Y240 HydrophobicContact CG1-CD2 4.4Å; V198-Y240 HydrophobicContact CG1-CE1 3.72Å; V198-Y240 HydrophobicContact CG1-CE2 4.15Å; V198-Y240 HydrophobicContact CG1-CG 4.3Å; V198-Y240 HydrophobicContact CG2-CD1 4.49Å; V198-Y240 HydrophobicContact CG2-CE1 3.76Å
199	L	92.9	Very high	91.7	Very high	5 Å²	5	47.9 Å²	47.9	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-64.6	-46.7	175.4	-66.3	-178.9	0	0	0	111.6	V183 L185 A194 H195 R196 A201 V202 S203 F206 F210 V236	V183-L199 HydrophobicContact CG1-CD1 4.21Å; L185-L199 HydrophobicContact CD1-CD1 3.95Å; A194-L199 HydrophobicContact CB-CD1 3.69Å; A194-L199 HydrophobicContact CB-CG 4.19Å; H195-L199 PolarHBondContact O-N 3.06Å; H195-L199 VanDerWaalsContact O-N 3.15Å; R196-L199 PolarHBondContact O-N 3.14Å; L199-A201 VanDerWaalsContact C-N 3.26Å; L199-A201 PolarHBondContact O-N 3.46Å; L199-V202 PolarHBondContact O-N 3.07Å; L199-S203 WeakPolarHBondContact O-CB 3.21Å; L199-S203 PolarHBondContact O-N 3.13Å; L199-F206 HydrophobicContact CB-CB 3.88Å; L199-F206 HydrophobicContact CB-CD2 3.77Å; L199-F206 HydrophobicContact CB-CE2 4.46Å; L199-F206 HydrophobicContact CB-CG 3.88Å; L199-F206 HydrophobicContact CD1-CD2 4.33Å; L199-F206 HydrophobicContact CD1-CE2 4.29Å; L199-F206 HydrophobicContact CD1-CG 4.46Å; L199-F206 HydrophobicContact CD1-CZ 4.4Å; L199-F206 HydrophobicContact CD2-CD2 4.24Å; L199-F206 HydrophobicContact CD2-CE2 4.19Å; L199-F206 HydrophobicContact CG-CD2 4.34Å; L199-F210 HydrophobicContact CB-CE2 4.17Å; L199-F210 HydrophobicContact CD1-CE2 4.13Å; L199-V236 HydrophobicContact CD2-CG2 4.24Å
200	S	92.1	Very high	91.7	Very high	29 Å²	29	42 Å²	42	20%	0.203	24%	0.235	C	C	.	.	H	α-helix	trans	-67.2	-21.9	176.5	-59.2	0	0	0	0	114	R196 V202 F206 F210	R196-S200 WeakPolarHBondContact O-CB 3.26Å; R196-S200 PolarHBondContact O-N 3.14Å; R196-S200 PolarHBondContact O-OG 2.94Å; R196-S200 VanDerWaalsContact O-OG 3.13Å; S200-V202 VanDerWaalsContact C-N 3.34Å; S200-F206 PolarHBondContact OG-O 2.8Å; S200-F210 WeakPolarHBondContact OG-CD2 3.46Å
201	A	91.8	Very high	91.4	Very high	81 Å²	81	44.5 Å²	44.5	67%	0.669	25%	0.254	S	S	*	.	H	α-helix	trans	-79.5	-15.4	174.7	0	0	0	0	0	113.7	L197 V198 L199	L197-A201 VanDerWaalsContact O-CB 3.28Å; L197-A201 WeakPolarHBondContact O-CB 3.47Å; L197-A201 PolarHBondContact O-N 2.79Å; V198-A201 PolarHBondContact O-N 2.95Å; L199-A201 VanDerWaalsContact C-N 3.26Å; L199-A201 PolarHBondContact O-N 3.46Å
202	V	92.5	Very high	90.9	Very high	57 Å²	57	43.4 Å²	43.4	35%	0.345	25%	0.253	S	S	.	.	H	α-helix	trans	-116.6	-19.2	-174.6	179.8	0	0	0	0	112.5	V198 L199 S200 Y238 A239 L263	V198-V202 WeakPolarHBondContact O-CG2 3.5Å; V198-V202 PolarHBondContact O-N 3.29Å; L199-V202 PolarHBondContact O-N 3.07Å; S200-V202 VanDerWaalsContact C-N 3.34Å; V202-Y238 HydrophobicContact CG1-CE1 4.04Å; V202-A239 HydrophobicContact CB-CB 4.16Å; V202-A239 HydrophobicContact CG1-CB 4.08Å; V202-A239 HydrophobicContact CG2-CB 4.1Å; V202-L263 HydrophobicContact CG1-CD2 3.93Å; V202-L263 WeakPolarHBondContact O-CD2 3.28Å
203	S	94.9	Very high	89.9	Confident	4 Å²	4	49.1 Å²	49.1	3%	0.028	28%	0.284	C	S	.	.			trans	-135.8	121.1	-175	166.5	0	0	0	0	111.5	L199 Y205 F206 A207 L261	L199-S203 WeakPolarHBondContact O-CB 3.21Å; L199-S203 PolarHBondContact O-N 3.13Å; S203-Y205 PolarHBondContact O-N 3.06Å; S203-Y205 PolarHBondContact OG-N 3.09Å; S203-F206 PolarHBondContact O-N 3.37Å; S203-F206 PolarHBondContact OG-N 3Å; S203-F206 VanDerWaalsContact OG-N 3.15Å; S203-A207 PolarHBondContact O-N 2.99Å; S203-L261 WeakPolarHBondContact CB-O 3.26Å; S203-L261 PolarHBondContact OG-O 2.99Å
204	D	91.4	Very high	89.1	Confident	111 Å²	111	50.4 Å²	50.4	59%	0.594	29%	0.291	S	S	*	.	H	α-helix	trans	-62.3	-31.3	173.7	-71.7	-43.7	0	0	0	112.1	A207 A208 Q262	D204-A207 PolarHBondContact O-N 2.66Å; D204-A208 WeakPolarHBondContact O-CB 3.34Å; D204-A208 PolarHBondContact O-N 3.31Å; D204-Q262 HydrophobicContact CB-CB 4.48Å
205	Y	91.6	Very high	87.9	Confident	67 Å²	67	56.7 Å²	56.7	26%	0.263	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-48.5	173	176.6	-89.1	0	0	0	111.7	S203 A208 M209 M224 L260 L261	S203-Y205 PolarHBondContact O-N 3.06Å; S203-Y205 PolarHBondContact OG-N 3.09Å; Y205-A208 PolarHBondContact O-N 2.88Å; Y205-M209 HydrophobicContact CE1-CE 3.48Å; Y205-M209 VanDerWaalsContact CE1-CE 3.48Å; Y205-M209 WeakPolarHBondContact O-CB 3.27Å; Y205-M209 PolarHBondContact O-N 3.24Å; Y205-M209 VanDerWaalsContact OH-CE 3.3Å; Y205-M209 WeakPolarHBondContact OH-CE 3.28Å; Y205-M224 HydrophobicContact CE1-CE 3.91Å; Y205-L260 WeakPolarHBondContact CD2-O 3.37Å; Y205-L261 HydrophobicContact CD1-CD2 3.58Å; Y205-L261 HydrophobicContact CE1-CD2 3.85Å; Y205-L261 HydrophobicContact CG-CD2 4.34Å
206	F	91.6	Very high	86.8	Confident	5 Å²	5	59 Å²	59	2%	0.022	34%	0.335	C	S	.	.	H	α-helix	trans	-73.6	-26.7	175.7	-71.9	-54.2	0	0	0	112.9	L185 L199 S200 S203 M209 F210 M224 L261	L185-F206 HydrophobicContact CD1-CE1 4.29Å; L185-F206 HydrophobicContact CD1-CZ 3.8Å; L185-F206 HydrophobicContact CD2-CE1 4.1Å; L185-F206 HydrophobicContact CD2-CZ 4.42Å; L199-F206 HydrophobicContact CB-CB 3.88Å; L199-F206 HydrophobicContact CB-CD2 3.77Å; L199-F206 HydrophobicContact CB-CE2 4.46Å; L199-F206 HydrophobicContact CB-CG 3.88Å; L199-F206 HydrophobicContact CD1-CD2 4.33Å; L199-F206 HydrophobicContact CD1-CE2 4.29Å; L199-F206 HydrophobicContact CD1-CG 4.46Å; L199-F206 HydrophobicContact CD1-CZ 4.4Å; L199-F206 HydrophobicContact CD2-CD2 4.24Å; L199-F206 HydrophobicContact CD2-CE2 4.19Å; L199-F206 HydrophobicContact CG-CD2 4.34Å; S200-F206 PolarHBondContact OG-O 2.8Å; S203-F206 PolarHBondContact O-N 3.37Å; S203-F206 PolarHBondContact OG-N 3Å; S203-F206 VanDerWaalsContact OG-N 3.15Å; F206-M209 HydrophobicContact CD1-SD 4.21Å; F206-M209 HydrophobicContact CE1-SD 4.42Å; F206-F210 HydrophobicContact CB-CD2 4.27Å; F206-F210 HydrophobicContact CB-CE2 4.02Å; F206-F210 AromaticContact CD1-CE2 3.84Å; F206-F210 HydrophobicContact CD1-CE2 3.84Å; F206-F210 AromaticContact CD1-CZ 3.77Å; F206-F210 HydrophobicContact CD1-CZ 3.77Å; F206-F210 HydrophobicContact CE1-CZ 4.33Å; F206-F210 HydrophobicContact CG-CE2 4.19Å; F206-F210 WeakPolarHBondContact O-CB 3.43Å; F206-F210 VanDerWaalsContact O-CD2 3.31Å; F206-F210 WeakPolarHBondContact O-CD2 3.44Å; F206-F210 WeakPolarHBondContact O-CG 3.39Å; F206-F210 PolarHBondContact O-N 3.34Å; F206-F210 VanDerWaalsContact O-N 3.1Å; F206-M224 HydrophobicContact CE1-SD 4.33Å; F206-L261 HydrophobicContact CD2-CD2 4.34Å; F206-L261 HydrophobicContact CE1-CD2 4.25Å; F206-L261 HydrophobicContact CE2-CD1 4.06Å; F206-L261 HydrophobicContact CE2-CD2 3.61Å; F206-L261 HydrophobicContact CE2-CG 4.37Å; F206-L261 HydrophobicContact CZ-CD1 4.41Å; F206-L261 HydrophobicContact CZ-CD2 3.55Å
207	A	90.3	Very high	85.9	Confident	22 Å²	22	58.4 Å²	58.4	18%	0.182	34%	0.337	C	S	.	.	H	α-helix	trans	-61.8	-52.4	168.5	0	0	0	0	0	110.1	S203 D204 M209 F210 T211	S203-A207 PolarHBondContact O-N 2.99Å; D204-A207 PolarHBondContact O-N 2.66Å; A207-M209 VanDerWaalsContact C-N 3.34Å; A207-M209 PolarHBondContact O-N 3.2Å; A207-F210 PolarHBondContact O-N 3.37Å; A207-T211 WeakPolarHBondContact O-CB 3.18Å; A207-T211 WeakPolarHBondContact O-CG2 3.46Å; A207-T211 PolarHBondContact O-N 3.41Å; A207-T211 PolarHBondContact O-OG1 3.48Å
208	A	88.2	Confident	85.2	Confident	46 Å²	46	61.6 Å²	61.6	38%	0.38	34%	0.34	S	S	.	.	H	α-helix	trans	-62.3	-39.2	179	0	0	0	0	0	112.5	D204 Y205 N212	D204-A208 WeakPolarHBondContact O-CB 3.34Å; D204-A208 PolarHBondContact O-N 3.31Å; Y205-A208 PolarHBondContact O-N 2.88Å; A208-N212 WeakPolarHBondContact CA-ND2 3.24Å; A208-N212 WeakPolarHBondContact O-CB 3.3Å; A208-N212 PolarHBondContact O-N 3.06Å; A208-N212 PolarHBondContact O-ND2 3.46Å
209	M	87.9	Confident	84.7	Confident	23 Å²	23	64.9 Å²	64.9	11%	0.113	35%	0.354	C	S	.	.	H	α-helix	trans	-67.7	-35.7	178.3	-176.8	-177.7	-80.1	0	0	113.6	Y205 F206 A207 V214 E216 A217 V222	Y205-M209 HydrophobicContact CE1-CE 3.48Å; Y205-M209 VanDerWaalsContact CE1-CE 3.48Å; Y205-M209 WeakPolarHBondContact O-CB 3.27Å; Y205-M209 PolarHBondContact O-N 3.24Å; Y205-M209 VanDerWaalsContact OH-CE 3.3Å; Y205-M209 WeakPolarHBondContact OH-CE 3.28Å; F206-M209 HydrophobicContact CD1-SD 4.21Å; F206-M209 HydrophobicContact CE1-SD 4.42Å; A207-M209 VanDerWaalsContact C-N 3.34Å; A207-M209 PolarHBondContact O-N 3.2Å; M209-V214 WeakPolarHBondContact O-CG2 3.41Å; M209-E216 HydrophobicContact CG-CB 3.85Å; M209-E216 HydrophobicContact SD-CB 4.21Å; M209-A217 WeakPolarHBondContact O-CB 3.43Å; M209-V222 HydrophobicContact CE-CG1 4.34Å; M209-V222 HydrophobicContact SD-CG1 3.86Å
210	F	87.9	Confident	84.2	Confident	25 Å²	25	72.1 Å²	72.1	11%	0.11	39%	0.388	C	S	.	.	H	α-helix	trans	-101.5	-13.7	-173.2	-57.9	-30.1	0	0	0	114.8	V183 R196 L199 S200 F206 A207	V183-F210 HydrophobicContact CG1-CZ 4.38Å; V183-F210 HydrophobicContact CG2-CE1 4.44Å; V183-F210 HydrophobicContact CG2-CZ 4.15Å; R196-F210 HydrophobicContact CB-CD2 3.7Å; R196-F210 HydrophobicContact CB-CE2 4.11Å; R196-F210 HydrophobicContact CB-CG 4.25Å; R196-F210 HydrophobicContact CG-CD1 4.46Å; R196-F210 HydrophobicContact CG-CD2 3.79Å; R196-F210 HydrophobicContact CG-CE2 3.89Å; R196-F210 HydrophobicContact CG-CG 4.12Å; R196-F210 HydrophobicContact CG-CZ 4.27Å; R196-F210 VanDerWaalsContact NH1-CD1 3.26Å; L199-F210 HydrophobicContact CB-CE2 4.17Å; L199-F210 HydrophobicContact CD1-CE2 4.13Å; S200-F210 WeakPolarHBondContact OG-CD2 3.46Å; F206-F210 HydrophobicContact CB-CD2 4.27Å; F206-F210 HydrophobicContact CB-CE2 4.02Å; F206-F210 AromaticContact CD1-CE2 3.84Å; F206-F210 HydrophobicContact CD1-CE2 3.84Å; F206-F210 AromaticContact CD1-CZ 3.77Å; F206-F210 HydrophobicContact CD1-CZ 3.77Å; F206-F210 HydrophobicContact CE1-CZ 4.33Å; F206-F210 HydrophobicContact CG-CE2 4.19Å; F206-F210 WeakPolarHBondContact O-CB 3.43Å; F206-F210 VanDerWaalsContact O-CD2 3.31Å; F206-F210 WeakPolarHBondContact O-CD2 3.44Å; F206-F210 WeakPolarHBondContact O-CG 3.39Å; F206-F210 PolarHBondContact O-N 3.34Å; F206-F210 VanDerWaalsContact O-N 3.1Å; A207-F210 PolarHBondContact O-N 3.37Å
211	T	84.6	Confident	84.1	Confident	110 Å²	110	74.4 Å²	74.4	68%	0.675	40%	0.396	S	S	*	.	H	α-helix	trans	-104.5	-22.8	178.5	63.1	0	0	0	0	114.9	A207	A207-T211 WeakPolarHBondContact O-CB 3.18Å; A207-T211 WeakPolarHBondContact O-CG2 3.46Å; A207-T211 PolarHBondContact O-N 3.41Å; A207-T211 PolarHBondContact O-OG1 3.48Å
212	N	80.9	Confident	84	Confident	91 Å²	91	70.7 Å²	70.7	49%	0.487	37%	0.365	S	S	.	.	S	Bend	trans	-86.6	161.9	174	-66.5	-64.8	0	0	0	111.7	A208 V214 A217	A208-N212 WeakPolarHBondContact CA-ND2 3.24Å; A208-N212 WeakPolarHBondContact O-CB 3.3Å; A208-N212 PolarHBondContact O-N 3.06Å; A208-N212 PolarHBondContact O-ND2 3.46Å; N212-V214 HydrophobicContact CB-CG1 4.42Å; N212-V214 PolarHBondContact O-N 2.91Å; N212-A217 VanDerWaalsContact O-CB 3.3Å; N212-A217 WeakPolarHBondContact O-CB 3.4Å
213	D	72.6	Confident	83.8	Confident	131 Å²	131	76.7 Å²	76.7	70%	0.701	38%	0.381	S	S	*	.	S	Bend	trans	-82.1	48.4	-174.4	-138.8	2.4	0	0	0	113.5	R218	D213-R218 IonicContact OD1-CZ 3.08Å; D213-R218 IonicContact OD1-NE 2.71Å; D213-R218 PolarHBondContact OD1-NE 3.15Å; D213-R218 IonicContact OD1-NH2 3.47Å; D213-R218 PolarHBondContact OD1-NH2 3.2Å; D213-R218 IonicContact OD2-NH2 2.8Å; D213-R218 PolarHBondContact OD2-NH2 3.42Å
214	V	77.4	Confident	83.5	Confident	57 Å²	57	76.9 Å²	76.9	35%	0.345	38%	0.382	S	S	.	.			trans	-89.9	164.2	176.2	-60	0	0	0	0	111.3	M209 N212 E216 A217	M209-V214 WeakPolarHBondContact O-CG2 3.41Å; N212-V214 HydrophobicContact CB-CG1 4.42Å; N212-V214 PolarHBondContact O-N 2.91Å; V214-E216 VanDerWaalsContact C-N 3.32Å; V214-E216 HydrophobicContact CG2-CB 4.36Å; V214-E216 PolarHBondContact O-N 3.2Å; V214-A217 HydrophobicContact CG2-CB 4.04Å; V214-A217 VanDerWaalsContact O-CB 3.32Å; V214-A217 WeakPolarHBondContact O-CB 3.45Å; V214-A217 PolarHBondContact O-N 3.48Å
215	L	68.2	Low	83.1	Confident	131 Å²	131	79.5 Å²	79.5	69%	0.686	39%	0.39	S	S	*	.	S	Bend	trans	-67.4	-36.8	-174.2	-65.9	174.5	0	0	0	111.7	A217 R218 Q219	L215-A217 VanDerWaalsContact C-N 3.25Å; L215-A217 PolarHBondContact O-N 2.63Å; L215-R218 PolarHBondContact O-N 2.88Å; L215-R218 VanDerWaalsContact O-N 3.1Å; L215-Q219 WeakPolarHBondContact O-CG 3.25Å
216	E	72.5	Confident	82.7	Confident	70 Å²	70	80.7 Å²	80.7	33%	0.327	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-64.2	-29.8	179.5	-60.9	67.6	-149.3	0	0	111.5	R196 M209 V214 R218 Q219	R196-E216 PolarHBondContact NH2-O 2.91Å; M209-E216 HydrophobicContact CG-CB 3.85Å; M209-E216 HydrophobicContact SD-CB 4.21Å; V214-E216 VanDerWaalsContact C-N 3.32Å; V214-E216 HydrophobicContact CG2-CB 4.36Å; V214-E216 PolarHBondContact O-N 3.2Å; E216-R218 PolarHBondContact O-N 2.84Å; E216-R218 VanDerWaalsContact O-N 3.12Å; E216-Q219 PolarHBondContact O-N 3.47Å
217	A	71.9	Confident	82.7	Confident	20 Å²	20	81.1 Å²	81.1	17%	0.165	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-59.8	-24.5	174.6	0	0	0	0	0	112	R196 M209 N212 V214 L215	R196-A217 PolarHBondContact NH1-O 2.83Å; R196-A217 PolarHBondContact NH2-O 3.35Å; M209-A217 WeakPolarHBondContact O-CB 3.43Å; N212-A217 VanDerWaalsContact O-CB 3.3Å; N212-A217 WeakPolarHBondContact O-CB 3.4Å; V214-A217 HydrophobicContact CG2-CB 4.04Å; V214-A217 VanDerWaalsContact O-CB 3.32Å; V214-A217 WeakPolarHBondContact O-CB 3.45Å; V214-A217 PolarHBondContact O-N 3.48Å; L215-A217 VanDerWaalsContact C-N 3.25Å; L215-A217 PolarHBondContact O-N 2.63Å
218	R	74.5	Confident	82.8	Confident	196 Å²	196	82.1 Å²	82.1	74%	0.74	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-111.2	6.6	-176.8	-51.6	-176.7	-174	-165.6	2	113.9	D213 L215 E216	D213-R218 IonicContact OD1-CZ 3.08Å; D213-R218 IonicContact OD1-NE 2.71Å; D213-R218 PolarHBondContact OD1-NE 3.15Å; D213-R218 IonicContact OD1-NH2 3.47Å; D213-R218 PolarHBondContact OD1-NH2 3.2Å; D213-R218 IonicContact OD2-NH2 2.8Å; D213-R218 PolarHBondContact OD2-NH2 3.42Å; L215-R218 PolarHBondContact O-N 2.88Å; L215-R218 VanDerWaalsContact O-N 3.1Å; E216-R218 PolarHBondContact O-N 2.84Å; E216-R218 VanDerWaalsContact O-N 3.12Å
219	Q	83.3	Confident	83	Confident	82 Å²	82	80.9 Å²	80.9	38%	0.383	42%	0.416	S	S	.	.			trans	-101.4	139.7	-178.6	-72.9	170.9	24	0	0	112.7	R196 L215 E216	R196-Q219 PolarHBondContact NH2-O 2.94Å; L215-Q219 WeakPolarHBondContact O-CG 3.25Å; E216-Q219 PolarHBondContact O-N 3.47Å
220	E	82.5	Confident	83.3	Confident	156 Å²	156	84.1 Å²	84.1	73%	0.729	43%	0.434	S	S	*	.	S	Bend	trans	-79.2	-40.4	175.4	-168.2	177.9	179	0	0	112	L184	L184-E220 PolarHBondContact N-O 3.13Å
221	E	89.4	Confident	83.6	Confident	78 Å²	78	83.2 Å²	83.2	36%	0.364	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	122.6	170.5	-59.2	-156.4	142.2	0	0	110.8	L184 I186 K191	L184-E221 HydrophobicContact CD2-CG 4.28Å; L184-E221 WeakPolarHBondContact O-CA 3.33Å; I186-E221 HydrophobicContact CD1-CB 3.92Å; I186-E221 HydrophobicContact CD1-CG 4.22Å; I186-E221 WeakPolarHBondContact CD1-OE2 3.33Å; K191-E221 IonicContact NZ-OE1 3.42Å; K191-E221 PolarHBondContact NZ-OE1 3.04Å; K191-E221 IonicContact NZ-OE2 3.43Å
222	V	89.5	Confident	84.1	Confident	3 Å²	3	78 Å²	78	2%	0.018	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	129.5	176.2	176.1	0	0	0	0	109.4	V183 L184 L185 I186 M209 M224	V183-V222 HydrophobicContact CG2-CB 4.33Å; V183-V222 HydrophobicContact CG2-CG2 3.86Å; L184-V222 PolarHBondContact O-N 2.87Å; L185-V222 CarbonylContact C-O 3.58Å; L185-V222 WeakPolarHBondContact CA-O 3.36Å; L185-V222 HydrophobicContact CD2-CB 4.12Å; L185-V222 HydrophobicContact CD2-CG1 4.38Å; I186-V222 PolarHBondContact N-O 3.24Å; M209-V222 HydrophobicContact CE-CG1 4.34Å; M209-V222 HydrophobicContact SD-CG1 3.86Å; V222-M224 HydrophobicContact CG1-SD 4.33Å
223	R	88.8	Confident	84.7	Confident	182 Å²	182	76 Å²	76	69%	0.687	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	123.1	-177.6	-65.1	-176.5	-178.1	-176.5	1.9	111.2	I186	I186-R223 HydrophobicContact CB-CG 4.32Å
224	M	88	Confident	85.7	Confident	9 Å²	9	71.8 Å²	71.8	4%	0.044	37%	0.37	C	S	.	.			trans	-99.4	92.1	177.8	-60.7	-56.5	-57	0	0	109.1	I186 A187 Y205 F206 V222 V227 L232 L261	I186-M224 PolarHBondContact O-N 3.44Å; A187-M224 HydrophobicContact CB-CB 4.42Å; Y205-M224 HydrophobicContact CE1-CE 3.91Å; F206-M224 HydrophobicContact CE1-SD 4.33Å; V222-M224 HydrophobicContact CG1-SD 4.33Å; M224-V227 HydrophobicContact CB-CB 4.49Å; M224-V227 HydrophobicContact CB-CG2 4.14Å; M224-V227 HydrophobicContact CE-CG2 4.28Å; M224-L232 HydrophobicContact CB-CD2 4Å; M224-L232 HydrophobicContact CG-CD2 3.78Å; M224-L261 HydrophobicContact CE-CD2 3.85Å
225	E	84.4	Confident	86.6	Confident	165 Å²	165	69.3 Å²	69.3	77%	0.771	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	147.5	175.6	-60.1	-164.4	170.1	0	0	111.3	V227	E225-V227 VanDerWaalsContact C-N 3.27Å; E225-V227 PolarHBondContact O-N 3.3Å
226	G	82.7	Confident	87.8	Confident	92 Å²	92	63.2 Å²	63.2	95%	0.948	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	-7.1	179.6	0	0	0	0	0	116.7
227	V	90.9	Very high	88.8	Confident	15 Å²	15	64.4 Å²	64.4	9%	0.091	33%	0.328	C	S	.	.			trans	-95.8	138.6	-176.9	-165.4	0	0	0	0	112	M224 E225 L232 A257 L260	M224-V227 HydrophobicContact CB-CB 4.49Å; M224-V227 HydrophobicContact CB-CG2 4.14Å; M224-V227 HydrophobicContact CE-CG2 4.28Å; E225-V227 VanDerWaalsContact C-N 3.27Å; E225-V227 PolarHBondContact O-N 3.3Å; V227-L232 HydrophobicContact CG1-CB 3.93Å; V227-A257 HydrophobicContact CG1-CB 3.68Å; V227-L260 HydrophobicContact CG2-CD2 3.45Å; V227-L260 VanDerWaalsContact CG2-CD2 3.45Å
228	D	92.9	Very high	89.9	Confident	43 Å²	43	65 Å²	65	23%	0.23	33%	0.326	C	S	.	.			trans	-65.3	128.9	170.1	177.2	-85.4	0	0	0	110.9	N230 A231 L232 N253	D228-N230 VanDerWaalsContact C-N 3.3Å; D228-N230 PolarHBondContact O-N 2.73Å; D228-N230 WeakPolarHBondContact OD1-CA 3.33Å; D228-N230 VanDerWaalsContact OD1-CB 3.3Å; D228-N230 WeakPolarHBondContact OD1-CB 3.23Å; D228-N230 PolarHBondContact OD1-N 3.07Å; D228-N230 PolarHBondContact OD1-ND2 3.45Å; D228-A231 HydrophobicContact CB-CB 3.88Å; D228-A231 PolarHBondContact O-N 2.98Å; D228-A231 PolarHBondContact OD1-N 3.14Å; D228-L232 PolarHBondContact O-N 3.28Å; D228-N253 HydrophobicContact CB-CB 3.8Å; D228-N253 PolarHBondContact OD2-ND2 3.46Å
229	P	93	Very high	90.8	Very high	20 Å²	20	56.1 Å²	56.1	13%	0.13	30%	0.295	C	S	.	.	H	α-helix	trans	-61.1	-32.4	-176.1	-26.1	35.5	0	0	0	114.9	A187 L190 N233	A187-P229 HydrophobicContact CB-CB 4.24Å; A187-P229 HydrophobicContact CB-CG 4.34Å; A187-P229 WeakPolarHBondContact O-CB 3.42Å; A187-P229 WeakPolarHBondContact O-CG 3.43Å; L190-P229 HydrophobicContact CB-CB 4.15Å; L190-P229 HydrophobicContact CD1-CB 3.73Å; L190-P229 HydrophobicContact CG-CB 4.09Å; P229-N233 PolarHBondContact O-N 3.48Å
230	N	92.9	Very high	91.2	Very high	90 Å²	90	52.5 Å²	52.5	48%	0.481	28%	0.278	S	S	.	.	H	α-helix	trans	-79.6	-42.5	-179.5	-50.7	-78.7	0	0	0	110.5	D228 L232 N233 S234	D228-N230 VanDerWaalsContact C-N 3.3Å; D228-N230 PolarHBondContact O-N 2.73Å; D228-N230 WeakPolarHBondContact OD1-CA 3.33Å; D228-N230 VanDerWaalsContact OD1-CB 3.3Å; D228-N230 WeakPolarHBondContact OD1-CB 3.23Å; D228-N230 PolarHBondContact OD1-N 3.07Å; D228-N230 PolarHBondContact OD1-ND2 3.45Å; N230-L232 PolarHBondContact O-N 3.01Å; N230-N233 PolarHBondContact O-N 3.44Å; N230-S234 PolarHBondContact O-N 3.14Å; N230-S234 PolarHBondContact O-OG 3.15Å
231	A	94.4	Very high	91.6	Very high	7 Å²	7	47.1 Å²	47.1	6%	0.058	26%	0.256	C	S	.	.	H	α-helix	trans	-57.1	-48	173.9	0	0	0	0	0	111.1	D228 N233 S234 L235 N253 L254 A257	D228-A231 HydrophobicContact CB-CB 3.88Å; D228-A231 PolarHBondContact O-N 2.98Å; D228-A231 PolarHBondContact OD1-N 3.14Å; A231-N233 VanDerWaalsContact C-N 3.34Å; A231-N233 PolarHBondContact O-N 3.28Å; A231-S234 PolarHBondContact O-N 3.5Å; A231-L235 VanDerWaalsContact O-CG 3.32Å; A231-L235 WeakPolarHBondContact O-CG 3.38Å; A231-L235 PolarHBondContact O-N 3.44Å; A231-N253 HydrophobicContact CB-CB 4.34Å; A231-N253 WeakPolarHBondContact CB-O 3.47Å; A231-L254 HydrophobicContact CB-CD1 4.44Å; A231-A257 HydrophobicContact CB-CB 3.88Å
232	L	94.8	Very high	91.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.1	-46.2	175.7	-177.7	62.2	0	0	0	111.6	L185 A187 I192 M224 V227 D228 N230 S234 L235 V236 L261	L185-L232 HydrophobicContact CB-CD2 4.28Å; L185-L232 HydrophobicContact CD1-CD1 4.34Å; L185-L232 HydrophobicContact CD1-CD2 4.44Å; A187-L232 HydrophobicContact CB-CB 4.5Å; A187-L232 HydrophobicContact CB-CD2 3.61Å; I192-L232 HydrophobicContact CD1-CB 4.21Å; I192-L232 HydrophobicContact CD1-CD2 3.92Å; I192-L232 HydrophobicContact CD1-CG 3.88Å; M224-L232 HydrophobicContact CB-CD2 4Å; M224-L232 HydrophobicContact CG-CD2 3.78Å; V227-L232 HydrophobicContact CG1-CB 3.93Å; D228-L232 PolarHBondContact O-N 3.28Å; N230-L232 PolarHBondContact O-N 3.01Å; L232-S234 VanDerWaalsContact C-N 3.35Å; L232-S234 PolarHBondContact O-N 2.97Å; L232-L235 PolarHBondContact O-N 2.81Å; L232-V236 HydrophobicContact CD1-CG2 4.27Å; L232-V236 HydrophobicContact CG-CG2 4.42Å; L232-V236 VanDerWaalsContact O-CG2 3.31Å; L232-V236 WeakPolarHBondContact O-CG2 3.43Å; L232-V236 PolarHBondContact O-N 3.44Å; L232-L261 HydrophobicContact CD1-CD1 3.76Å
233	N	93.5	Very high	91.6	Very high	50 Å²	50	53 Å²	53	27%	0.267	30%	0.3	S	S	.	.	H	α-helix	trans	-61.1	-40.9	177	171.9	82.9	0	0	0	112.3	I192 P229 N230 A231 V236 Q237	I192-N233 HydrophobicContact CD1-CB 3.82Å; I192-N233 HydrophobicContact CG1-CB 4.35Å; P229-N233 PolarHBondContact O-N 3.48Å; N230-N233 PolarHBondContact O-N 3.44Å; A231-N233 VanDerWaalsContact C-N 3.34Å; A231-N233 PolarHBondContact O-N 3.28Å; N233-V236 PolarHBondContact O-N 2.92Å; N233-Q237 PolarHBondContact ND2-NE2 2.75Å; N233-Q237 WeakPolarHBondContact O-CB 3.28Å; N233-Q237 VanDerWaalsContact O-CG 3.25Å; N233-Q237 WeakPolarHBondContact O-CG 3.21Å; N233-Q237 PolarHBondContact O-N 3.17Å; N233-Q237 PolarHBondContact OD1-NE2 3.45Å
234	S	94.7	Very high	91.8	Very high	42 Å²	42	46.4 Å²	46.4	29%	0.294	28%	0.279	S	S	.	.	H	α-helix	trans	-65.5	-38.1	175.9	-70.8	0	0	0	0	113	N230 A231 L232 Q237 Y238	N230-S234 PolarHBondContact O-N 3.14Å; N230-S234 PolarHBondContact O-OG 3.15Å; A231-S234 PolarHBondContact O-N 3.5Å; L232-S234 VanDerWaalsContact C-N 3.35Å; L232-S234 PolarHBondContact O-N 2.97Å; S234-Q237 PolarHBondContact O-N 3.36Å; S234-Y238 WeakPolarHBondContact O-CB 3.4Å; S234-Y238 PolarHBondContact O-N 3.13Å
235	L	95.4	Very high	92	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-71.3	-38.6	176.6	-65.1	173.1	0	0	0	112.2	A231 L232 Y238 A239 L254 A257 A258 L261 L263 V266	A231-L235 VanDerWaalsContact O-CG 3.32Å; A231-L235 WeakPolarHBondContact O-CG 3.38Å; A231-L235 PolarHBondContact O-N 3.44Å; L232-L235 PolarHBondContact O-N 2.81Å; L235-Y238 PolarHBondContact O-N 3.1Å; L235-A239 PolarHBondContact O-N 3.38Å; L235-A239 VanDerWaalsContact O-N 3.15Å; L235-L254 HydrophobicContact CD1-CD1 4.34Å; L235-L254 HydrophobicContact CD2-CD1 3.65Å; L235-L254 HydrophobicContact CG-CD1 3.79Å; L235-A257 HydrophobicContact CD1-CB 3.51Å; L235-A258 HydrophobicContact CD1-CB 4.3Å; L235-A258 HydrophobicContact CD2-CB 4.33Å; L235-L261 HydrophobicContact CD1-CD1 4.03Å; L235-L263 HydrophobicContact CB-CD1 3.97Å; L235-L263 HydrophobicContact CD1-CD1 4.08Å; L235-L263 HydrophobicContact CD2-CD1 3.83Å; L235-L263 HydrophobicContact CG-CD1 4.16Å; L235-V266 HydrophobicContact CD2-CB 4.45Å; L235-V266 HydrophobicContact CD2-CG1 3.74Å; L235-V266 HydrophobicContact CD2-CG2 4.35Å
236	V	94.1	Very high	92.4	Very high	3 Å²	3	47.5 Å²	47.5	2%	0.018	29%	0.285	C	S	.	.	H	α-helix	trans	-62.4	-44.1	170.6	172.7	0	0	0	0	110.2	L185 I192 A194 L199 L232 N233 Y238 A239 Y240	L185-V236 HydrophobicContact CD1-CG2 3.89Å; I192-V236 HydrophobicContact CG2-CB 4.22Å; I192-V236 HydrophobicContact CG2-CG1 3.92Å; I192-V236 HydrophobicContact CG2-CG2 4.24Å; A194-V236 HydrophobicContact CB-CG1 4.28Å; L199-V236 HydrophobicContact CD2-CG2 4.24Å; L232-V236 HydrophobicContact CD1-CG2 4.27Å; L232-V236 HydrophobicContact CG-CG2 4.42Å; L232-V236 VanDerWaalsContact O-CG2 3.31Å; L232-V236 WeakPolarHBondContact O-CG2 3.43Å; L232-V236 PolarHBondContact O-N 3.44Å; N233-V236 PolarHBondContact O-N 2.92Å; V236-Y238 PolarHBondContact O-N 3.41Å; V236-A239 WeakPolarHBondContact O-CB 3.35Å; V236-A239 PolarHBondContact O-N 3.08Å; V236-Y240 HydrophobicContact CG1-CE2 4.21Å; V236-Y240 VanDerWaalsContact O-CD2 3.25Å; V236-Y240 WeakPolarHBondContact O-CD2 3.27Å
237	Q	92.8	Very high	92.8	Very high	96 Å²	96	48.3 Å²	48.3	45%	0.449	26%	0.26	S	S	.	.	H	α-helix	trans	-62.2	-42.8	176.5	-74.7	177.7	10.9	0	0	112.3	N233 S234 A239 Y240 T241	N233-Q237 PolarHBondContact ND2-NE2 2.75Å; N233-Q237 WeakPolarHBondContact O-CB 3.28Å; N233-Q237 VanDerWaalsContact O-CG 3.25Å; N233-Q237 WeakPolarHBondContact O-CG 3.21Å; N233-Q237 PolarHBondContact O-N 3.17Å; N233-Q237 PolarHBondContact OD1-NE2 3.45Å; S234-Q237 PolarHBondContact O-N 3.36Å; Q237-A239 VanDerWaalsContact C-N 3.27Å; Q237-A239 PolarHBondContact O-N 3.29Å; Q237-Y240 PolarHBondContact O-N 2.9Å; Q237-Y240 VanDerWaalsContact O-N 3.08Å; Q237-T241 WeakPolarHBondContact O-CG2 3.45Å; Q237-T241 PolarHBondContact O-N 3.47Å; Q237-T241 PolarHBondContact O-OG1 2.89Å; Q237-T241 VanDerWaalsContact O-OG1 3.09Å
238	Y	94.9	Very high	92.7	Very high	32 Å²	32	54.1 Å²	54.1	13%	0.125	29%	0.285	C	S	.	.	H	α-helix	trans	-54.5	-40.7	173.8	161.6	-99	0	0	0	112.3	V202 S234 L235 V236 Y240 T241 G242 L244 V266	V202-Y238 HydrophobicContact CG1-CE1 4.04Å; S234-Y238 WeakPolarHBondContact O-CB 3.4Å; S234-Y238 PolarHBondContact O-N 3.13Å; L235-Y238 PolarHBondContact O-N 3.1Å; V236-Y238 PolarHBondContact O-N 3.41Å; Y238-Y240 PolarHBondContact O-N 2.78Å; Y238-T241 WeakPolarHBondContact CA-OG1 3.31Å; Y238-T241 PolarHBondContact O-N 2.89Å; Y238-G242 PolarHBondContact O-N 3.01Å; Y238-L244 HydrophobicContact CD2-CB 4.07Å; Y238-V266 HydrophobicContact CD1-CG2 3.8Å; Y238-V266 HydrophobicContact CE1-CG2 3.4Å; Y238-V266 VanDerWaalsContact CE1-CG2 3.4Å; Y238-V266 HydrophobicContact CE2-CG2 4.19Å; Y238-V266 HydrophobicContact CG-CG2 4.35Å
239	A	93.6	Very high	92.5	Very high	10 Å²	10	57.6 Å²	57.6	8%	0.083	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-15.6	178.6	0	0	0	0	0	114.6	V198 V202 L235 V236 Q237	V198-A239 HydrophobicContact CG1-CB 4.4Å; V198-A239 WeakPolarHBondContact CG1-O 3.44Å; V202-A239 HydrophobicContact CB-CB 4.16Å; V202-A239 HydrophobicContact CG1-CB 4.08Å; V202-A239 HydrophobicContact CG2-CB 4.1Å; L235-A239 PolarHBondContact O-N 3.38Å; L235-A239 VanDerWaalsContact O-N 3.15Å; V236-A239 WeakPolarHBondContact O-CB 3.35Å; V236-A239 PolarHBondContact O-N 3.08Å; Q237-A239 VanDerWaalsContact C-N 3.27Å; Q237-A239 PolarHBondContact O-N 3.29Å
240	Y	92.1	Very high	92.5	Very high	6 Å²	6	58.2 Å²	58.2	2%	0.024	31%	0.308	C	S	.	.	H	α-helix	trans	-107.7	-7	173.4	-65.2	-92.4	0	0	0	114.3	M171 L175 H195 V198 V236 Q237 Y238	M171-Y240 HydrophobicContact CB-CD1 4.01Å; M171-Y240 HydrophobicContact CB-CE1 4.16Å; L175-Y240 HydrophobicContact CB-CE1 4.49Å; L175-Y240 HydrophobicContact CD1-CE1 4.49Å; L175-Y240 HydrophobicContact CD1-CE2 3.87Å; L175-Y240 HydrophobicContact CD2-CD2 3.63Å; L175-Y240 HydrophobicContact CD2-CE2 3.76Å; L175-Y240 HydrophobicContact CD2-CG 4.07Å; L175-Y240 HydrophobicContact CG-CE2 4.37Å; H195-Y240 VanDerWaalsContact CB-OH 3.28Å; H195-Y240 WeakPolarHBondContact CB-OH 3.22Å; H195-Y240 PolarHBondContact N-OH 3.3Å; H195-Y240 AromaticContact ND1-CE1 3.79Å; H195-Y240 AromaticContact ND1-CZ 3.69Å; H195-Y240 PolarHBondContact ND1-OH 3.1Å; V198-Y240 HydrophobicContact CB-CE1 3.9Å; V198-Y240 HydrophobicContact CG1-CD1 3.98Å; V198-Y240 HydrophobicContact CG1-CD2 4.4Å; V198-Y240 HydrophobicContact CG1-CE1 3.72Å; V198-Y240 HydrophobicContact CG1-CE2 4.15Å; V198-Y240 HydrophobicContact CG1-CG 4.3Å; V198-Y240 HydrophobicContact CG2-CD1 4.49Å; V198-Y240 HydrophobicContact CG2-CE1 3.76Å; V236-Y240 HydrophobicContact CG1-CE2 4.21Å; V236-Y240 VanDerWaalsContact O-CD2 3.25Å; V236-Y240 WeakPolarHBondContact O-CD2 3.27Å; Q237-Y240 PolarHBondContact O-N 2.9Å; Q237-Y240 VanDerWaalsContact O-N 3.08Å; Y238-Y240 PolarHBondContact O-N 2.78Å
241	T	91.3	Very high	92.5	Very high	43 Å²	43	54.2 Å²	54.2	26%	0.264	29%	0.286	S	S	.	.	H	α-helix	trans	-125.6	-21.8	-172.5	60.9	0	0	0	0	114.9	Q172 Q237 Y238 M243	Q172-T241 HydrophobicContact CG-CG2 4.28Å; Q237-T241 WeakPolarHBondContact O-CG2 3.45Å; Q237-T241 PolarHBondContact O-N 3.47Å; Q237-T241 PolarHBondContact O-OG1 2.89Å; Q237-T241 VanDerWaalsContact O-OG1 3.09Å; Y238-T241 WeakPolarHBondContact CA-OG1 3.31Å; Y238-T241 PolarHBondContact O-N 2.89Å; T241-M243 HydrophobicContact CG2-CE 4.46Å; T241-M243 PolarHBondContact O-N 2.99Å; T241-M243 VanDerWaalsContact O-N 3.12Å; T241-M243 PolarHBondContact OG1-N 3.33Å; T241-M243 PolarHBondContact OG1-O 3.01Å
242	G	89.4	Confident	92.4	Very high	60 Å²	60	57.2 Å²	57.2	62%	0.619	30%	0.299	S	S	*	.	S	Bend	trans	64.3	2.4	-164.6	0	0	0	0	0	114.3	Y238	Y238-G242 PolarHBondContact O-N 3.01Å
243	M	89.4	Confident	92.3	Very high	143 Å²	143	60.6 Å²	60.6	70%	0.704	32%	0.317	S	S	*	.			trans	-111.2	132.5	-173.5	-67.9	-174.2	-73.5	0	0	111.3	T241	T241-M243 HydrophobicContact CG2-CE 4.46Å; T241-M243 PolarHBondContact O-N 2.99Å; T241-M243 VanDerWaalsContact O-N 3.12Å; T241-M243 PolarHBondContact OG1-N 3.33Å; T241-M243 PolarHBondContact OG1-O 3.01Å
244	L	93.6	Very high	92.4	Very high	45 Å²	45	58.4 Å²	58.4	24%	0.236	31%	0.305	C	S	.	.			trans	-136.4	130.4	-179.8	-173.8	63.9	0	0	0	110.6	Y238 L246 L254 V266	Y238-L244 HydrophobicContact CD2-CB 4.07Å; L244-L246 HydrophobicContact CD2-CD2 4.08Å; L244-L246 HydrophobicContact CG-CD2 4.19Å; L244-L254 HydrophobicContact CD1-CD1 4.21Å; L244-L254 HydrophobicContact CD1-CD2 4.19Å; L244-L254 HydrophobicContact CD2-CD2 4.09Å; L244-L254 HydrophobicContact CG-CD2 4.23Å; L244-V266 HydrophobicContact CD2-CB 4.36Å; L244-V266 HydrophobicContact CD2-CG1 3.42Å; L244-V266 VanDerWaalsContact CD2-CG1 3.42Å; L244-V266 HydrophobicContact CD2-CG2 4.13Å
245	Q	91.2	Very high	92.4	Very high	150 Å²	150	56.4 Å²	56.4	70%	0.701	29%	0.291	S	S	*	.			trans	-94.6	116.4	177	-173.2	178.8	10.2	0	0	110.3	R247	Q245-R247 HydrophobicContact CG-CG 4.41Å
246	L	92.8	Very high	92.3	Very high	46 Å²	46	57.7 Å²	57.7	24%	0.241	30%	0.302	C	S	.	.			trans	-89.4	140.9	175.5	-49.8	179.9	0	0	0	110.4	L244 I251 L254 V269 F273	L244-L246 HydrophobicContact CD2-CD2 4.08Å; L244-L246 HydrophobicContact CG-CD2 4.19Å; L246-I251 HydrophobicContact CD2-CD1 4.09Å; L246-L254 HydrophobicContact CD2-CD2 3.97Å; L246-V269 HydrophobicContact CD1-CG1 3.71Å; L246-V269 HydrophobicContact CD2-CG1 4.31Å; L246-V269 HydrophobicContact CG-CG1 4.47Å; L246-F273 HydrophobicContact CB-CD2 3.89Å; L246-F273 HydrophobicContact CB-CE2 4.02Å; L246-F273 HydrophobicContact CB-CG 4.35Å; L246-F273 HydrophobicContact CD1-CB 3.84Å; L246-F273 HydrophobicContact CD1-CD2 3.76Å; L246-F273 HydrophobicContact CD1-CG 4.02Å
247	R	92.1	Very high	92.3	Very high	110 Å²	110	57.7 Å²	57.7	42%	0.415	30%	0.303	S	S	.	.			trans	-150.3	145.1	175.5	-56.3	178.6	-63.5	-170.6	-2.7	110.1	Q245 D249 T250 I251	Q245-R247 HydrophobicContact CG-CG 4.41Å; R247-D249 VanDerWaalsContact C-N 3.26Å; R247-D249 WeakPolarHBondContact CB-OD1 3.25Å; R247-D249 IonicContact NE-OD1 2.71Å; R247-D249 PolarHBondContact NE-OD1 3.21Å; R247-D249 PolarHBondContact O-N 2.97Å; R247-T250 PolarHBondContact NE-OG1 3.25Å; R247-T250 PolarHBondContact NH2-OG1 3.18Å; R247-T250 PolarHBondContact O-N 3.27Å; R247-I251 WeakPolarHBondContact O-CB 3.13Å; R247-I251 PolarHBondContact O-N 3.05Å
248	E	88.4	Confident	92.4	Very high	136 Å²	136	53.1 Å²	53.1	64%	0.636	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-30.4	-176.7	-63	170.5	-171.2	0	0	113.4	F273 Q277	E248-F273 HydrophobicContact CG-CE1 4.05Å; E248-F273 HydrophobicContact CG-CZ 3.96Å; E248-Q277 PolarHBondContact OE1-NE2 2.83Å
249	D	88.7	Confident	92.4	Very high	117 Å²	117	52.9 Å²	52.9	63%	0.626	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-25.8	179.8	67.7	-36.4	0	0	0	113.9	R247	R247-D249 VanDerWaalsContact C-N 3.26Å; R247-D249 WeakPolarHBondContact CB-OD1 3.25Å; R247-D249 IonicContact NE-OD1 2.71Å; R247-D249 PolarHBondContact NE-OD1 3.21Å; R247-D249 PolarHBondContact O-N 2.97Å
250	T	92	Very high	92.3	Very high	33 Å²	33	56.1 Å²	56.1	20%	0.202	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115	-3.2	-177.3	55	0	0	0	0	115.3	R247 E252 N253 L254	R247-T250 PolarHBondContact NE-OG1 3.25Å; R247-T250 PolarHBondContact NH2-OG1 3.18Å; R247-T250 PolarHBondContact O-N 3.27Å; T250-E252 PolarHBondContact O-N 3.42Å; T250-N253 PolarHBondContact O-N 2.78Å; T250-L254 VanDerWaalsContact O-CB 3.27Å; T250-L254 WeakPolarHBondContact O-CB 3.5Å; T250-L254 PolarHBondContact O-N 3.3Å
251	I	93.6	Very high	92.4	Very high	5 Å²	5	55.9 Å²	55.9	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-63.9	-35.7	-174.3	-167.5	66.4	0	0	0	113.7	L246 R247 L254 L255 C270 F273 L274	L246-I251 HydrophobicContact CD2-CD1 4.09Å; R247-I251 WeakPolarHBondContact O-CB 3.13Å; R247-I251 PolarHBondContact O-N 3.05Å; I251-L254 PolarHBondContact O-N 3.23Å; I251-L255 WeakPolarHBondContact O-CB 3.16Å; I251-L255 PolarHBondContact O-N 3.29Å; I251-C270 HydrophobicContact CD1-CB 3.75Å; I251-F273 HydrophobicContact CB-CD1 4.45Å; I251-F273 HydrophobicContact CD1-CB 4.48Å; I251-F273 HydrophobicContact CD1-CD1 4.12Å; I251-F273 HydrophobicContact CD1-CG 4.46Å; I251-F273 HydrophobicContact CG1-CD1 3.9Å; I251-F273 HydrophobicContact CG1-CE1 4.45Å; I251-L274 HydrophobicContact CG1-CD1 4.41Å; I251-L274 HydrophobicContact CG1-CD2 4.18Å; I251-L274 HydrophobicContact CG1-CG 4.05Å; I251-L274 HydrophobicContact CG2-CD2 3.76Å
252	E	91.9	Very high	92.5	Very high	71 Å²	71	58.7 Å²	58.7	33%	0.332	31%	0.309	S	S	.	.	H	α-helix	trans	-63.2	-52.5	176.9	-65.6	-179.9	-176.8	0	0	110.8	R18 T250 L254 L255 A256 F289	R18-E252 IonicContact CZ-OE1 2.6Å; R18-E252 IonicContact CZ-OE2 2.95Å; R18-E252 IonicContact NH2-OE1 2.6Å; R18-E252 PolarHBondContact NH2-OE1 3.3Å; R18-E252 IonicContact NH2-OE2 2.8Å; R18-E252 PolarHBondContact NH2-OE2 2.71Å; T250-E252 PolarHBondContact O-N 3.42Å; E252-L254 VanDerWaalsContact C-N 3.26Å; E252-L254 PolarHBondContact O-N 3.4Å; E252-L255 PolarHBondContact O-N 3.33Å; E252-A256 WeakPolarHBondContact O-CB 3.38Å; E252-A256 PolarHBondContact O-N 3.29Å; E252-F289 HydrophobicContact CB-CE1 4.27Å; E252-F289 HydrophobicContact CB-CE2 4.33Å; E252-F289 HydrophobicContact CB-CZ 4.02Å; E252-F289 HydrophobicContact CG-CD1 4.49Å; E252-F289 HydrophobicContact CG-CE1 4.28Å; E252-F289 HydrophobicContact CG-CZ 4.48Å; E252-F289 VanDerWaalsContact O-CZ 3.23Å; E252-F289 WeakPolarHBondContact O-CZ 3.25Å
253	N	93.4	Very high	92.7	Very high	70 Å²	70	56.4 Å²	56.4	37%	0.374	28%	0.283	S	S	.	.	H	α-helix	trans	-61.7	-35.7	177.8	-68.7	10.3	0	0	0	111.9	D228 A231 T250 A257	D228-N253 HydrophobicContact CB-CB 3.8Å; D228-N253 PolarHBondContact OD2-ND2 3.46Å; A231-N253 HydrophobicContact CB-CB 4.34Å; A231-N253 WeakPolarHBondContact CB-O 3.47Å; T250-N253 PolarHBondContact O-N 2.78Å; N253-A257 VanDerWaalsContact O-CB 3.31Å; N253-A257 WeakPolarHBondContact O-CB 3.39Å; N253-A257 PolarHBondContact O-N 2.86Å; N253-A257 VanDerWaalsContact O-N 3.11Å
254	L	95.1	Very high	92.9	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-70.8	-44.7	179.9	-173.4	62.4	0	0	0	112.5	A231 L235 L244 L246 T250 I251 E252 A257 A258	A231-L254 HydrophobicContact CB-CD1 4.44Å; L235-L254 HydrophobicContact CD1-CD1 4.34Å; L235-L254 HydrophobicContact CD2-CD1 3.65Å; L235-L254 HydrophobicContact CG-CD1 3.79Å; L244-L254 HydrophobicContact CD1-CD1 4.21Å; L244-L254 HydrophobicContact CD1-CD2 4.19Å; L244-L254 HydrophobicContact CD2-CD2 4.09Å; L244-L254 HydrophobicContact CG-CD2 4.23Å; L246-L254 HydrophobicContact CD2-CD2 3.97Å; T250-L254 VanDerWaalsContact O-CB 3.27Å; T250-L254 WeakPolarHBondContact O-CB 3.5Å; T250-L254 PolarHBondContact O-N 3.3Å; I251-L254 PolarHBondContact O-N 3.23Å; E252-L254 VanDerWaalsContact C-N 3.26Å; E252-L254 PolarHBondContact O-N 3.4Å; L254-A257 PolarHBondContact O-N 3.01Å; L254-A258 WeakPolarHBondContact O-CB 3.46Å; L254-A258 PolarHBondContact O-N 3.32Å
255	L	94.5	Very high	92.9	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65.7	-45.3	176	178.5	55	0	0	0	110.9	I251 E252 A257 A258 C259 I267 C270 L274 F289 L298	I251-L255 WeakPolarHBondContact O-CB 3.16Å; I251-L255 PolarHBondContact O-N 3.29Å; E252-L255 PolarHBondContact O-N 3.33Å; L255-A257 VanDerWaalsContact C-N 3.31Å; L255-A257 PolarHBondContact O-N 3.32Å; L255-A258 PolarHBondContact O-N 3.45Å; L255-A258 VanDerWaalsContact O-N 3.08Å; L255-C259 PolarHBondContact O-N 3.36Å; L255-C259 PolarHBondContact O-SG 2.71Å; L255-I267 HydrophobicContact CD1-CB 4.15Å; L255-I267 HydrophobicContact CD1-CG1 4.16Å; L255-I267 HydrophobicContact CD1-CG2 3.99Å; L255-C270 HydrophobicContact CB-CB 4.07Å; L255-C270 HydrophobicContact CD1-CB 4.03Å; L255-C270 HydrophobicContact CG-CB 4.44Å; L255-L274 HydrophobicContact CD2-CD1 3.93Å; L255-F289 HydrophobicContact CB-CE1 4.15Å; L255-F289 HydrophobicContact CB-CZ 4.19Å; L255-F289 HydrophobicContact CD2-CE1 3.8Å; L255-F289 HydrophobicContact CD2-CZ 4.42Å; L255-F289 HydrophobicContact CG-CE1 4.27Å; L255-F289 HydrophobicContact CG-CZ 4.43Å; L255-L298 HydrophobicContact CD2-CD2 4.15Å
256	A	94	Very high	93.1	Very high	30 Å²	30	51 Å²	51	25%	0.248	26%	0.26	C	S	.	.	H	α-helix	trans	-59.8	-40.8	178.4	0	0	0	0	0	112.5	E252 L260 F289	E252-A256 WeakPolarHBondContact O-CB 3.38Å; E252-A256 PolarHBondContact O-N 3.29Å; A256-L260 PolarHBondContact O-N 3.31Å; A256-L260 VanDerWaalsContact O-N 3.13Å; A256-F289 HydrophobicContact CB-CE2 4.48Å; A256-F289 HydrophobicContact CB-CZ 4.46Å
257	A	94.4	Very high	93.1	Very high	4 Å²	4	50.4 Å²	50.4	3%	0.033	26%	0.257	C	S	.	.	H	α-helix	trans	-66.7	-38.9	173.7	0	0	0	0	0	112.5	V227 A231 L235 N253 L254 L255 L261	V227-A257 HydrophobicContact CG1-CB 3.68Å; A231-A257 HydrophobicContact CB-CB 3.88Å; L235-A257 HydrophobicContact CD1-CB 3.51Å; N253-A257 VanDerWaalsContact O-CB 3.31Å; N253-A257 WeakPolarHBondContact O-CB 3.39Å; N253-A257 PolarHBondContact O-N 2.86Å; N253-A257 VanDerWaalsContact O-N 3.11Å; L254-A257 PolarHBondContact O-N 3.01Å; L255-A257 VanDerWaalsContact C-N 3.31Å; L255-A257 PolarHBondContact O-N 3.32Å; A257-L261 WeakPolarHBondContact O-CB 3.07Å; A257-L261 VanDerWaalsContact O-CG 3.28Å; A257-L261 WeakPolarHBondContact O-CG 3.35Å; A257-L261 PolarHBondContact O-N 3.37Å
258	A	94.9	Very high	93.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-67.7	-36.6	176.6	0	0	0	0	0	112.7	L235 L254 L255 L261 Q262 L263 V266 I267	L235-A258 HydrophobicContact CD1-CB 4.3Å; L235-A258 HydrophobicContact CD2-CB 4.33Å; L254-A258 WeakPolarHBondContact O-CB 3.46Å; L254-A258 PolarHBondContact O-N 3.32Å; L255-A258 PolarHBondContact O-N 3.45Å; L255-A258 VanDerWaalsContact O-N 3.08Å; A258-L261 CarbonylContact O-C 3.55Å; A258-L261 PolarHBondContact O-N 2.68Å; A258-Q262 PolarHBondContact O-N 3.47Å; A258-L263 HydrophobicContact CB-CB 4.22Å; A258-L263 PolarHBondContact O-N 3.03Å; A258-V266 HydrophobicContact CB-CB 4.08Å; A258-V266 HydrophobicContact CB-CG1 3.73Å; A258-I267 HydrophobicContact CB-CG1 4.04Å
259	C	93.4	Very high	93.5	Very high	27 Å²	27	45.9 Å²	45.9	18%	0.182	25%	0.248	C	C	.	.	H	α-helix	trans	-63.5	-48.5	173.5	-70.4	0	0	0	0	111.8	L255 L261 Q262 C295	L255-C259 PolarHBondContact O-N 3.36Å; L255-C259 PolarHBondContact O-SG 2.71Å; C259-L261 VanDerWaalsContact C-N 3.31Å; C259-L261 PolarHBondContact O-N 2.68Å; C259-Q262 PolarHBondContact O-N 3.31Å; C259-C295 VanDerWaalsContact SG-SG 3.67Å
260	L	93	Very high	93.8	Very high	77 Å²	77	40.3 Å²	40.3	40%	0.403	22%	0.218	S	C	.	.	H	α-helix	trans	-61	-40.7	176.7	-174.7	71	0	0	0	112.1	Y205 V227 A256 Q262	Y205-L260 WeakPolarHBondContact CD2-O 3.37Å; V227-L260 HydrophobicContact CG2-CD2 3.45Å; V227-L260 VanDerWaalsContact CG2-CD2 3.45Å; A256-L260 PolarHBondContact O-N 3.31Å; A256-L260 VanDerWaalsContact O-N 3.13Å; L260-Q262 VanDerWaalsContact C-N 3.28Å; L260-Q262 PolarHBondContact O-N 2.97Å
261	L	92.6	Very high	94	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.01	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	4.2	179.9	-63.4	178.6	0	0	0	114.1	S203 Y205 F206 M224 L232 L235 A257 A258 C259 L263	S203-L261 WeakPolarHBondContact CB-O 3.26Å; S203-L261 PolarHBondContact OG-O 2.99Å; Y205-L261 HydrophobicContact CD1-CD2 3.58Å; Y205-L261 HydrophobicContact CE1-CD2 3.85Å; Y205-L261 HydrophobicContact CG-CD2 4.34Å; F206-L261 HydrophobicContact CD2-CD2 4.34Å; F206-L261 HydrophobicContact CE1-CD2 4.25Å; F206-L261 HydrophobicContact CE2-CD1 4.06Å; F206-L261 HydrophobicContact CE2-CD2 3.61Å; F206-L261 HydrophobicContact CE2-CG 4.37Å; F206-L261 HydrophobicContact CZ-CD1 4.41Å; F206-L261 HydrophobicContact CZ-CD2 3.55Å; M224-L261 HydrophobicContact CE-CD2 3.85Å; L232-L261 HydrophobicContact CD1-CD1 3.76Å; L235-L261 HydrophobicContact CD1-CD1 4.03Å; A257-L261 WeakPolarHBondContact O-CB 3.07Å; A257-L261 VanDerWaalsContact O-CG 3.28Å; A257-L261 WeakPolarHBondContact O-CG 3.35Å; A257-L261 PolarHBondContact O-N 3.37Å; A258-L261 CarbonylContact O-C 3.55Å; A258-L261 PolarHBondContact O-N 2.68Å; C259-L261 VanDerWaalsContact C-N 3.31Å; C259-L261 PolarHBondContact O-N 2.68Å; L261-L263 VanDerWaalsContact C-N 3.27Å; L261-L263 HydrophobicContact CB-CD1 4.05Å; L261-L263 HydrophobicContact CB-CG 3.97Å; L261-L263 HydrophobicContact CD1-CD1 4.37Å; L261-L263 PolarHBondContact O-N 2.75Å
262	Q	93.8	Very high	94	Very high	101 Å²	101	42.7 Å²	42.7	47%	0.472	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	39.1	177.5	-59.1	177	-14.9	0	0	113.4	D204 A258 C259 L260 T264	D204-Q262 HydrophobicContact CB-CB 4.48Å; A258-Q262 PolarHBondContact O-N 3.47Å; C259-Q262 PolarHBondContact O-N 3.31Å; L260-Q262 VanDerWaalsContact C-N 3.28Å; L260-Q262 PolarHBondContact O-N 2.97Å; Q262-T264 PolarHBondContact O-N 3.04Å
263	L	94.5	Very high	94.2	Very high	13 Å²	13	41.5 Å²	41.5	7%	0.068	22%	0.224	C	C	.	.			trans	-89.2	71.1	-178.2	-67.8	175.8	0	0	0	111.5	V202 L235 A258 L261 Q265 V266 I267	V202-L263 HydrophobicContact CG1-CD2 3.93Å; V202-L263 WeakPolarHBondContact O-CD2 3.28Å; L235-L263 HydrophobicContact CB-CD1 3.97Å; L235-L263 HydrophobicContact CD1-CD1 4.08Å; L235-L263 HydrophobicContact CD2-CD1 3.83Å; L235-L263 HydrophobicContact CG-CD1 4.16Å; A258-L263 HydrophobicContact CB-CB 4.22Å; A258-L263 PolarHBondContact O-N 3.03Å; L261-L263 VanDerWaalsContact C-N 3.27Å; L261-L263 HydrophobicContact CB-CD1 4.05Å; L261-L263 HydrophobicContact CB-CG 3.97Å; L261-L263 HydrophobicContact CD1-CD1 4.37Å; L261-L263 PolarHBondContact O-N 2.75Å; L263-Q265 PolarHBondContact O-N 3.12Å; L263-V266 HydrophobicContact CB-CB 4.06Å; L263-V266 HydrophobicContact CB-CG2 4.19Å; L263-V266 WeakPolarHBondContact O-CA 3.23Å; L263-V266 WeakPolarHBondContact O-CB 3.4Å; L263-V266 PolarHBondContact O-N 3.25Å; L263-I267 WeakPolarHBondContact O-CG1 3.36Å; L263-I267 PolarHBondContact O-N 3.36Å
264	T	92.8	Very high	94.3	Very high	83 Å²	83	38.7 Å²	38.7	51%	0.509	21%	0.209	S	C	.	.	H	α-helix	trans	-47.7	-50.2	-170.8	-47.5	0	0	0	0	114.1	Q262 V266 I267 D268	Q262-T264 PolarHBondContact O-N 3.04Å; T264-V266 PolarHBondContact O-N 3.08Å; T264-I267 WeakPolarHBondContact O-CB 3.28Å; T264-I267 PolarHBondContact O-N 2.87Å; T264-D268 PolarHBondContact O-N 3.38Å
265	Q	93.4	Very high	94.3	Very high	140 Å²	140	40.5 Å²	40.5	65%	0.654	22%	0.218	S	C	*	.	H	α-helix	trans	-59.7	-32.9	179.1	-62.9	-177.6	33.8	0	0	113.1	L263 V269	L263-Q265 PolarHBondContact O-N 3.12Å; Q265-V269 WeakPolarHBondContact O-CB 3.43Å; Q265-V269 WeakPolarHBondContact O-CG2 3.44Å; Q265-V269 PolarHBondContact O-N 3.4Å
266	V	94.9	Very high	94.2	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.012	25%	0.253	C	S	.	.	H	α-helix	trans	-77	-38.5	176.9	179.4	0	0	0	0	111	L235 Y238 L244 A258 L263 T264 V269 C270	L235-V266 HydrophobicContact CD2-CB 4.45Å; L235-V266 HydrophobicContact CD2-CG1 3.74Å; L235-V266 HydrophobicContact CD2-CG2 4.35Å; Y238-V266 HydrophobicContact CD1-CG2 3.8Å; Y238-V266 HydrophobicContact CE1-CG2 3.4Å; Y238-V266 VanDerWaalsContact CE1-CG2 3.4Å; Y238-V266 HydrophobicContact CE2-CG2 4.19Å; Y238-V266 HydrophobicContact CG-CG2 4.35Å; L244-V266 HydrophobicContact CD2-CB 4.36Å; L244-V266 HydrophobicContact CD2-CG1 3.42Å; L244-V266 VanDerWaalsContact CD2-CG1 3.42Å; L244-V266 HydrophobicContact CD2-CG2 4.13Å; A258-V266 HydrophobicContact CB-CB 4.08Å; A258-V266 HydrophobicContact CB-CG1 3.73Å; L263-V266 HydrophobicContact CB-CB 4.06Å; L263-V266 HydrophobicContact CB-CG2 4.19Å; L263-V266 WeakPolarHBondContact O-CA 3.23Å; L263-V266 WeakPolarHBondContact O-CB 3.4Å; L263-V266 PolarHBondContact O-N 3.25Å; T264-V266 PolarHBondContact O-N 3.08Å; V266-V269 PolarHBondContact O-N 3.5Å; V266-C270 VanDerWaalsContact O-CB 3.31Å; V266-C270 WeakPolarHBondContact O-CB 3.43Å; V266-C270 PolarHBondContact O-N 3.32Å; V266-C270 PolarHBondContact O-SG 3.4Å
267	I	94.6	Very high	94.2	Very high	33 Å²	33	50.5 Å²	50.5	17%	0.169	26%	0.257	C	S	.	.	H	α-helix	trans	-56.6	-51.8	173	-65.2	164.3	0	0	0	109.4	L255 A258 L263 T264 V269 C270 C271	L255-I267 HydrophobicContact CD1-CB 4.15Å; L255-I267 HydrophobicContact CD1-CG1 4.16Å; L255-I267 HydrophobicContact CD1-CG2 3.99Å; A258-I267 HydrophobicContact CB-CG1 4.04Å; L263-I267 WeakPolarHBondContact O-CG1 3.36Å; L263-I267 PolarHBondContact O-N 3.36Å; T264-I267 WeakPolarHBondContact O-CB 3.28Å; T264-I267 PolarHBondContact O-N 2.87Å; I267-V269 PolarHBondContact O-N 3.44Å; I267-C270 PolarHBondContact O-N 2.97Å; I267-C271 WeakPolarHBondContact O-CB 3.23Å; I267-C271 PolarHBondContact O-N 2.88Å; I267-C271 PolarHBondContact O-SG 3.4Å
268	D	93.8	Very high	94.2	Very high	77 Å²	77	51.5 Å²	51.5	41%	0.412	26%	0.262	S	S	.	.	H	α-helix	trans	-58.8	-46.4	-179.8	-60.1	-24.4	0	0	0	111.7	T264 N272	T264-D268 PolarHBondContact O-N 3.38Å; D268-N272 VanDerWaalsContact O-CB 3.31Å; D268-N272 WeakPolarHBondContact O-CB 3.3Å; D268-N272 PolarHBondContact O-N 2.8Å; D268-N272 PolarHBondContact O-ND2 2.99Å
269	V	95.1	Very high	94.2	Very high	74 Å²	74	56.4 Å²	56.4	45%	0.448	29%	0.285	S	S	.	.	H	α-helix	trans	-65	-39.9	178.8	164.6	0	0	0	0	111.9	L246 Q265 V266 I267 F273	L246-V269 HydrophobicContact CD1-CG1 3.71Å; L246-V269 HydrophobicContact CD2-CG1 4.31Å; L246-V269 HydrophobicContact CG-CG1 4.47Å; Q265-V269 WeakPolarHBondContact O-CB 3.43Å; Q265-V269 WeakPolarHBondContact O-CG2 3.44Å; Q265-V269 PolarHBondContact O-N 3.4Å; V266-V269 PolarHBondContact O-N 3.5Å; I267-V269 PolarHBondContact O-N 3.44Å; V269-F273 PolarHBondContact O-N 3.03Å; V269-F273 VanDerWaalsContact O-N 3.07Å
270	C	95	Very high	94.3	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-72.2	-40.9	178	-67.1	0	0	0	0	112.3	I251 L255 V266 I267 F273 L274	I251-C270 HydrophobicContact CD1-CB 3.75Å; L255-C270 HydrophobicContact CB-CB 4.07Å; L255-C270 HydrophobicContact CD1-CB 4.03Å; L255-C270 HydrophobicContact CG-CB 4.44Å; V266-C270 VanDerWaalsContact O-CB 3.31Å; V266-C270 WeakPolarHBondContact O-CB 3.43Å; V266-C270 PolarHBondContact O-N 3.32Å; V266-C270 PolarHBondContact O-SG 3.4Å; I267-C270 PolarHBondContact O-N 2.97Å; C270-F273 WeakPolarHBondContact O-CB 3.31Å; C270-F273 PolarHBondContact O-N 3.4Å; C270-L274 PolarHBondContact O-N 3.26Å
271	C	95	Very high	94.3	Very high	11 Å²	11	54.3 Å²	54.3	7%	0.074	28%	0.277	C	S	.	.	H	α-helix	trans	-59.8	-45.2	171.9	-73.1	0	0	0	0	111.1	I267 F273 L274 I275 L298	I267-C271 WeakPolarHBondContact O-CB 3.23Å; I267-C271 PolarHBondContact O-N 2.88Å; I267-C271 PolarHBondContact O-SG 3.4Å; C271-F273 VanDerWaalsContact C-N 3.27Å; C271-F273 PolarHBondContact O-N 3.34Å; C271-L274 PolarHBondContact O-N 2.88Å; C271-I275 WeakPolarHBondContact O-CB 3.46Å; C271-I275 VanDerWaalsContact O-CG1 3.29Å; C271-I275 WeakPolarHBondContact O-CG1 3.36Å; C271-I275 PolarHBondContact O-N 3.11Å; C271-L298 HydrophobicContact CB-CB 4.46Å
272	N	94.9	Very high	94.4	Very high	76 Å²	76	56.5 Å²	56.5	41%	0.406	29%	0.288	S	S	.	.	H	α-helix	trans	-63.4	-29.1	175.8	-88.8	-84.4	0	0	0	113.6	D268 K276	D268-N272 VanDerWaalsContact O-CB 3.31Å; D268-N272 WeakPolarHBondContact O-CB 3.3Å; D268-N272 PolarHBondContact O-N 2.8Å; D268-N272 PolarHBondContact O-ND2 2.99Å; N272-K276 WeakPolarHBondContact O-CD 3.35Å; N272-K276 VanDerWaalsContact O-CG 3.28Å; N272-K276 WeakPolarHBondContact O-CG 3.49Å; N272-K276 PolarHBondContact O-N 3.34Å
273	F	95.1	Very high	94.4	Very high	46 Å²	46	51.7 Å²	51.7	20%	0.202	27%	0.266	C	S	.	.	H	α-helix	trans	-71.4	-46.2	171.9	-176.6	-86.8	0	0	0	111.4	L246 E248 I251 V269 C270 C271 K276 Q277	L246-F273 HydrophobicContact CB-CD2 3.89Å; L246-F273 HydrophobicContact CB-CE2 4.02Å; L246-F273 HydrophobicContact CB-CG 4.35Å; L246-F273 HydrophobicContact CD1-CB 3.84Å; L246-F273 HydrophobicContact CD1-CD2 3.76Å; L246-F273 HydrophobicContact CD1-CG 4.02Å; E248-F273 HydrophobicContact CG-CE1 4.05Å; E248-F273 HydrophobicContact CG-CZ 3.96Å; I251-F273 HydrophobicContact CB-CD1 4.45Å; I251-F273 HydrophobicContact CD1-CB 4.48Å; I251-F273 HydrophobicContact CD1-CD1 4.12Å; I251-F273 HydrophobicContact CD1-CG 4.46Å; I251-F273 HydrophobicContact CG1-CD1 3.9Å; I251-F273 HydrophobicContact CG1-CE1 4.45Å; V269-F273 PolarHBondContact O-N 3.03Å; V269-F273 VanDerWaalsContact O-N 3.07Å; C270-F273 WeakPolarHBondContact O-CB 3.31Å; C270-F273 PolarHBondContact O-N 3.4Å; C271-F273 VanDerWaalsContact C-N 3.27Å; C271-F273 PolarHBondContact O-N 3.34Å; F273-K276 PolarHBondContact O-N 3.46Å; F273-Q277 HydrophobicContact CD1-CG 4.43Å; F273-Q277 HydrophobicContact CE1-CG 4.17Å; F273-Q277 WeakPolarHBondContact O-CG 3.32Å; F273-Q277 PolarHBondContact O-N 3.29Å
274	L	94.9	Very high	94.4	Very high	11 Å²	11	51.5 Å²	51.5	6%	0.058	27%	0.265	C	S	.	.	H	α-helix	trans	-64.1	-39.8	178.1	-72.2	171.2	0	0	0	112.7	I251 L255 C270 C271 K276 Q277 L278 I286 F289 L298	I251-L274 HydrophobicContact CG1-CD1 4.41Å; I251-L274 HydrophobicContact CG1-CD2 4.18Å; I251-L274 HydrophobicContact CG1-CG 4.05Å; I251-L274 HydrophobicContact CG2-CD2 3.76Å; L255-L274 HydrophobicContact CD2-CD1 3.93Å; C270-L274 PolarHBondContact O-N 3.26Å; C271-L274 PolarHBondContact O-N 2.88Å; L274-K276 VanDerWaalsContact C-N 3.29Å; L274-K276 PolarHBondContact O-N 3.3Å; L274-Q277 CarbonylContact O-C 3.58Å; L274-Q277 PolarHBondContact O-N 3.21Å; L274-L278 PolarHBondContact O-N 3.08Å; L274-I286 HydrophobicContact CD2-CD1 4.49Å; L274-F289 HydrophobicContact CD1-CD1 4.27Å; L274-F289 HydrophobicContact CD1-CE1 4.15Å; L274-L298 HydrophobicContact CB-CD1 3.79Å; L274-L298 HydrophobicContact CB-CD2 4.47Å; L274-L298 HydrophobicContact CD1-CD2 3.8Å
275	I	94.8	Very high	94.4	Very high	44 Å²	44	48.5 Å²	48.5	23%	0.226	25%	0.25	C	S	.	.	H	α-helix	trans	-59.3	-39	175.7	-72.5	165.9	0	0	0	111.5	C271 Q277 L278 L298 V301	C271-I275 WeakPolarHBondContact O-CB 3.46Å; C271-I275 VanDerWaalsContact O-CG1 3.29Å; C271-I275 WeakPolarHBondContact O-CG1 3.36Å; C271-I275 PolarHBondContact O-N 3.11Å; I275-Q277 PolarHBondContact O-N 3.13Å; I275-L278 PolarHBondContact O-N 3.34Å; I275-L298 HydrophobicContact CD1-CD1 4.44Å; I275-L298 HydrophobicContact CG1-CD1 3.75Å; I275-V301 HydrophobicContact CD1-CB 4.43Å; I275-V301 HydrophobicContact CD1-CG1 4.48Å; I275-V301 HydrophobicContact CD1-CG2 4.29Å; I275-V301 HydrophobicContact CG1-CB 4.34Å; I275-V301 HydrophobicContact CG1-CG1 4.1Å; I275-V301 HydrophobicContact CG2-CG1 4.04Å
276	K	94	Very high	94.4	Very high	166 Å²	166	42.4 Å²	42.4	72%	0.722	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-13.9	177.1	-70.2	167.9	-171.7	172.7	0	113.7	N272 F273 L274	N272-K276 WeakPolarHBondContact O-CD 3.35Å; N272-K276 VanDerWaalsContact O-CG 3.28Å; N272-K276 WeakPolarHBondContact O-CG 3.49Å; N272-K276 PolarHBondContact O-N 3.34Å; F273-K276 PolarHBondContact O-N 3.46Å; L274-K276 VanDerWaalsContact C-N 3.29Å; L274-K276 PolarHBondContact O-N 3.3Å
277	Q	93	Very high	94.4	Very high	74 Å²	74	43.5 Å²	43.5	35%	0.346	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	12.7	-176.9	-64.3	-78	24.9	0	0	112.6	E248 F273 L274 I275 H279 N282	E248-Q277 PolarHBondContact OE1-NE2 2.83Å; F273-Q277 HydrophobicContact CD1-CG 4.43Å; F273-Q277 HydrophobicContact CE1-CG 4.17Å; F273-Q277 WeakPolarHBondContact O-CG 3.32Å; F273-Q277 PolarHBondContact O-N 3.29Å; L274-Q277 CarbonylContact O-C 3.58Å; L274-Q277 PolarHBondContact O-N 3.21Å; I275-Q277 PolarHBondContact O-N 3.13Å; Q277-H279 PolarHBondContact O-N 2.95Å; Q277-N282 PolarHBondContact O-ND2 3.41Å; Q277-N282 PolarHBondContact O-OD1 3.22Å
278	L	95	Very high	94.2	Very high	24 Å²	24	44.2 Å²	44.2	13%	0.126	24%	0.236	C	C	.	.			trans	-65.8	123.3	176.3	-79.7	167.6	0	0	0	111.5	L274 I275 C283 I286 V301 A302 Y305	L274-L278 PolarHBondContact O-N 3.08Å; I275-L278 PolarHBondContact O-N 3.34Å; L278-C283 HydrophobicContact CD2-CB 3.96Å; L278-I286 HydrophobicContact CD2-CB 4.25Å; L278-I286 HydrophobicContact CD2-CD1 3.96Å; L278-I286 HydrophobicContact CD2-CG2 4.06Å; L278-V301 HydrophobicContact CD1-CG1 3.8Å; L278-A302 HydrophobicContact CD2-CB 3.98Å; L278-Y305 HydrophobicContact CB-CD1 4.44Å; L278-Y305 HydrophobicContact CB-CD2 4.16Å; L278-Y305 HydrophobicContact CB-CE2 4.24Å; L278-Y305 HydrophobicContact CB-CG 4.26Å; L278-Y305 HydrophobicContact CD1-CG 4.49Å; L278-Y305 PolarHBondContact O-OH 3.29Å
279	H	95.4	Very high	94.1	Very high	104 Å²	104	41.9 Å²	41.9	48%	0.481	22%	0.222	S	C	.	.			trans	-139.7	153.1	-179.3	-172.7	-108.2	0	0	0	109.6	Q277 S281 N282 C283 Y305	Q277-H279 PolarHBondContact O-N 2.95Å; H279-S281 PolarHBondContact ND1-OG 3.44Å; H279-S281 PolarHBondContact O-N 2.88Å; H279-N282 PolarHBondContact N-OD1 3.25Å; H279-N282 PolarHBondContact O-N 3.49Å; H279-N282 PolarHBondContact O-OD1 3.11Å; H279-C283 WeakPolarHBondContact O-CB 3.31Å; H279-C283 PolarHBondContact O-N 3.18Å; H279-Y305 WeakPolarHBondContact CA-OH 3.37Å
280	P	94.9	Very high	94.1	Very high	10 Å²	10	38.4 Å²	38.4	7%	0.065	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-10.8	-176.1	-23.5	36.7	0	0	0	114.3	Y305 H309 E312 V313 N316	P280-Y305 VanDerWaalsContact CD-OH 3.31Å; P280-Y305 WeakPolarHBondContact CD-OH 3.25Å; P280-Y305 HydrophobicContact CG-CE1 4.26Å; P280-H309 HydrophobicContact CG-CB 4.22Å; P280-E312 HydrophobicContact CB-CB 3.7Å; P280-E312 HydrophobicContact CG-CB 3.96Å; P280-V313 HydrophobicContact CB-CG2 4Å; P280-V313 WeakPolarHBondContact O-CA 3.45Å; P280-N316 PolarHBondContact O-ND2 2.86Å
281	S	93.8	Very high	93.9	Very high	50 Å²	50	41.9 Å²	41.9	35%	0.35	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-3.8	177.8	72.8	0	0	0	0	115.5	H279 N316 E318	H279-S281 PolarHBondContact ND1-OG 3.44Å; H279-S281 PolarHBondContact O-N 2.88Å; S281-N316 PolarHBondContact N-ND2 3.01Å; S281-E318 VanDerWaalsContact O-CD 3.3Å
282	N	93.6	Very high	93.7	Very high	48 Å²	48	44.3 Å²	44.3	26%	0.257	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.3	-11.5	178.4	71.9	3.8	0	0	0	113.8	Q277 H279 L284 G285 I286 E318	Q277-N282 PolarHBondContact O-ND2 3.41Å; Q277-N282 PolarHBondContact O-OD1 3.22Å; H279-N282 PolarHBondContact N-OD1 3.25Å; H279-N282 PolarHBondContact O-N 3.49Å; H279-N282 PolarHBondContact O-OD1 3.11Å; N282-L284 PolarHBondContact O-N 3.49Å; N282-G285 PolarHBondContact O-N 2.93Å; N282-G285 VanDerWaalsContact O-N 3.13Å; N282-I286 HydrophobicContact CB-CD1 4.42Å; N282-I286 WeakPolarHBondContact O-CG1 3.42Å; N282-I286 PolarHBondContact O-N 3.34Å; N282-E318 VanDerWaalsContact CA-OE2 3.3Å; N282-E318 WeakPolarHBondContact CA-OE2 3.4Å
283	C	95.1	Very high	93.5	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.7	-26.9	-175.5	60.5	0	0	0	0	113.7	L278 H279 L287 Y305 V313	L278-C283 HydrophobicContact CD2-CB 3.96Å; H279-C283 WeakPolarHBondContact O-CB 3.31Å; H279-C283 PolarHBondContact O-N 3.18Å; C283-L287 WeakPolarHBondContact O-CB 3.49Å; C283-L287 PolarHBondContact O-N 3.02Å; C283-Y305 HydrophobicContact CB-CD1 3.73Å; C283-Y305 HydrophobicContact CB-CE1 4.16Å; C283-V313 VanDerWaalsContact SG-CG2 3.53Å
284	L	94.3	Very high	93.3	Very high	8 Å²	8	43.5 Å²	43.5	4%	0.042	25%	0.249	C	C	.	.	H	α-helix	trans	-74.3	-41.8	174.3	-64.7	175.8	0	0	0	111.1	N282 L287 S288 T306 V313 E318 F319 L322 L330	N282-L284 PolarHBondContact O-N 3.49Å; L284-L287 PolarHBondContact O-N 2.93Å; L284-S288 WeakPolarHBondContact O-CB 3.46Å; L284-S288 PolarHBondContact O-N 2.89Å; L284-T306 HydrophobicContact CD2-CG2 3.64Å; L284-V313 HydrophobicContact CD1-CG1 3.52Å; L284-V313 HydrophobicContact CD2-CG1 4.04Å; L284-V313 HydrophobicContact CG-CG1 3.68Å; L284-E318 HydrophobicContact CB-CB 4.19Å; L284-E318 HydrophobicContact CD1-CB 4.08Å; L284-E318 PolarHBondContact N-OE2 3.37Å; L284-F319 HydrophobicContact CD1-CB 3.85Å; L284-F319 HydrophobicContact CD1-CD2 4.35Å; L284-L322 HydrophobicContact CD1-CD1 3.92Å; L284-L322 HydrophobicContact CD1-CG 4.4Å; L284-L322 HydrophobicContact CD2-CD1 4.21Å; L284-L330 HydrophobicContact CD2-CD1 4.1Å
285	G	92	Very high	93.2	Very high	20 Å²	20	43.5 Å²	43.5	21%	0.206	25%	0.25	C	S	.	.	H	α-helix	trans	-57.6	-49.8	169.6	0	0	0	0	0	112.3	N282 L287 S288 F289 E318	N282-G285 PolarHBondContact O-N 2.93Å; N282-G285 VanDerWaalsContact O-N 3.13Å; G285-L287 PolarHBondContact O-N 3Å; G285-S288 PolarHBondContact O-N 3.49Å; G285-F289 VanDerWaalsContact O-CB 3.27Å; G285-F289 WeakPolarHBondContact O-CB 3.2Å; G285-F289 PolarHBondContact O-N 3.38Å; G285-E318 PolarHBondContact N-OE2 3.22Å
286	I	93.8	Very high	93.1	Very high	12 Å²	12	45.4 Å²	45.4	6%	0.062	26%	0.264	C	S	.	.	H	α-helix	trans	-64.4	-39.3	178.8	-65.7	169.3	0	0	0	111.4	L274 L278 N282 F289 G290 L298 A302	L274-I286 HydrophobicContact CD2-CD1 4.49Å; L278-I286 HydrophobicContact CD2-CB 4.25Å; L278-I286 HydrophobicContact CD2-CD1 3.96Å; L278-I286 HydrophobicContact CD2-CG2 4.06Å; N282-I286 HydrophobicContact CB-CD1 4.42Å; N282-I286 WeakPolarHBondContact O-CG1 3.42Å; N282-I286 PolarHBondContact O-N 3.34Å; I286-F289 PolarHBondContact O-N 3.28Å; I286-G290 PolarHBondContact O-N 3.2Å; I286-L298 HydrophobicContact CG2-CD1 3.8Å; I286-L298 HydrophobicContact CG2-CD2 4.29Å; I286-L298 HydrophobicContact CG2-CG 4.04Å; I286-A302 HydrophobicContact CG2-CB 4.13Å
287	L	93.7	Very high	93	Very high	25 Å²	25	43.6 Å²	43.6	13%	0.131	26%	0.258	C	S	.	.	H	α-helix	trans	-61.5	-49.5	174.9	175.1	60.5	0	0	0	111.9	C283 L284 G285 F289 G290 D291 Q299 A302 H303	C283-L287 WeakPolarHBondContact O-CB 3.49Å; C283-L287 PolarHBondContact O-N 3.02Å; L284-L287 PolarHBondContact O-N 2.93Å; G285-L287 PolarHBondContact O-N 3Å; L287-F289 VanDerWaalsContact C-N 3.29Å; L287-F289 PolarHBondContact O-N 2.9Å; L287-G290 PolarHBondContact O-N 2.94Å; L287-D291 PolarHBondContact O-N 2.89Å; L287-D291 VanDerWaalsContact O-N 3.08Å; L287-Q299 HydrophobicContact CD1-CG 3.71Å; L287-Q299 WeakPolarHBondContact CD1-O 3.21Å; L287-A302 HydrophobicContact CB-CB 3.97Å; L287-A302 HydrophobicContact CD1-CB 4.39Å; L287-H303 HydrophobicContact CD1-CB 3.82Å
288	S	91.9	Very high	93.1	Very high	48 Å²	48	40 Å²	40	34%	0.336	24%	0.241	S	C	.	.	H	α-helix	trans	-66.6	-31.4	177.9	-174.7	0	0	0	0	112.4	L284 G285 A292	L284-S288 WeakPolarHBondContact O-CB 3.46Å; L284-S288 PolarHBondContact O-N 2.89Å; G285-S288 PolarHBondContact O-N 3.49Å; S288-A292 WeakPolarHBondContact O-CB 3.47Å; S288-A292 PolarHBondContact O-N 2.89Å; S288-A292 VanDerWaalsContact O-N 3.12Å
289	F	92	Very high	93.1	Very high	29 Å²	29	41 Å²	41	13%	0.127	25%	0.245	C	C	.	.	H	α-helix	trans	-72.6	-40.9	175.7	-178	-121.7	0	0	0	111.6	E252 L255 A256 L274 G285 I286 L287 D291 A292 Q293	E252-F289 HydrophobicContact CB-CE1 4.27Å; E252-F289 HydrophobicContact CB-CE2 4.33Å; E252-F289 HydrophobicContact CB-CZ 4.02Å; E252-F289 HydrophobicContact CG-CD1 4.49Å; E252-F289 HydrophobicContact CG-CE1 4.28Å; E252-F289 HydrophobicContact CG-CZ 4.48Å; E252-F289 VanDerWaalsContact O-CZ 3.23Å; E252-F289 WeakPolarHBondContact O-CZ 3.25Å; L255-F289 HydrophobicContact CB-CE1 4.15Å; L255-F289 HydrophobicContact CB-CZ 4.19Å; L255-F289 HydrophobicContact CD2-CE1 3.8Å; L255-F289 HydrophobicContact CD2-CZ 4.42Å; L255-F289 HydrophobicContact CG-CE1 4.27Å; L255-F289 HydrophobicContact CG-CZ 4.43Å; A256-F289 HydrophobicContact CB-CE2 4.48Å; A256-F289 HydrophobicContact CB-CZ 4.46Å; L274-F289 HydrophobicContact CD1-CD1 4.27Å; L274-F289 HydrophobicContact CD1-CE1 4.15Å; G285-F289 VanDerWaalsContact O-CB 3.27Å; G285-F289 WeakPolarHBondContact O-CB 3.2Å; G285-F289 PolarHBondContact O-N 3.38Å; I286-F289 PolarHBondContact O-N 3.28Å; L287-F289 VanDerWaalsContact C-N 3.29Å; L287-F289 PolarHBondContact O-N 2.9Å; F289-D291 PolarHBondContact O-N 3.29Å; F289-A292 PolarHBondContact O-N 3.42Å; F289-Q293 HydrophobicContact CD2-CG 4.02Å; F289-Q293 HydrophobicContact CE1-CG 4.38Å; F289-Q293 HydrophobicContact CE2-CG 3.54Å; F289-Q293 HydrophobicContact CZ-CG 3.72Å; F289-Q293 WeakPolarHBondContact O-CG 3.28Å; F289-Q293 PolarHBondContact O-N 3.28Å
290	G	93.3	Very high	93	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.7	-43.7	173.1	0	0	0	0	0	113	I286 L287 Q293 G294 C295	I286-G290 PolarHBondContact O-N 3.2Å; L287-G290 PolarHBondContact O-N 2.94Å; G290-Q293 PolarHBondContact O-N 3.23Å; G290-G294 PolarHBondContact O-N 3.35Å; G290-G294 VanDerWaalsContact O-N 3.11Å; G290-C295 PolarHBondContact O-N 3.21Å
291	D	91.4	Very high	93	Very high	74 Å²	74	42.6 Å²	42.6	40%	0.396	26%	0.259	S	S	.	.	H	α-helix	trans	-58.8	-48.9	172.9	-160	32	0	0	0	110.9	L287 F289 Q293 G294 Q299 K329	L287-D291 PolarHBondContact O-N 2.89Å; L287-D291 VanDerWaalsContact O-N 3.08Å; F289-D291 PolarHBondContact O-N 3.29Å; D291-Q293 VanDerWaalsContact C-N 3.34Å; D291-Q293 PolarHBondContact O-N 3.13Å; D291-G294 PolarHBondContact O-N 2.97Å; D291-Q299 PolarHBondContact OD1-NE2 3.13Å; D291-K329 IonicContact OD2-NZ 3.54Å
292	A	90.6	Very high	93.1	Very high	62 Å²	62	40.2 Å²	40.2	51%	0.512	24%	0.242	S	C	.	.	H	α-helix	trans	-66.6	-26.9	-178.2	0	0	0	0	0	114.9	S288 F289	S288-A292 WeakPolarHBondContact O-CB 3.47Å; S288-A292 PolarHBondContact O-N 2.89Å; S288-A292 VanDerWaalsContact O-N 3.12Å; F289-A292 PolarHBondContact O-N 3.42Å
293	Q	91.1	Very high	93.1	Very high	49 Å²	49	41.1 Å²	41.1	23%	0.229	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	1.1	176	-57.5	-49.8	-50.7	0	0	113.6	F289 G290 D291 C295	F289-Q293 HydrophobicContact CD2-CG 4.02Å; F289-Q293 HydrophobicContact CE1-CG 4.38Å; F289-Q293 HydrophobicContact CE2-CG 3.54Å; F289-Q293 HydrophobicContact CZ-CG 3.72Å; F289-Q293 WeakPolarHBondContact O-CG 3.28Å; F289-Q293 PolarHBondContact O-N 3.28Å; G290-Q293 PolarHBondContact O-N 3.23Å; D291-Q293 VanDerWaalsContact C-N 3.34Å; D291-Q293 PolarHBondContact O-N 3.13Å; Q293-C295 PolarHBondContact O-N 3.19Å
294	G	90.4	Very high	93.1	Very high	55 Å²	55	47.5 Å²	47.5	57%	0.567	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	18.1	-174.5	0	0	0	0	0	114.4	G290 D291 V296	G290-G294 PolarHBondContact O-N 3.35Å; G290-G294 VanDerWaalsContact O-N 3.11Å; D291-G294 PolarHBondContact O-N 2.97Å; G294-V296 VanDerWaalsContact C-N 3.29Å; G294-V296 PolarHBondContact O-N 2.96Å
295	C	92.7	Very high	93.2	Very high	11 Å²	11	49.5 Å²	49.5	7%	0.074	28%	0.279	C	S	.	.			trans	-81	72	-178	-68.1	0	0	0	0	110.9	C259 G290 Q293 E297 L298 Q299	C259-C295 VanDerWaalsContact SG-SG 3.67Å; G290-C295 PolarHBondContact O-N 3.21Å; Q293-C295 PolarHBondContact O-N 3.19Å; C295-E297 VanDerWaalsContact C-N 3.29Å; C295-E297 PolarHBondContact O-N 3.4Å; C295-L298 HydrophobicContact CB-CB 4.05Å; C295-L298 HydrophobicContact CB-CD2 4.43Å; C295-L298 WeakPolarHBondContact O-CB 3.43Å; C295-L298 PolarHBondContact O-N 2.96Å; C295-L298 VanDerWaalsContact O-N 3.11Å; C295-Q299 WeakPolarHBondContact O-CB 3.28Å; C295-Q299 PolarHBondContact O-N 3.42Å
296	V	92.6	Very high	93.3	Very high	84 Å²	84	48.6 Å²	48.6	51%	0.509	27%	0.27	S	S	.	.	H	α-helix	trans	-54.8	-36.5	-171.5	177.4	0	0	0	0	113.6	G294 N300	G294-V296 VanDerWaalsContact C-N 3.29Å; G294-V296 PolarHBondContact O-N 2.96Å; V296-N300 WeakPolarHBondContact CG1-ND2 3.42Å; V296-N300 WeakPolarHBondContact O-CB 3.46Å; V296-N300 VanDerWaalsContact O-CG 3.25Å; V296-N300 PolarHBondContact O-N 3.43Å; V296-N300 PolarHBondContact O-ND2 3.48Å
297	E	92.6	Very high	93.4	Very high	128 Å²	128	48.3 Å²	48.3	60%	0.598	27%	0.268	S	S	*	.	H	α-helix	trans	-66	-51.1	176.2	-174.4	176.7	179.4	0	0	111.8	C295 Q299 N300 V301	C295-E297 VanDerWaalsContact C-N 3.29Å; C295-E297 PolarHBondContact O-N 3.4Å; E297-Q299 VanDerWaalsContact C-N 3.28Å; E297-Q299 PolarHBondContact O-N 3.35Å; E297-N300 PolarHBondContact O-N 3.43Å; E297-V301 WeakPolarHBondContact O-CG2 3.28Å; E297-V301 PolarHBondContact O-N 3.33Å
298	L	94.8	Very high	93.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-57.3	-43.5	176.4	-179.4	65.5	0	0	0	111.2	L255 C271 L274 I275 I286 C295 V301 A302	L255-L298 HydrophobicContact CD2-CD2 4.15Å; C271-L298 HydrophobicContact CB-CB 4.46Å; L274-L298 HydrophobicContact CB-CD1 3.79Å; L274-L298 HydrophobicContact CB-CD2 4.47Å; L274-L298 HydrophobicContact CD1-CD2 3.8Å; I275-L298 HydrophobicContact CD1-CD1 4.44Å; I275-L298 HydrophobicContact CG1-CD1 3.75Å; I286-L298 HydrophobicContact CG2-CD1 3.8Å; I286-L298 HydrophobicContact CG2-CD2 4.29Å; I286-L298 HydrophobicContact CG2-CG 4.04Å; C295-L298 HydrophobicContact CB-CB 4.05Å; C295-L298 HydrophobicContact CB-CD2 4.43Å; C295-L298 WeakPolarHBondContact O-CB 3.43Å; C295-L298 PolarHBondContact O-N 2.96Å; C295-L298 VanDerWaalsContact O-N 3.11Å; L298-V301 PolarHBondContact O-N 3.19Å; L298-A302 VanDerWaalsContact O-CB 3.23Å; L298-A302 WeakPolarHBondContact O-CB 3.4Å; L298-A302 PolarHBondContact O-N 2.98Å
299	Q	94.4	Very high	93.5	Very high	44 Å²	44	50.8 Å²	50.8	21%	0.206	27%	0.274	C	S	.	.	H	α-helix	trans	-59.4	-48.7	176	-170.2	-174.2	24.2	0	0	111.6	L287 D291 C295 E297 A302 H303	L287-Q299 HydrophobicContact CD1-CG 3.71Å; L287-Q299 WeakPolarHBondContact CD1-O 3.21Å; D291-Q299 PolarHBondContact OD1-NE2 3.13Å; C295-Q299 WeakPolarHBondContact O-CB 3.28Å; C295-Q299 PolarHBondContact O-N 3.42Å; E297-Q299 VanDerWaalsContact C-N 3.28Å; E297-Q299 PolarHBondContact O-N 3.35Å; Q299-A302 PolarHBondContact O-N 3.36Å; Q299-H303 VanDerWaalsContact O-CB 3.25Å; Q299-H303 WeakPolarHBondContact O-CB 3.38Å; Q299-H303 PolarHBondContact O-N 3.07Å
300	N	93.5	Very high	93.7	Very high	97 Å²	97	49.5 Å²	49.5	52%	0.519	27%	0.268	S	S	.	.	H	α-helix	trans	-64	-41.9	179.5	-78.9	-38	0	0	0	112.6	V296 E297 K304	V296-N300 WeakPolarHBondContact CG1-ND2 3.42Å; V296-N300 WeakPolarHBondContact O-CB 3.46Å; V296-N300 VanDerWaalsContact O-CG 3.25Å; V296-N300 PolarHBondContact O-N 3.43Å; V296-N300 PolarHBondContact O-ND2 3.48Å; E297-N300 PolarHBondContact O-N 3.43Å; N300-K304 WeakPolarHBondContact O-CB 3.49Å; N300-K304 PolarHBondContact O-N 2.96Å
301	V	95.6	Very high	93.7	Very high	51 Å²	51	52.7 Å²	52.7	31%	0.309	29%	0.285	S	S	.	.	H	α-helix	trans	-68	-45.2	178.1	178.4	0	0	0	0	110.8	I275 L278 E297 L298 H303 K304 Y305	I275-V301 HydrophobicContact CD1-CB 4.43Å; I275-V301 HydrophobicContact CD1-CG1 4.48Å; I275-V301 HydrophobicContact CD1-CG2 4.29Å; I275-V301 HydrophobicContact CG1-CB 4.34Å; I275-V301 HydrophobicContact CG1-CG1 4.1Å; I275-V301 HydrophobicContact CG2-CG1 4.04Å; L278-V301 HydrophobicContact CD1-CG1 3.8Å; E297-V301 WeakPolarHBondContact O-CG2 3.28Å; E297-V301 PolarHBondContact O-N 3.33Å; L298-V301 PolarHBondContact O-N 3.19Å; V301-H303 PolarHBondContact O-N 3.31Å; V301-K304 PolarHBondContact O-N 3.42Å; V301-Y305 WeakPolarHBondContact O-CB 3.46Å; V301-Y305 PolarHBondContact O-N 3.05Å
302	A	95.8	Very high	93.9	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.9	-38.1	175.9	0	0	0	0	0	112.5	L278 I286 L287 L298 Q299 T306	L278-A302 HydrophobicContact CD2-CB 3.98Å; I286-A302 HydrophobicContact CG2-CB 4.13Å; L287-A302 HydrophobicContact CB-CB 3.97Å; L287-A302 HydrophobicContact CD1-CB 4.39Å; L298-A302 VanDerWaalsContact O-CB 3.23Å; L298-A302 WeakPolarHBondContact O-CB 3.4Å; L298-A302 PolarHBondContact O-N 2.98Å; Q299-A302 PolarHBondContact O-N 3.36Å; A302-T306 WeakPolarHBondContact O-CB 3.35Å; A302-T306 PolarHBondContact O-N 3.12Å; A302-T306 PolarHBondContact O-OG1 3.35Å
303	H	94.6	Very high	94.1	Very high	66 Å²	66	50.7 Å²	50.7	31%	0.306	26%	0.262	S	S	.	.	H	α-helix	trans	-64.6	-48.6	174.6	-179.4	-106.3	0	0	0	111.4	L287 Q299 V301 Y305 T306 M307	L287-H303 HydrophobicContact CD1-CB 3.82Å; Q299-H303 VanDerWaalsContact O-CB 3.25Å; Q299-H303 WeakPolarHBondContact O-CB 3.38Å; Q299-H303 PolarHBondContact O-N 3.07Å; V301-H303 PolarHBondContact O-N 3.31Å; H303-Y305 VanDerWaalsContact C-N 3.32Å; H303-Y305 PolarHBondContact O-N 3.26Å; H303-T306 WeakPolarHBondContact O-CB 3.4Å; H303-T306 PolarHBondContact O-N 2.9Å; H303-T306 VanDerWaalsContact O-N 3.14Å; H303-M307 WeakPolarHBondContact O-CG 3.22Å; H303-M307 PolarHBondContact O-N 3.13Å
304	K	94.1	Very high	94.3	Very high	135 Å²	135	49.2 Å²	49.2	59%	0.587	26%	0.257	S	S	*	.	H	α-helix	trans	-57.7	-45.2	176.8	-175.5	-178.4	176.6	-176.2	0	111.5	N300 V301 T306 M307 E308	N300-K304 WeakPolarHBondContact O-CB 3.49Å; N300-K304 PolarHBondContact O-N 2.96Å; V301-K304 PolarHBondContact O-N 3.42Å; K304-T306 PolarHBondContact O-N 3.15Å; K304-M307 PolarHBondContact O-N 2.98Å; K304-E308 WeakPolarHBondContact O-CB 3.39Å; K304-E308 PolarHBondContact O-N 3.36Å
305	Y	95.8	Very high	94.4	Very high	49 Å²	49	53.4 Å²	53.4	19%	0.192	26%	0.259	C	S	.	.	H	α-helix	trans	-60.2	-44.4	175.2	-173.3	-84.6	0	0	0	111.9	L278 H279 P280 C283 V301 H303 M307 E308 H309	L278-Y305 HydrophobicContact CB-CD1 4.44Å; L278-Y305 HydrophobicContact CB-CD2 4.16Å; L278-Y305 HydrophobicContact CB-CE2 4.24Å; L278-Y305 HydrophobicContact CB-CG 4.26Å; L278-Y305 HydrophobicContact CD1-CG 4.49Å; L278-Y305 PolarHBondContact O-OH 3.29Å; H279-Y305 WeakPolarHBondContact CA-OH 3.37Å; P280-Y305 VanDerWaalsContact CD-OH 3.31Å; P280-Y305 WeakPolarHBondContact CD-OH 3.25Å; P280-Y305 HydrophobicContact CG-CE1 4.26Å; C283-Y305 HydrophobicContact CB-CD1 3.73Å; C283-Y305 HydrophobicContact CB-CE1 4.16Å; V301-Y305 WeakPolarHBondContact O-CB 3.46Å; V301-Y305 PolarHBondContact O-N 3.05Å; H303-Y305 VanDerWaalsContact C-N 3.32Å; H303-Y305 PolarHBondContact O-N 3.26Å; Y305-M307 VanDerWaalsContact C-N 3.34Å; Y305-M307 PolarHBondContact O-N 3.4Å; Y305-E308 PolarHBondContact O-N 3.11Å; Y305-H309 AromaticContact CD2-CD2 3.93Å; Y305-H309 HydrophobicContact CE1-CB 4.2Å; Y305-H309 AromaticContact CE1-CD2 3.95Å; Y305-H309 AromaticContact CE2-CD2 3.65Å; Y305-H309 AromaticContact CE2-NE2 3.75Å; Y305-H309 AromaticContact CZ-CD2 3.66Å; Y305-H309 AromaticContact CZ-NE2 3.98Å; Y305-H309 PolarHBondContact O-N 2.91Å
306	T	95.6	Very high	94.5	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-61	-40.1	176.9	-59	0	0	0	0	112.2	L284 A302 H303 K304 F310 V313 L330	L284-T306 HydrophobicContact CD2-CG2 3.64Å; A302-T306 WeakPolarHBondContact O-CB 3.35Å; A302-T306 PolarHBondContact O-N 3.12Å; A302-T306 PolarHBondContact O-OG1 3.35Å; H303-T306 WeakPolarHBondContact O-CB 3.4Å; H303-T306 PolarHBondContact O-N 2.9Å; H303-T306 VanDerWaalsContact O-N 3.14Å; K304-T306 PolarHBondContact O-N 3.15Å; T306-F310 WeakPolarHBondContact O-CA 3.49Å; T306-F310 PolarHBondContact O-N 3.17Å; T306-V313 HydrophobicContact CG2-CG1 4.41Å; T306-L330 HydrophobicContact CG2-CD2 3.92Å
307	M	94.6	Very high	94.3	Very high	6 Å²	6	55.9 Å²	55.9	3%	0.03	27%	0.266	C	S	.	.	H	α-helix	trans	-67.7	-38	175.3	-66.5	-61	101.3	0	0	112.1	H303 K304 Y305 L330 S333 I336 N337	H303-M307 WeakPolarHBondContact O-CG 3.22Å; H303-M307 PolarHBondContact O-N 3.13Å; K304-M307 PolarHBondContact O-N 2.98Å; Y305-M307 VanDerWaalsContact C-N 3.34Å; Y305-M307 PolarHBondContact O-N 3.4Å; M307-L330 HydrophobicContact CE-CD2 3.52Å; M307-S333 VanDerWaalsContact SD-CB 3.54Å; M307-S333 PolarHBondContact SD-OG 3.17Å; M307-I336 HydrophobicContact CE-CG1 4.43Å; M307-I336 HydrophobicContact SD-CB 4.44Å; M307-I336 HydrophobicContact SD-CG1 3.67Å; M307-N337 WeakPolarHBondContact O-CB 3.43Å; M307-N337 PolarHBondContact O-N 3.13Å
308	E	93.8	Very high	94.3	Very high	66 Å²	66	52.1 Å²	52.1	31%	0.308	25%	0.248	S	C	.	.	H	α-helix	trans	-72.9	-40.4	-178.3	-173.4	133.2	-118.8	0	0	112.9	K304 Y305 N337 R451	K304-E308 WeakPolarHBondContact O-CB 3.39Å; K304-E308 PolarHBondContact O-N 3.36Å; Y305-E308 PolarHBondContact O-N 3.11Å; E308-N337 WeakPolarHBondContact O-CB 3.34Å; E308-N337 PolarHBondContact O-ND2 3.32Å; E308-R451 VanDerWaalsContact CD-NH1 3.32Å; E308-R451 IonicContact OE1-CZ 2.68Å; E308-R451 IonicContact OE1-NH1 2.68Å; E308-R451 PolarHBondContact OE1-NH1 2.84Å; E308-R451 IonicContact OE1-NH2 3.71Å; E308-R451 PolarHBondContact OE1-NH2 3.47Å; E308-R451 IonicContact OE2-NH1 3.45Å
309	H	95.1	Very high	94.2	Very high	60 Å²	60	52.2 Å²	52.2	28%	0.278	25%	0.248	S	C	.	.	S	Bend	trans	-100.7	17	-178.1	-72.3	-91.6	0	0	0	114.1	P280 Y305 I311 E312 V313	P280-H309 HydrophobicContact CG-CB 4.22Å; Y305-H309 AromaticContact CD2-CD2 3.93Å; Y305-H309 HydrophobicContact CE1-CB 4.2Å; Y305-H309 AromaticContact CE1-CD2 3.95Å; Y305-H309 AromaticContact CE2-CD2 3.65Å; Y305-H309 AromaticContact CE2-NE2 3.75Å; Y305-H309 AromaticContact CZ-CD2 3.66Å; Y305-H309 AromaticContact CZ-NE2 3.98Å; Y305-H309 PolarHBondContact O-N 2.91Å; H309-I311 VanDerWaalsContact C-N 3.28Å; H309-I311 PolarHBondContact O-N 3.48Å; H309-E312 IonicContact CE1-OE2 3.86Å; H309-E312 IonicContact CG-OE2 3.56Å; H309-E312 IonicContact ND1-OE2 2.63Å; H309-E312 PolarHBondContact ND1-OE2 3.21Å; H309-E312 WeakPolarHBondContact O-CA 3.43Å; H309-E312 WeakPolarHBondContact O-CB 3.41Å; H309-E312 PolarHBondContact O-N 3.23Å; H309-V313 HydrophobicContact CB-CG2 4.34Å; H309-V313 WeakPolarHBondContact O-CG2 3.43Å; H309-V313 PolarHBondContact O-N 3.11Å
310	F	95.1	Very high	94.1	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.009	24%	0.244	C	C	.	.	H	α-helix	trans	-49.5	-41.2	-169.5	-173.7	-99.4	0	0	0	114.9	T306 E312 V313 V314 I336 V338 I344 A347	T306-F310 WeakPolarHBondContact O-CA 3.49Å; T306-F310 PolarHBondContact O-N 3.17Å; F310-E312 PolarHBondContact O-N 3.43Å; F310-V313 PolarHBondContact O-N 2.92Å; F310-V314 HydrophobicContact CD1-CG2 3.95Å; F310-V314 HydrophobicContact CD2-CG2 4.37Å; F310-V314 HydrophobicContact CE1-CG2 3.57Å; F310-V314 HydrophobicContact CE2-CG2 4.03Å; F310-V314 HydrophobicContact CG-CG2 4.34Å; F310-V314 HydrophobicContact CZ-CG2 3.61Å; F310-V314 WeakPolarHBondContact O-CG2 3.46Å; F310-V314 PolarHBondContact O-N 2.84Å; F310-I336 HydrophobicContact CB-CG2 3.8Å; F310-I336 HydrophobicContact CD1-CG2 3.49Å; F310-I336 VanDerWaalsContact CD1-CG2 3.49Å; F310-I336 HydrophobicContact CD2-CG2 3.89Å; F310-I336 HydrophobicContact CE1-CG2 3.96Å; F310-I336 HydrophobicContact CE2-CG2 4.32Å; F310-I336 HydrophobicContact CG-CG2 3.44Å; F310-I336 VanDerWaalsContact CG-CG2 3.44Å; F310-I336 HydrophobicContact CZ-CG2 4.35Å; F310-V338 HydrophobicContact CD1-CG1 3.87Å; F310-V338 HydrophobicContact CE1-CG1 4.43Å; F310-I344 HydrophobicContact CE1-CG1 4.08Å; F310-A347 HydrophobicContact CE1-CB 4.37Å
311	I	94.7	Very high	94	Very high	67 Å²	67	48.8 Å²	48.8	34%	0.344	23%	0.231	S	C	.	.	H	α-helix	trans	-62.3	-25.2	178.8	-53.7	172.1	0	0	0	112.4	H309 K315 V338 T343	H309-I311 VanDerWaalsContact C-N 3.28Å; H309-I311 PolarHBondContact O-N 3.48Å; I311-K315 WeakPolarHBondContact O-CD 3.47Å; I311-K315 WeakPolarHBondContact O-CE 3.48Å; I311-K315 PolarHBondContact O-NZ 2.88Å; I311-K315 VanDerWaalsContact O-NZ 3.08Å; I311-V338 HydrophobicContact CG1-CG1 4.12Å; I311-T343 HydrophobicContact CG1-CG2 4.42Å
312	E	95.2	Very high	93.9	Very high	93 Å²	93	47 Å²	47	44%	0.435	22%	0.22	S	C	.	.	H	α-helix	trans	-90.4	-41.6	176.2	-59.3	176.9	148.1	0	0	110.5	P280 H309 F310 V314 K315 N316	P280-E312 HydrophobicContact CB-CB 3.7Å; P280-E312 HydrophobicContact CG-CB 3.96Å; H309-E312 IonicContact CE1-OE2 3.86Å; H309-E312 IonicContact CG-OE2 3.56Å; H309-E312 IonicContact ND1-OE2 2.63Å; H309-E312 PolarHBondContact ND1-OE2 3.21Å; H309-E312 WeakPolarHBondContact O-CA 3.43Å; H309-E312 WeakPolarHBondContact O-CB 3.41Å; H309-E312 PolarHBondContact O-N 3.23Å; F310-E312 PolarHBondContact O-N 3.43Å; E312-V314 PolarHBondContact O-N 3.07Å; E312-K315 WeakPolarHBondContact O-CB 3.28Å; E312-K315 PolarHBondContact O-N 3.12Å; E312-N316 PolarHBondContact O-ND2 3.06Å; E312-N316 VanDerWaalsContact O-ND2 3.14Å
313	V	95.2	Very high	93.7	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-58.4	-45.4	178.3	178.1	0	0	0	0	112.5	P280 C283 L284 T306 H309 F310 K315 N316	P280-V313 HydrophobicContact CB-CG2 4Å; P280-V313 WeakPolarHBondContact O-CA 3.45Å; C283-V313 VanDerWaalsContact SG-CG2 3.53Å; L284-V313 HydrophobicContact CD1-CG1 3.52Å; L284-V313 HydrophobicContact CD2-CG1 4.04Å; L284-V313 HydrophobicContact CG-CG1 3.68Å; T306-V313 HydrophobicContact CG2-CG1 4.41Å; H309-V313 HydrophobicContact CB-CG2 4.34Å; H309-V313 WeakPolarHBondContact O-CG2 3.43Å; H309-V313 PolarHBondContact O-N 3.11Å; F310-V313 PolarHBondContact O-N 2.92Å; V313-K315 PolarHBondContact O-N 3.03Å; V313-K315 VanDerWaalsContact O-N 3.08Å; V313-N316 PolarHBondContact O-N 3.32Å
314	V	94.3	Very high	93.6	Very high	18 Å²	18	46.9 Å²	46.9	11%	0.109	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-23.6	-179.3	164.6	0	0	0	0	113.6	F310 E312 F319 A347	F310-V314 HydrophobicContact CD1-CG2 3.95Å; F310-V314 HydrophobicContact CD2-CG2 4.37Å; F310-V314 HydrophobicContact CE1-CG2 3.57Å; F310-V314 HydrophobicContact CE2-CG2 4.03Å; F310-V314 HydrophobicContact CG-CG2 4.34Å; F310-V314 HydrophobicContact CZ-CG2 3.61Å; F310-V314 WeakPolarHBondContact O-CG2 3.46Å; F310-V314 PolarHBondContact O-N 2.84Å; E312-V314 PolarHBondContact O-N 3.07Å; V314-F319 HydrophobicContact CB-CD1 4.36Å; V314-F319 HydrophobicContact CB-CE1 4.39Å; V314-F319 HydrophobicContact CG1-CD1 4.24Å; V314-F319 HydrophobicContact CG1-CE1 4.03Å; V314-F319 HydrophobicContact CG2-CD1 4.38Å; V314-F319 HydrophobicContact CG2-CD2 4.34Å; V314-F319 HydrophobicContact CG2-CE1 4.12Å; V314-F319 HydrophobicContact CG2-CE2 4.08Å; V314-F319 HydrophobicContact CG2-CG 4.49Å; V314-F319 HydrophobicContact CG2-CZ 3.97Å; V314-A347 HydrophobicContact CB-CB 4.34Å; V314-A347 HydrophobicContact CG1-CB 3.52Å; V314-A347 HydrophobicContact CG2-CB 3.82Å
315	K	93.1	Very high	93.5	Very high	142 Å²	142	45.1 Å²	45.1	62%	0.617	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-16.5	179.4	-61.1	166	-176.5	149.4	0	112.9	I311 E312 V313	I311-K315 WeakPolarHBondContact O-CD 3.47Å; I311-K315 WeakPolarHBondContact O-CE 3.48Å; I311-K315 PolarHBondContact O-NZ 2.88Å; I311-K315 VanDerWaalsContact O-NZ 3.08Å; E312-K315 WeakPolarHBondContact O-CB 3.28Å; E312-K315 PolarHBondContact O-N 3.12Å; V313-K315 PolarHBondContact O-N 3.03Å; V313-K315 VanDerWaalsContact O-N 3.08Å
316	N	94.2	Very high	93.3	Very high	49 Å²	49	45.1 Å²	45.1	26%	0.262	23%	0.225	S	C	.	.	S	Bend	trans	-90.9	153.1	-173.4	-67.8	-53.2	0	0	0	112.8	P280 S281 E312 V313 E318 F319	P280-N316 PolarHBondContact O-ND2 2.86Å; S281-N316 PolarHBondContact N-ND2 3.01Å; E312-N316 PolarHBondContact O-ND2 3.06Å; E312-N316 VanDerWaalsContact O-ND2 3.14Å; V313-N316 PolarHBondContact O-N 3.32Å; N316-E318 VanDerWaalsContact C-N 3.27Å; N316-E318 PolarHBondContact O-N 3.01Å; N316-F319 PolarHBondContact O-N 3.24Å
317	Q	89.6	Confident	93.3	Very high	99 Å²	99	45.1 Å²	45.1	46%	0.463	23%	0.225	S	C	.	.	H	α-helix	trans	-64.6	-27.2	-174.2	-166.5	177.8	4.9	0	0	113.5	F319 L320 L321	Q317-F319 VanDerWaalsContact C-N 3.3Å; Q317-F319 PolarHBondContact O-N 3.27Å; Q317-L320 PolarHBondContact O-N 2.85Å; Q317-L321 HydrophobicContact CG-CD1 4.03Å; Q317-L321 HydrophobicContact CG-CG 4.44Å; Q317-L321 WeakPolarHBondContact O-CG 3.4Å; Q317-L321 PolarHBondContact O-N 3.26Å
318	E	91.2	Very high	93.2	Very high	48 Å²	48	45.1 Å²	45.1	22%	0.224	23%	0.226	C	C	.	.	H	α-helix	trans	-57	-42.9	175.7	-64.6	-157.3	140.4	0	0	111.9	S281 N282 L284 G285 N316 L320 L321 L322	S281-E318 VanDerWaalsContact O-CD 3.3Å; N282-E318 VanDerWaalsContact CA-OE2 3.3Å; N282-E318 WeakPolarHBondContact CA-OE2 3.4Å; L284-E318 HydrophobicContact CB-CB 4.19Å; L284-E318 HydrophobicContact CD1-CB 4.08Å; L284-E318 PolarHBondContact N-OE2 3.37Å; G285-E318 PolarHBondContact N-OE2 3.22Å; N316-E318 VanDerWaalsContact C-N 3.27Å; N316-E318 PolarHBondContact O-N 3.01Å; E318-L320 PolarHBondContact O-N 3.26Å; E318-L321 PolarHBondContact O-N 3.18Å; E318-L322 PolarHBondContact O-N 3.11Å
319	F	93.8	Very high	93.1	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.009	23%	0.234	C	C	.	.	H	α-helix	trans	-60.2	-44.7	179.1	179.7	-104.1	0	0	0	111.7	L284 V314 N316 Q317 L321 L322 I327 A347 W351	L284-F319 HydrophobicContact CD1-CB 3.85Å; L284-F319 HydrophobicContact CD1-CD2 4.35Å; V314-F319 HydrophobicContact CB-CD1 4.36Å; V314-F319 HydrophobicContact CB-CE1 4.39Å; V314-F319 HydrophobicContact CG1-CD1 4.24Å; V314-F319 HydrophobicContact CG1-CE1 4.03Å; V314-F319 HydrophobicContact CG2-CD1 4.38Å; V314-F319 HydrophobicContact CG2-CD2 4.34Å; V314-F319 HydrophobicContact CG2-CE1 4.12Å; V314-F319 HydrophobicContact CG2-CE2 4.08Å; V314-F319 HydrophobicContact CG2-CG 4.49Å; V314-F319 HydrophobicContact CG2-CZ 3.97Å; N316-F319 PolarHBondContact O-N 3.24Å; Q317-F319 VanDerWaalsContact C-N 3.3Å; Q317-F319 PolarHBondContact O-N 3.27Å; F319-L321 PolarHBondContact O-N 3.14Å; F319-L322 HydrophobicContact CD2-CD1 4.32Å; F319-L322 PolarHBondContact O-N 2.82Å; F319-I327 HydrophobicContact CD2-CD1 3.94Å; F319-I327 HydrophobicContact CE2-CD1 3.47Å; F319-I327 VanDerWaalsContact CE2-CD1 3.47Å; F319-I327 HydrophobicContact CZ-CD1 3.86Å; F319-A347 HydrophobicContact CZ-CB 4.38Å; F319-W351 HydrophobicContact CE1-CB 3.96Å; F319-W351 HydrophobicContact CZ-CB 4.46Å; F319-W351 VanDerWaalsContact O-CD1 3.25Å
320	L	91.9	Very high	93.1	Very high	22 Å²	22	44.8 Å²	44.8	12%	0.115	22%	0.223	C	C	.	.	H	α-helix	trans	-64.2	-19	177.1	-67.9	-179.7	0	0	0	113.8	Q317 E318 H354 R359	Q317-L320 PolarHBondContact O-N 2.85Å; E318-L320 PolarHBondContact O-N 3.26Å; L320-H354 HydrophobicContact CD2-CB 4.1Å; L320-R359 VanDerWaalsContact O-CZ 3.31Å; L320-R359 PolarHBondContact O-NH1 3.39Å; L320-R359 PolarHBondContact O-NH2 2.89Å
321	L	91.8	Very high	93	Very high	48 Å²	48	44.8 Å²	44.8	25%	0.251	22%	0.223	S	C	.	.	H	α-helix	trans	-98.5	-7.8	-178.6	-67	171.1	0	0	0	113.9	L15 Q317 E318 F319	L15-L321 HydrophobicContact CB-CD1 4.29Å; L15-L321 HydrophobicContact CD1-CD1 3.58Å; L15-L321 HydrophobicContact CD2-CD1 4.41Å; L15-L321 HydrophobicContact CG-CD1 4.29Å; Q317-L321 HydrophobicContact CG-CD1 4.03Å; Q317-L321 HydrophobicContact CG-CG 4.44Å; Q317-L321 WeakPolarHBondContact O-CG 3.4Å; Q317-L321 PolarHBondContact O-N 3.26Å; E318-L321 PolarHBondContact O-N 3.18Å; F319-L321 PolarHBondContact O-N 3.14Å
322	L	92.1	Very high	92.9	Very high	13 Å²	13	45 Å²	45	7%	0.068	23%	0.23	C	C	.	.	S	Bend	trans	-63.3	145.1	174.3	-69.1	179.8	0	0	0	112	L284 E318 F319 E326 I327 L330 W351	L284-L322 HydrophobicContact CD1-CD1 3.92Å; L284-L322 HydrophobicContact CD1-CG 4.4Å; L284-L322 HydrophobicContact CD2-CD1 4.21Å; E318-L322 PolarHBondContact O-N 3.11Å; F319-L322 HydrophobicContact CD2-CD1 4.32Å; F319-L322 PolarHBondContact O-N 2.82Å; L322-E326 HydrophobicContact CB-CB 4.45Å; L322-E326 HydrophobicContact CD1-CB 4.48Å; L322-E326 HydrophobicContact CD2-CB 4.24Å; L322-I327 HydrophobicContact CB-CD1 3.86Å; L322-I327 HydrophobicContact CB-CG1 4.02Å; L322-I327 HydrophobicContact CD1-CD1 3.81Å; L322-I327 HydrophobicContact CG-CD1 4.46Å; L322-L330 HydrophobicContact CD1-CD1 3.7Å; L322-W351 WeakPolarHBondContact O-CZ2 3.31Å; L322-W351 PolarHBondContact O-NE1 3.34Å
323	P	92.3	Very high	92.7	Very high	53 Å²	53	41.4 Å²	41.4	34%	0.344	22%	0.215	S	C	.	.			trans	-78.9	160.7	170.3	34.4	-35.6	0	0	0	111.3	W19 N325 E326 I327	W19-P323 VanDerWaalsContact CH2-CD 3.46Å; W19-P323 HydrophobicContact CH2-CG 3.93Å; W19-P323 HydrophobicContact CZ3-CG 4.13Å; P323-N325 PolarHBondContact O-N 2.7Å; P323-N325 VanDerWaalsContact O-N 3.09Å; P323-E326 HydrophobicContact CG-CB 4.43Å; P323-E326 HydrophobicContact CG-CG 3.9Å; P323-E326 PolarHBondContact O-N 2.75Å; P323-I327 PolarHBondContact O-N 2.91Å
324	A	92.3	Very high	92.5	Very high	11 Å²	11	43.7 Å²	43.7	9%	0.091	23%	0.227	C	C	.	.	H	α-helix	trans	-55.8	-31.6	-173.3	0	0	0	0	0	114.8	A328 W351 D362	A324-A328 WeakPolarHBondContact O-CB 3.12Å; A324-A328 PolarHBondContact O-N 2.89Å; A324-W351 HydrophobicContact CB-CH2 3.87Å; A324-W351 HydrophobicContact CB-CZ2 4.43Å; A324-D362 HydrophobicContact CB-CB 3.88Å; A324-D362 WeakPolarHBondContact CB-OD2 3.48Å
325	N	92.3	Very high	92.4	Very high	97 Å²	97	45.1 Å²	45.1	52%	0.519	23%	0.234	S	C	.	.	H	α-helix	trans	-70.7	-34.8	178.9	-72.8	-24	0	0	0	113	P323 A328 K329 K365	P323-N325 PolarHBondContact O-N 2.7Å; P323-N325 VanDerWaalsContact O-N 3.09Å; N325-A328 PolarHBondContact O-N 3.48Å; N325-K329 PolarHBondContact O-N 3.41Å; N325-K365 PolarHBondContact OD1-NZ 3.25Å
326	E	92.3	Very high	92.4	Very high	49 Å²	49	38.4 Å²	38.4	23%	0.229	21%	0.205	C	C	.	.	H	α-helix	trans	-75.1	-37.1	176.2	-58.9	-49.1	113.6	0	0	110.9	L322 P323 A328 K329 L330	L322-E326 HydrophobicContact CB-CB 4.45Å; L322-E326 HydrophobicContact CD1-CB 4.48Å; L322-E326 HydrophobicContact CD2-CB 4.24Å; P323-E326 HydrophobicContact CG-CB 4.43Å; P323-E326 HydrophobicContact CG-CG 3.9Å; P323-E326 PolarHBondContact O-N 2.75Å; E326-A328 VanDerWaalsContact C-N 3.3Å; E326-A328 PolarHBondContact O-N 2.96Å; E326-K329 PolarHBondContact O-N 2.94Å; E326-K329 VanDerWaalsContact OE1-CE 3.23Å; E326-K329 WeakPolarHBondContact OE1-CE 3.4Å; E326-K329 IonicContact OE1-NZ 2.92Å; E326-K329 PolarHBondContact OE1-NZ 2.79Å; E326-K329 VanDerWaalsContact OE2-CD 3.28Å; E326-K329 WeakPolarHBondContact OE2-CD 3.27Å; E326-K329 WeakPolarHBondContact OE2-CE 3.4Å; E326-K329 IonicContact OE2-NZ 3.21Å; E326-K329 PolarHBondContact OE2-NZ 2.79Å; E326-L330 WeakPolarHBondContact O-CG 3.3Å; E326-L330 PolarHBondContact O-N 2.96Å
327	I	93.9	Very high	92.4	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-59.9	-41.8	168.8	-60.9	-66.6	0	0	0	110.7	F319 L322 P323 L330 L331 W351 L366	F319-I327 HydrophobicContact CD2-CD1 3.94Å; F319-I327 HydrophobicContact CE2-CD1 3.47Å; F319-I327 VanDerWaalsContact CE2-CD1 3.47Å; F319-I327 HydrophobicContact CZ-CD1 3.86Å; L322-I327 HydrophobicContact CB-CD1 3.86Å; L322-I327 HydrophobicContact CB-CG1 4.02Å; L322-I327 HydrophobicContact CD1-CD1 3.81Å; L322-I327 HydrophobicContact CG-CD1 4.46Å; P323-I327 PolarHBondContact O-N 2.91Å; I327-L330 PolarHBondContact O-N 3.34Å; I327-L331 HydrophobicContact CG2-CD1 3.68Å; I327-L331 HydrophobicContact CG2-CG 4.01Å; I327-L331 WeakPolarHBondContact O-CB 3.45Å; I327-L331 VanDerWaalsContact O-CG 3.28Å; I327-L331 WeakPolarHBondContact O-CG 3.31Å; I327-L331 PolarHBondContact O-N 3.38Å; I327-W351 HydrophobicContact CD1-CG 4.22Å; I327-W351 HydrophobicContact CG1-CD2 4.1Å; I327-W351 HydrophobicContact CG1-CG 4.3Å; I327-W351 HydrophobicContact CG1-CZ2 4.08Å; I327-L366 HydrophobicContact CB-CD2 4.42Å; I327-L366 HydrophobicContact CG2-CD1 4.06Å; I327-L366 HydrophobicContact CG2-CD2 4.06Å
328	A	94	Very high	92.5	Very high	7 Å²	7	34.1 Å²	34.1	6%	0.058	19%	0.185	C	C	.	.	H	α-helix	trans	-62.6	-43.7	176	0	0	0	0	0	112.6	A324 N325 E326 L330 L331 C332 L366 Y369	A324-A328 WeakPolarHBondContact O-CB 3.12Å; A324-A328 PolarHBondContact O-N 2.89Å; N325-A328 PolarHBondContact O-N 3.48Å; E326-A328 VanDerWaalsContact C-N 3.3Å; E326-A328 PolarHBondContact O-N 2.96Å; A328-L330 PolarHBondContact O-N 3.49Å; A328-L331 PolarHBondContact O-N 2.89Å; A328-C332 VanDerWaalsContact O-CB 3.23Å; A328-C332 WeakPolarHBondContact O-CB 3.25Å; A328-C332 PolarHBondContact O-N 2.75Å; A328-L366 HydrophobicContact CB-CD2 3.79Å; A328-Y369 HydrophobicContact CB-CD2 4.42Å; A328-Y369 HydrophobicContact CB-CE2 3.84Å
329	K	92	Very high	92.5	Very high	109 Å²	109	34 Å²	34	47%	0.474	19%	0.188	S	C	.	.	H	α-helix	trans	-55.3	-49.6	172.8	-72.8	175.9	-173.4	166.8	0	110.9	D291 N325 E326	D291-K329 IonicContact OD2-NZ 3.54Å; N325-K329 PolarHBondContact O-N 3.41Å; E326-K329 PolarHBondContact O-N 2.94Å; E326-K329 VanDerWaalsContact OE1-CE 3.23Å; E326-K329 WeakPolarHBondContact OE1-CE 3.4Å; E326-K329 IonicContact OE1-NZ 2.92Å; E326-K329 PolarHBondContact OE1-NZ 2.79Å; E326-K329 VanDerWaalsContact OE2-CD 3.28Å; E326-K329 WeakPolarHBondContact OE2-CD 3.27Å; E326-K329 WeakPolarHBondContact OE2-CE 3.4Å; E326-K329 IonicContact OE2-NZ 3.21Å; E326-K329 PolarHBondContact OE2-NZ 2.79Å
330	L	93.3	Very high	92.3	Very high	9 Å²	9	37 Å²	37	5%	0.047	21%	0.205	C	C	.	.	H	α-helix	trans	-62.8	-51.1	180	-67.4	171.3	0	0	0	111.8	L284 T306 M307 L322 E326 I327 A328 C332 S333 I336	L284-L330 HydrophobicContact CD2-CD1 4.1Å; T306-L330 HydrophobicContact CG2-CD2 3.92Å; M307-L330 HydrophobicContact CE-CD2 3.52Å; L322-L330 HydrophobicContact CD1-CD1 3.7Å; E326-L330 WeakPolarHBondContact O-CG 3.3Å; E326-L330 PolarHBondContact O-N 2.96Å; I327-L330 PolarHBondContact O-N 3.34Å; A328-L330 PolarHBondContact O-N 3.49Å; L330-C332 VanDerWaalsContact C-N 3.27Å; L330-C332 PolarHBondContact O-N 2.73Å; L330-S333 VanDerWaalsContact O-CB 3.31Å; L330-S333 WeakPolarHBondContact O-CB 3.33Å; L330-S333 PolarHBondContact O-N 3.31Å; L330-S333 VanDerWaalsContact O-N 3.13Å; L330-I336 WeakPolarHBondContact O-CD1 3.39Å
331	L	93	Very high	92.3	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-65.8	-26.7	-177.5	-68.5	-179	0	0	0	113.6	I327 A328 S333 I344 L348 L366 R423	I327-L331 HydrophobicContact CG2-CD1 3.68Å; I327-L331 HydrophobicContact CG2-CG 4.01Å; I327-L331 WeakPolarHBondContact O-CB 3.45Å; I327-L331 VanDerWaalsContact O-CG 3.28Å; I327-L331 WeakPolarHBondContact O-CG 3.31Å; I327-L331 PolarHBondContact O-N 3.38Å; A328-L331 PolarHBondContact O-N 2.89Å; L331-S333 PolarHBondContact O-N 3.04Å; L331-I344 HydrophobicContact CD2-CG2 3.36Å; L331-L348 HydrophobicContact CD1-CD1 4.27Å; L331-L348 HydrophobicContact CD1-CD2 4.46Å; L331-L366 HydrophobicContact CD1-CB 4.22Å; L331-L366 HydrophobicContact CD1-CD2 4.36Å; L331-R423 PolarHBondContact O-NH1 3.26Å; L331-R423 PolarHBondContact O-NH2 3.19Å
332	C	92.6	Very high	92.4	Very high	73 Å²	73	37.1 Å²	37.1	49%	0.493	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-11.4	176.1	-166.1	0	0	0	0	113.4	A328 L330 Y369	A328-C332 VanDerWaalsContact O-CB 3.23Å; A328-C332 WeakPolarHBondContact O-CB 3.25Å; A328-C332 PolarHBondContact O-N 2.75Å; L330-C332 VanDerWaalsContact C-N 3.27Å; L330-C332 PolarHBondContact O-N 2.73Å; C332-Y369 HydrophobicContact CB-CD1 3.66Å; C332-Y369 HydrophobicContact CB-CE1 3.95Å; C332-Y369 HydrophobicContact CB-CG 4.36Å
333	S	91.8	Very high	92.5	Very high	16 Å²	16	38.3 Å²	38.3	11%	0.112	21%	0.211	C	C	.	.			trans	-76.5	130.6	-178.1	-178.4	0	0	0	0	113.2	M307 L330 L331 D335 I336 R423	M307-S333 VanDerWaalsContact SD-CB 3.54Å; M307-S333 PolarHBondContact SD-OG 3.17Å; L330-S333 VanDerWaalsContact O-CB 3.31Å; L330-S333 WeakPolarHBondContact O-CB 3.33Å; L330-S333 PolarHBondContact O-N 3.31Å; L330-S333 VanDerWaalsContact O-N 3.13Å; L331-S333 PolarHBondContact O-N 3.04Å; S333-D335 VanDerWaalsContact C-N 3.28Å; S333-D335 PolarHBondContact OG-N 3.13Å; S333-I336 WeakPolarHBondContact O-CD1 3.49Å; S333-I336 WeakPolarHBondContact O-CG1 3.46Å; S333-R423 PolarHBondContact O-NH1 3.05Å
334	D	90.6	Very high	92.6	Very high	49 Å²	49	35.8 Å²	35.8	26%	0.262	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-9.2	174.7	-86.9	16.8	0	0	0	113.5	R371 K424	D334-R371 IonicContact OD1-CZ 2.78Å; D334-R371 IonicContact OD1-NH1 3.66Å; D334-R371 PolarHBondContact OD1-NH1 3.47Å; D334-R371 IonicContact OD1-NH2 2.88Å; D334-R371 PolarHBondContact OD1-NH2 2.89Å; D334-R371 IonicContact OD2-NH2 3.75Å; D334-R371 PolarHBondContact OD2-NH2 3.46Å; D334-R371 VanDerWaalsContact OD2-NH2 3.08Å; D334-K424 PolarHBondContact O-N 3.45Å; D334-K424 VanDerWaalsContact O-N 3.12Å
335	D	91.9	Very high	92.7	Very high	49 Å²	49	35.5 Å²	35.5	26%	0.262	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-0.2	-174	-74.8	-64.5	0	0	0	114.5	S333 N337 K424 R451	S333-D335 VanDerWaalsContact C-N 3.28Å; S333-D335 PolarHBondContact OG-N 3.13Å; D335-N337 PolarHBondContact O-N 3.48Å; D335-K424 VanDerWaalsContact OD1-CD 3.31Å; D335-K424 WeakPolarHBondContact OD1-CD 3.27Å; D335-K424 WeakPolarHBondContact OD1-CE 3.42Å; D335-K424 IonicContact OD1-NZ 2.71Å; D335-K424 PolarHBondContact OD1-NZ 3.29Å; D335-K424 IonicContact OD2-NZ 3.72Å; D335-K424 PolarHBondContact OD2-NZ 2.97Å; D335-R451 WeakPolarHBondContact O-CD 3.36Å
336	I	93.6	Very high	92.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.187	C	C	.	.			trans	-57.3	124	177.8	-54.3	169.5	0	0	0	110.3	M307 F310 L330 S333 V338 I344 S425	M307-I336 HydrophobicContact CE-CG1 4.43Å; M307-I336 HydrophobicContact SD-CB 4.44Å; M307-I336 HydrophobicContact SD-CG1 3.67Å; F310-I336 HydrophobicContact CB-CG2 3.8Å; F310-I336 HydrophobicContact CD1-CG2 3.49Å; F310-I336 VanDerWaalsContact CD1-CG2 3.49Å; F310-I336 HydrophobicContact CD2-CG2 3.89Å; F310-I336 HydrophobicContact CE1-CG2 3.96Å; F310-I336 HydrophobicContact CE2-CG2 4.32Å; F310-I336 HydrophobicContact CG-CG2 3.44Å; F310-I336 VanDerWaalsContact CG-CG2 3.44Å; F310-I336 HydrophobicContact CZ-CG2 4.35Å; L330-I336 WeakPolarHBondContact O-CD1 3.39Å; S333-I336 WeakPolarHBondContact O-CD1 3.49Å; S333-I336 WeakPolarHBondContact O-CG1 3.46Å; I336-V338 HydrophobicContact CG2-CG1 3.98Å; I336-V338 HydrophobicContact CG2-CG2 4.36Å; I336-V338 PolarHBondContact O-N 3.24Å; I336-I344 HydrophobicContact CB-CD1 4.32Å; I336-I344 HydrophobicContact CD1-CD1 3.87Å; I336-I344 HydrophobicContact CG2-CD1 4.05Å; I336-S425 WeakPolarHBondContact O-CB 3.4Å; I336-S425 PolarHBondContact O-OG 3.35Å
337	N	93.6	Very high	92.8	Very high	54 Å²	54	33 Å²	33	29%	0.289	18%	0.177	S	C	.	.			trans	-82.8	96.2	178.9	-169.1	34.2	0	0	0	111.2	M307 E308 D335	M307-N337 WeakPolarHBondContact O-CB 3.43Å; M307-N337 PolarHBondContact O-N 3.13Å; E308-N337 WeakPolarHBondContact O-CB 3.34Å; E308-N337 PolarHBondContact O-ND2 3.32Å; D335-N337 PolarHBondContact O-N 3.48Å
338	V	92.4	Very high	92.8	Very high	4 Å²	4	33 Å²	33	2%	0.024	18%	0.177	C	C	.	.			trans	-140.3	150.9	178.4	-76.3	0	0	0	0	111.6	F310 I311 I336 N340 T343 I344 T426	F310-V338 HydrophobicContact CD1-CG1 3.87Å; F310-V338 HydrophobicContact CE1-CG1 4.43Å; I311-V338 HydrophobicContact CG1-CG1 4.12Å; I336-V338 HydrophobicContact CG2-CG1 3.98Å; I336-V338 HydrophobicContact CG2-CG2 4.36Å; I336-V338 PolarHBondContact O-N 3.24Å; V338-N340 VanDerWaalsContact C-N 3.33Å; V338-N340 WeakPolarHBondContact CG2-O 3.49Å; V338-T343 HydrophobicContact CB-CG2 4.48Å; V338-T343 HydrophobicContact CG1-CG2 3.83Å; V338-I344 HydrophobicContact CB-CG1 4.48Å; V338-I344 HydrophobicContact CG1-CD1 4.36Å; V338-I344 HydrophobicContact CG1-CG1 3.96Å; V338-I344 HydrophobicContact CG2-CD1 3.62Å; V338-I344 HydrophobicContact CG2-CG1 3.99Å; V338-T426 HydrophobicContact CG2-CG2 4.38Å
339	P	90.4	Very high	92.8	Very high	45 Å²	45	34.6 Å²	34.6	29%	0.292	18%	0.184	S	C	.	.	S	Bend	trans	-73.4	-25.2	177.2	30.6	-36.3	0	0	0	112.9
340	N	91	Very high	92.7	Very high	66 Å²	66	33.9 Å²	33.9	35%	0.353	18%	0.182	S	C	.	.			trans	-158	164.7	-178.8	59.8	30.4	0	0	0	111.4	V338 E342 T343	V338-N340 VanDerWaalsContact C-N 3.33Å; V338-N340 WeakPolarHBondContact CG2-O 3.49Å; N340-E342 VanDerWaalsContact C-N 3.28Å; N340-E342 PolarHBondContact O-N 3.47Å; N340-E342 PolarHBondContact OD1-N 3.39Å; N340-T343 WeakPolarHBondContact OD1-CB 3.37Å; N340-T343 PolarHBondContact OD1-N 3.25Å; N340-T343 PolarHBondContact OD1-OG1 2.89Å
341	E	92.3	Very high	92.8	Very high	9 Å²	9	33.6 Å²	33.6	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-70.4	-25.7	176.8	-166.7	71.1	-176.1	0	0	112.4	T343 I344 F345 I370 R371 L375 R423	E341-T343 VanDerWaalsContact C-N 3.26Å; E341-T343 PolarHBondContact O-N 2.88Å; E341-I344 WeakPolarHBondContact O-CA 3.49Å; E341-I344 WeakPolarHBondContact O-CB 3.31Å; E341-I344 PolarHBondContact O-N 3.22Å; E341-F345 PolarHBondContact O-N 3.21Å; E341-I370 HydrophobicContact CG-CG2 3.83Å; E341-I370 WeakPolarHBondContact OE1-CA 3.48Å; E341-R371 HydrophobicContact CG-CB 3.86Å; E341-R371 WeakPolarHBondContact OE1-CD 3.44Å; E341-R371 PolarHBondContact OE1-N 3.3Å; E341-R371 WeakPolarHBondContact OE2-CD 3.29Å; E341-L375 HydrophobicContact CB-CD2 4.06Å; E341-L375 HydrophobicContact CG-CD2 4.24Å; E341-R423 IonicContact OE1-CZ 2.8Å; E341-R423 IonicContact OE1-NE 3.92Å; E341-R423 PolarHBondContact OE1-NE 2.84Å; E341-R423 IonicContact OE1-NH2 3.2Å; E341-R423 PolarHBondContact OE1-NH2 2.78Å; E341-R423 IonicContact OE2-CZ 3.57Å; E341-R423 IonicContact OE2-NE 3.3Å; E341-R423 PolarHBondContact OE2-NE 3.06Å; E341-R423 IonicContact OE2-NH2 2.71Å
342	E	93.1	Very high	92.8	Very high	63 Å²	63	33.5 Å²	33.5	29%	0.294	18%	0.18	S	C	.	.	H	α-helix	trans	-60.1	-35.1	177.6	176.5	172.5	175.1	0	0	112.3	N340 I344 F345 H346 L375 L379	N340-E342 VanDerWaalsContact C-N 3.28Å; N340-E342 PolarHBondContact O-N 3.47Å; N340-E342 PolarHBondContact OD1-N 3.39Å; E342-I344 PolarHBondContact O-N 2.9Å; E342-F345 WeakPolarHBondContact O-CB 3.42Å; E342-F345 PolarHBondContact O-N 2.98Å; E342-H346 VanDerWaalsContact CG-CD2 3.46Å; E342-H346 WeakPolarHBondContact CG-CD2 3.07Å; E342-H346 VanDerWaalsContact CG-NE2 3.26Å; E342-H346 WeakPolarHBondContact CG-NE2 3.49Å; E342-H346 PolarHBondContact O-CD2 2.93Å; E342-H346 VanDerWaalsContact O-CD2 3.24Å; E342-H346 PolarHBondContact O-N 3.04Å; E342-H346 IonicContact OE1-CD2 2.7Å; E342-H346 IonicContact OE1-CE1 3.46Å; E342-H346 IonicContact OE1-NE2 2.63Å; E342-H346 PolarHBondContact OE1-NE2 3.18Å; E342-L375 HydrophobicContact CB-CD2 4Å; E342-L379 HydrophobicContact CB-CD2 4.47Å; E342-L379 HydrophobicContact CG-CD2 3.89Å
343	T	93.2	Very high	92.7	Very high	39 Å²	39	32.9 Å²	32.9	24%	0.239	19%	0.186	C	C	.	.	H	α-helix	trans	-58	-37	172.7	-58.4	0	0	0	0	111.8	I311 V338 N340 E341 A347	I311-T343 HydrophobicContact CG1-CG2 4.42Å; V338-T343 HydrophobicContact CB-CG2 4.48Å; V338-T343 HydrophobicContact CG1-CG2 3.83Å; N340-T343 WeakPolarHBondContact OD1-CB 3.37Å; N340-T343 PolarHBondContact OD1-N 3.25Å; N340-T343 PolarHBondContact OD1-OG1 2.89Å; E341-T343 VanDerWaalsContact C-N 3.26Å; E341-T343 PolarHBondContact O-N 2.88Å; T343-A347 WeakPolarHBondContact O-CB 3.45Å; T343-A347 PolarHBondContact O-N 3.18Å; T343-A347 VanDerWaalsContact O-N 3.11Å
344	I	94.5	Very high	92.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-77	-37.1	178.2	-62.5	176.5	0	0	0	110.9	F310 L331 I336 V338 E341 E342 A347 L348 I370	F310-I344 HydrophobicContact CE1-CG1 4.08Å; L331-I344 HydrophobicContact CD2-CG2 3.36Å; I336-I344 HydrophobicContact CB-CD1 4.32Å; I336-I344 HydrophobicContact CD1-CD1 3.87Å; I336-I344 HydrophobicContact CG2-CD1 4.05Å; V338-I344 HydrophobicContact CB-CG1 4.48Å; V338-I344 HydrophobicContact CG1-CD1 4.36Å; V338-I344 HydrophobicContact CG1-CG1 3.96Å; V338-I344 HydrophobicContact CG2-CD1 3.62Å; V338-I344 HydrophobicContact CG2-CG1 3.99Å; E341-I344 WeakPolarHBondContact O-CA 3.49Å; E341-I344 WeakPolarHBondContact O-CB 3.31Å; E341-I344 PolarHBondContact O-N 3.22Å; E342-I344 PolarHBondContact O-N 2.9Å; I344-A347 WeakPolarHBondContact O-CB 3.44Å; I344-A347 PolarHBondContact O-N 2.93Å; I344-L348 PolarHBondContact O-N 3.11Å; I344-I370 HydrophobicContact CG2-CD1 4.18Å; I344-I370 HydrophobicContact CG2-CG1 4.25Å
345	F	94.2	Very high	92.6	Very high	5 Å²	5	37.2 Å²	37.2	2%	0.022	20%	0.204	C	C	.	.	H	α-helix	trans	-59.8	-50.5	172.8	179.1	-94.8	0	0	0	111.8	E341 E342 A347 L348 M349 L367 L372 L375 L379 L383 F389	E341-F345 PolarHBondContact O-N 3.21Å; E342-F345 WeakPolarHBondContact O-CB 3.42Å; E342-F345 PolarHBondContact O-N 2.98Å; F345-A347 VanDerWaalsContact C-N 3.29Å; F345-A347 PolarHBondContact O-N 3.36Å; F345-L348 PolarHBondContact O-N 3.3Å; F345-M349 HydrophobicContact CD1-CG 4.19Å; F345-M349 HydrophobicContact CE1-CG 3.54Å; F345-M349 HydrophobicContact CE2-CG 4.05Å; F345-M349 HydrophobicContact CE2-SD 4.22Å; F345-M349 HydrophobicContact CZ-CG 3.43Å; F345-M349 VanDerWaalsContact CZ-CG 3.43Å; F345-M349 HydrophobicContact CZ-SD 3.83Å; F345-M349 WeakPolarHBondContact O-CG 3.5Å; F345-M349 PolarHBondContact O-N 3.18Å; F345-L367 HydrophobicContact CD2-CD2 4.18Å; F345-L367 HydrophobicContact CE2-CD2 3.86Å; F345-L372 HydrophobicContact CD2-CD2 4.4Å; F345-L375 HydrophobicContact CB-CD2 4.48Å; F345-L375 HydrophobicContact CD2-CD1 4.5Å; F345-L375 HydrophobicContact CG-CD1 4.49Å; F345-L379 HydrophobicContact CD1-CD2 4.17Å; F345-L379 HydrophobicContact CE1-CD1 4.38Å; F345-L383 HydrophobicContact CE1-CD1 4Å; F345-L383 HydrophobicContact CE1-CD2 3.86Å; F345-L383 HydrophobicContact CE1-CG 4.48Å; F345-L383 HydrophobicContact CE2-CD1 3.77Å; F345-L383 HydrophobicContact CE2-CD2 4.36Å; F345-L383 HydrophobicContact CZ-CD1 3.49Å; F345-L383 VanDerWaalsContact CZ-CD1 3.49Å; F345-L383 HydrophobicContact CZ-CD2 3.4Å; F345-L383 HydrophobicContact CZ-CG 4.08Å; F345-F389 HydrophobicContact CE2-CE1 4.4Å; F345-F389 HydrophobicContact CE2-CZ 4.15Å; F345-F389 AromaticContact CZ-CZ 3.96Å; F345-F389 HydrophobicContact CZ-CZ 3.96Å
346	H	93.1	Very high	92.3	Very high	89 Å²	89	36.8 Å²	36.8	41%	0.412	21%	0.208	S	C	.	.	H	α-helix	trans	-63.5	-33.8	176.7	-67.6	-47.8	0	0	0	112.4	E342 M349 H350	E342-H346 VanDerWaalsContact CG-CD2 3.46Å; E342-H346 WeakPolarHBondContact CG-CD2 3.07Å; E342-H346 VanDerWaalsContact CG-NE2 3.26Å; E342-H346 WeakPolarHBondContact CG-NE2 3.49Å; E342-H346 PolarHBondContact O-CD2 2.93Å; E342-H346 VanDerWaalsContact O-CD2 3.24Å; E342-H346 PolarHBondContact O-N 3.04Å; E342-H346 IonicContact OE1-CD2 2.7Å; E342-H346 IonicContact OE1-CE1 3.46Å; E342-H346 IonicContact OE1-NE2 2.63Å; E342-H346 PolarHBondContact OE1-NE2 3.18Å; H346-M349 PolarHBondContact O-N 3.3Å; H346-H350 WeakPolarHBondContact O-CB 3.47Å; H346-H350 PolarHBondContact O-N 3.12Å
347	A	94.3	Very high	91.9	Very high	3 Å²	3	45.1 Å²	45.1	3%	0.025	25%	0.246	C	C	.	.	H	α-helix	trans	-61.1	-45	172.5	0	0	0	0	0	112.5	F310 V314 F319 T343 I344 F345 H350 W351	F310-A347 HydrophobicContact CE1-CB 4.37Å; V314-A347 HydrophobicContact CB-CB 4.34Å; V314-A347 HydrophobicContact CG1-CB 3.52Å; V314-A347 HydrophobicContact CG2-CB 3.82Å; F319-A347 HydrophobicContact CZ-CB 4.38Å; T343-A347 WeakPolarHBondContact O-CB 3.45Å; T343-A347 PolarHBondContact O-N 3.18Å; T343-A347 VanDerWaalsContact O-N 3.11Å; I344-A347 WeakPolarHBondContact O-CB 3.44Å; I344-A347 PolarHBondContact O-N 2.93Å; F345-A347 VanDerWaalsContact C-N 3.29Å; F345-A347 PolarHBondContact O-N 3.36Å; A347-H350 PolarHBondContact O-N 3.41Å; A347-W351 PolarHBondContact O-N 2.98Å; A347-W351 VanDerWaalsContact O-N 3.1Å
348	L	94.6	Very high	91.5	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-63.8	-45.4	175.2	175.2	59.7	0	0	0	111.4	L331 I344 F345 H350 W351 V352 L363 L366 L367 I370	L331-L348 HydrophobicContact CD1-CD1 4.27Å; L331-L348 HydrophobicContact CD1-CD2 4.46Å; I344-L348 PolarHBondContact O-N 3.11Å; F345-L348 PolarHBondContact O-N 3.3Å; L348-H350 VanDerWaalsContact C-N 3.32Å; L348-H350 PolarHBondContact O-N 2.96Å; L348-W351 HydrophobicContact CD1-CE3 4.18Å; L348-W351 PolarHBondContact O-N 3.07Å; L348-W351 VanDerWaalsContact O-N 3.13Å; L348-V352 HydrophobicContact CD1-CG2 4.01Å; L348-V352 HydrophobicContact CG-CG2 4.42Å; L348-V352 WeakPolarHBondContact O-CG2 3.33Å; L348-V352 PolarHBondContact O-N 3.42Å; L348-L363 HydrophobicContact CD2-CD1 4.38Å; L348-L366 HydrophobicContact CD1-CB 3.72Å; L348-L366 HydrophobicContact CD1-CD1 3.61Å; L348-L366 HydrophobicContact CD1-CG 4.29Å; L348-L366 HydrophobicContact CD2-CB 3.82Å; L348-L366 HydrophobicContact CG-CB 4.46Å; L348-L367 HydrophobicContact CD2-CD2 3.96Å; L348-L367 HydrophobicContact CD2-CG 4.19Å; L348-I370 HydrophobicContact CB-CD1 4.01Å; L348-I370 HydrophobicContact CD2-CD1 3.58Å; L348-I370 HydrophobicContact CG-CD1 4.45Å
349	M	92.4	Very high	91.4	Very high	42 Å²	42	48.2 Å²	48.2	21%	0.207	26%	0.261	C	S	.	.	H	α-helix	trans	-64.3	-36	179.6	-66.1	-53.6	-70.8	0	0	112.5	F345 H346 V352 G353 L363 M388 F389	F345-M349 HydrophobicContact CD1-CG 4.19Å; F345-M349 HydrophobicContact CE1-CG 3.54Å; F345-M349 HydrophobicContact CE2-CG 4.05Å; F345-M349 HydrophobicContact CE2-SD 4.22Å; F345-M349 HydrophobicContact CZ-CG 3.43Å; F345-M349 VanDerWaalsContact CZ-CG 3.43Å; F345-M349 HydrophobicContact CZ-SD 3.83Å; F345-M349 WeakPolarHBondContact O-CG 3.5Å; F345-M349 PolarHBondContact O-N 3.18Å; H346-M349 PolarHBondContact O-N 3.3Å; M349-V352 PolarHBondContact O-N 2.88Å; M349-G353 PolarHBondContact O-N 3.21Å; M349-L363 HydrophobicContact SD-CD1 4.37Å; M349-M388 HydrophobicContact CE-CE 3.89Å; M349-M388 HydrophobicContact CE-SD 3.95Å; M349-F389 HydrophobicContact CE-CE2 3.83Å; M349-F389 HydrophobicContact CE-CZ 3.9Å; M349-F389 HydrophobicContact SD-CE2 4.36Å; M349-F389 HydrophobicContact SD-CZ 3.81Å
350	H	91.9	Very high	91.2	Very high	94 Å²	94	49.6 Å²	49.6	44%	0.435	26%	0.264	S	S	.	.	H	α-helix	trans	-62.4	-42.5	171.4	-177.4	-132.1	0	0	0	112	H346 A347 L348 H354	H346-H350 WeakPolarHBondContact O-CB 3.47Å; H346-H350 PolarHBondContact O-N 3.12Å; A347-H350 PolarHBondContact O-N 3.41Å; L348-H350 VanDerWaalsContact C-N 3.32Å; L348-H350 PolarHBondContact O-N 2.96Å; H350-H354 PolarHBondContact O-N 2.91Å
351	W	95	Very high	91.1	Very high	3 Å²	3	56.8 Å²	56.8	1%	0.011	29%	0.286	C	S	.	.	H	α-helix	trans	-66.2	-42.7	175.7	179.9	90.5	0	0	0	112.9	F319 L322 A324 I327 A347 L348 R359 L366	F319-W351 HydrophobicContact CE1-CB 3.96Å; F319-W351 HydrophobicContact CZ-CB 4.46Å; F319-W351 VanDerWaalsContact O-CD1 3.25Å; L322-W351 WeakPolarHBondContact O-CZ2 3.31Å; L322-W351 PolarHBondContact O-NE1 3.34Å; A324-W351 HydrophobicContact CB-CH2 3.87Å; A324-W351 HydrophobicContact CB-CZ2 4.43Å; I327-W351 HydrophobicContact CD1-CG 4.22Å; I327-W351 HydrophobicContact CG1-CD2 4.1Å; I327-W351 HydrophobicContact CG1-CG 4.3Å; I327-W351 HydrophobicContact CG1-CZ2 4.08Å; A347-W351 PolarHBondContact O-N 2.98Å; A347-W351 VanDerWaalsContact O-N 3.1Å; L348-W351 HydrophobicContact CD1-CE3 4.18Å; L348-W351 PolarHBondContact O-N 3.07Å; L348-W351 VanDerWaalsContact O-N 3.13Å; W351-R359 VanDerWaalsContact CE2-CZ 3.47Å; W351-R359 HydrophobicContact CE3-CB 4.35Å; W351-R359 HydrophobicContact CE3-CG 4.34Å; W351-R359 HydrophobicContact CH2-CB 4.02Å; W351-R359 HydrophobicContact CH2-CG 3.56Å; W351-R359 HydrophobicContact CZ2-CG 4.07Å; W351-R359 HydrophobicContact CZ3-CB 3.71Å; W351-R359 HydrophobicContact CZ3-CG 3.73Å; W351-R359 VanDerWaalsContact O-CD 3.28Å; W351-R359 WeakPolarHBondContact O-CD 3.44Å; W351-R359 PolarHBondContact O-NH1 2.69Å; W351-L366 HydrophobicContact CE3-CD1 4.03Å; W351-L366 HydrophobicContact CH2-CD1 4.08Å; W351-L366 HydrophobicContact CZ3-CD1 3.48Å; W351-L366 VanDerWaalsContact CZ3-CD1 3.48Å
352	V	92.1	Very high	90.9	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-66.5	-43.1	177	176.5	0	0	0	0	110.8	L348 M349 H354 D355 A356 R359 L363 M388	L348-V352 HydrophobicContact CD1-CG2 4.01Å; L348-V352 HydrophobicContact CG-CG2 4.42Å; L348-V352 WeakPolarHBondContact O-CG2 3.33Å; L348-V352 PolarHBondContact O-N 3.42Å; M349-V352 PolarHBondContact O-N 2.88Å; V352-H354 PolarHBondContact O-N 3.49Å; V352-H354 VanDerWaalsContact O-N 3.14Å; V352-D355 CarbonylContact O-C 3.24Å; V352-D355 VanDerWaalsContact O-C 3.24Å; V352-D355 PolarHBondContact O-N 3.18Å; V352-A356 VanDerWaalsContact O-CA 3.29Å; V352-A356 WeakPolarHBondContact O-CA 3.46Å; V352-A356 PolarHBondContact O-N 3.15Å; V352-R359 HydrophobicContact CB-CB 4.48Å; V352-R359 HydrophobicContact CG1-CB 4.2Å; V352-R359 HydrophobicContact CG2-CB 4.42Å; V352-L363 HydrophobicContact CG2-CD1 4.26Å; V352-M388 HydrophobicContact CG1-CE 3.79Å
353	G	89.8	Confident	90.8	Very high	59 Å²	59	55.8 Å²	55.8	61%	0.608	28%	0.283	S	S	*	.	H	α-helix	trans	-58.9	-26.3	-179.2	0	0	0	0	0	114.9	M349 D355	M349-G353 PolarHBondContact O-N 3.21Å; G353-D355 PolarHBondContact O-N 3.4Å
354	H	90.8	Very high	90.7	Very high	98 Å²	98	54.7 Å²	54.7	45%	0.454	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-25.9	176.5	177.3	-84.4	0	0	0	113.9	L320 H350 V352	L320-H354 HydrophobicContact CD2-CB 4.1Å; H350-H354 PolarHBondContact O-N 2.91Å; V352-H354 PolarHBondContact O-N 3.49Å; V352-H354 VanDerWaalsContact O-N 3.14Å
355	D	89.9	Confident	90.6	Very high	58 Å²	58	58.8 Å²	58.8	31%	0.31	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.9	65.1	174.3	-177.2	8.2	0	0	0	110.7	V352 G353 Q357 N358 R359	V352-D355 CarbonylContact O-C 3.24Å; V352-D355 VanDerWaalsContact O-C 3.24Å; V352-D355 PolarHBondContact O-N 3.18Å; G353-D355 PolarHBondContact O-N 3.4Å; D355-Q357 VanDerWaalsContact C-N 3.27Å; D355-Q357 PolarHBondContact O-N 3.08Å; D355-N358 VanDerWaalsContact CG-ND2 3.3Å; D355-N358 PolarHBondContact O-N 3.34Å; D355-N358 PolarHBondContact OD1-ND2 2.85Å; D355-N358 PolarHBondContact OD2-ND2 3.04Å; D355-R359 HydrophobicContact CB-CG 4.18Å; D355-R359 WeakPolarHBondContact O-CB 3.31Å; D355-R359 VanDerWaalsContact O-CG 3.26Å; D355-R359 WeakPolarHBondContact O-CG 3.38Å; D355-R359 PolarHBondContact O-N 3.07Å
356	A	86.1	Confident	90.5	Very high	41 Å²	41	58.6 Å²	58.6	34%	0.339	30%	0.295	S	S	.	.	H	α-helix	trans	-58.4	-37.1	-171.9	0	0	0	0	0	113.1	V352 N358 R359 Q360	V352-A356 VanDerWaalsContact O-CA 3.29Å; V352-A356 WeakPolarHBondContact O-CA 3.46Å; V352-A356 PolarHBondContact O-N 3.15Å; A356-N358 VanDerWaalsContact C-N 3.34Å; A356-N358 PolarHBondContact O-N 3.4Å; A356-R359 PolarHBondContact O-N 3.09Å; A356-Q360 WeakPolarHBondContact O-CB 3.42Å; A356-Q360 PolarHBondContact O-N 3.27Å
357	Q	84.3	Confident	90.5	Very high	174 Å²	174	54.5 Å²	54.5	81%	0.813	28%	0.276	S	S	*	.	H	α-helix	trans	-63.1	-37.5	-175.5	-67.4	-174.3	-7.6	0	0	113.2	D355	D355-Q357 VanDerWaalsContact C-N 3.27Å; D355-Q357 PolarHBondContact O-N 3.08Å
358	N	87.3	Confident	90.4	Very high	98 Å²	98	56.6 Å²	56.6	52%	0.524	29%	0.29	S	S	.	.	H	α-helix	trans	-88.5	-43.8	175.6	-61.9	-59.7	0	0	0	111.3	D355 A356	D355-N358 VanDerWaalsContact CG-ND2 3.3Å; D355-N358 PolarHBondContact O-N 3.34Å; D355-N358 PolarHBondContact OD1-ND2 2.85Å; D355-N358 PolarHBondContact OD2-ND2 3.04Å; A356-N358 VanDerWaalsContact C-N 3.34Å; A356-N358 PolarHBondContact O-N 3.4Å
359	R	90.3	Very high	90.4	Very high	26 Å²	26	60 Å²	60	10%	0.098	30%	0.304	C	S	.	.	H	α-helix	trans	-78	-20.1	-168.3	-64.4	177.8	174.2	-178.5	-6.3	114.7	L320 W351 V352 D355 A356 R361 D362 L363	L320-R359 VanDerWaalsContact O-CZ 3.31Å; L320-R359 PolarHBondContact O-NH1 3.39Å; L320-R359 PolarHBondContact O-NH2 2.89Å; W351-R359 VanDerWaalsContact CE2-CZ 3.47Å; W351-R359 HydrophobicContact CE3-CB 4.35Å; W351-R359 HydrophobicContact CE3-CG 4.34Å; W351-R359 HydrophobicContact CH2-CB 4.02Å; W351-R359 HydrophobicContact CH2-CG 3.56Å; W351-R359 HydrophobicContact CZ2-CG 4.07Å; W351-R359 HydrophobicContact CZ3-CB 3.71Å; W351-R359 HydrophobicContact CZ3-CG 3.73Å; W351-R359 VanDerWaalsContact O-CD 3.28Å; W351-R359 WeakPolarHBondContact O-CD 3.44Å; W351-R359 PolarHBondContact O-NH1 2.69Å; V352-R359 HydrophobicContact CB-CB 4.48Å; V352-R359 HydrophobicContact CG1-CB 4.2Å; V352-R359 HydrophobicContact CG2-CB 4.42Å; D355-R359 HydrophobicContact CB-CG 4.18Å; D355-R359 WeakPolarHBondContact O-CB 3.31Å; D355-R359 VanDerWaalsContact O-CG 3.26Å; D355-R359 WeakPolarHBondContact O-CG 3.38Å; D355-R359 PolarHBondContact O-N 3.07Å; A356-R359 PolarHBondContact O-N 3.09Å; R359-R361 PolarHBondContact O-N 3.13Å; R359-R361 VanDerWaalsContact O-N 3.17Å; R359-D362 PolarHBondContact O-N 3.09Å; R359-L363 PolarHBondContact O-N 3.13Å
360	Q	86	Confident	90.4	Very high	74 Å²	74	58 Å²	58	35%	0.346	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-59.6	-25.9	175.1	-171.1	175.5	8.3	0	0	112.3	A356 D362 L363 M388	A356-Q360 WeakPolarHBondContact O-CB 3.42Å; A356-Q360 PolarHBondContact O-N 3.27Å; Q360-D362 VanDerWaalsContact C-N 3.31Å; Q360-D362 PolarHBondContact O-N 2.8Å; Q360-L363 VanDerWaalsContact O-CB 3.24Å; Q360-L363 WeakPolarHBondContact O-CB 3.47Å; Q360-L363 PolarHBondContact O-N 3.43Å; Q360-M388 PolarHBondContact NE2-O 3.26Å
361	R	87.6	Confident	90.5	Very high	217 Å²	217	54.1 Å²	54.1	82%	0.819	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-68.8	-26.3	175.5	-62.8	179.8	178.8	-178.2	-0.4	114	R359	R359-R361 PolarHBondContact O-N 3.13Å; R359-R361 VanDerWaalsContact O-N 3.17Å
362	D	89.4	Confident	90.4	Very high	50 Å²	50	54 Å²	54	27%	0.267	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-90.2	-9	176.6	-67.5	-65.3	0	0	0	112.3	A324 R359 Q360 A364 K365 L366	A324-D362 HydrophobicContact CB-CB 3.88Å; A324-D362 WeakPolarHBondContact CB-OD2 3.48Å; R359-D362 PolarHBondContact O-N 3.09Å; Q360-D362 VanDerWaalsContact C-N 3.31Å; Q360-D362 PolarHBondContact O-N 2.8Å; D362-A364 PolarHBondContact O-N 3.15Å; D362-K365 WeakPolarHBondContact O-CB 3.28Å; D362-K365 PolarHBondContact O-N 2.95Å; D362-K365 VanDerWaalsContact O-N 3.17Å; D362-L366 HydrophobicContact CB-CD1 4.12Å; D362-L366 HydrophobicContact CB-CG 4.38Å; D362-L366 WeakPolarHBondContact O-CG 3.39Å; D362-L366 PolarHBondContact O-N 3.29Å
363	L	90.4	Very high	90.4	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-57.4	-53.3	-169.3	178.9	59.7	0	0	0	112.7	L348 M349 V352 R359 Q360 K365 L366 L367 M388 F389	L348-L363 HydrophobicContact CD2-CD1 4.38Å; M349-L363 HydrophobicContact SD-CD1 4.37Å; V352-L363 HydrophobicContact CG2-CD1 4.26Å; R359-L363 PolarHBondContact O-N 3.13Å; Q360-L363 VanDerWaalsContact O-CB 3.24Å; Q360-L363 WeakPolarHBondContact O-CB 3.47Å; Q360-L363 PolarHBondContact O-N 3.43Å; L363-K365 VanDerWaalsContact C-N 3.3Å; L363-K365 PolarHBondContact O-N 3.18Å; L363-L366 PolarHBondContact O-N 2.97Å; L363-L366 VanDerWaalsContact O-N 3.14Å; L363-L367 HydrophobicContact CD1-CD1 3.78Å; L363-L367 HydrophobicContact CD1-CD2 4.34Å; L363-L367 HydrophobicContact CD1-CG 3.85Å; L363-L367 HydrophobicContact CG-CD1 3.72Å; L363-L367 HydrophobicContact CG-CG 4.26Å; L363-L367 WeakPolarHBondContact O-CB 3.26Å; L363-L367 VanDerWaalsContact O-CG 3.27Å; L363-L367 WeakPolarHBondContact O-CG 3.46Å; L363-L367 PolarHBondContact O-N 3.34Å; L363-M388 HydrophobicContact CD2-CE 4.42Å; L363-F389 HydrophobicContact CD2-CE1 4.5Å; L363-F389 HydrophobicContact CD2-CZ 4.5Å
364	A	90.3	Very high	90.4	Very high	16 Å²	16	54.1 Å²	54.1	13%	0.132	26%	0.261	C	S	.	.	H	α-helix	trans	-57.4	-41	177.7	0	0	0	0	0	113.2	D362 S368 D392 E394	D362-A364 PolarHBondContact O-N 3.15Å; A364-S368 PolarHBondContact O-N 3.46Å; A364-S368 VanDerWaalsContact O-N 3.14Å; A364-D392 WeakPolarHBondContact CB-OD2 3.22Å; A364-E394 HydrophobicContact CB-CB 3.78Å
365	K	92.4	Very high	90.5	Very high	86 Å²	86	50 Å²	50	37%	0.374	24%	0.242	S	C	.	.	H	α-helix	trans	-62.7	-46	176.5	178.4	-175.7	168.4	-169.1	0	110.4	N325 D362 L363 S368 Y369	N325-K365 PolarHBondContact OD1-NZ 3.25Å; D362-K365 WeakPolarHBondContact O-CB 3.28Å; D362-K365 PolarHBondContact O-N 2.95Å; D362-K365 VanDerWaalsContact O-N 3.17Å; L363-K365 VanDerWaalsContact C-N 3.3Å; L363-K365 PolarHBondContact O-N 3.18Å; K365-S368 WeakPolarHBondContact O-CB 3.48Å; K365-S368 PolarHBondContact O-N 3.15Å; K365-S368 PolarHBondContact O-OG 2.86Å; K365-Y369 HydrophobicContact CG-CE2 4.28Å; K365-Y369 VanDerWaalsContact O-CD2 3.25Å; K365-Y369 WeakPolarHBondContact O-CD2 3.47Å; K365-Y369 WeakPolarHBondContact O-CE2 3.42Å
366	L	93.4	Very high	90.5	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-70.9	-37.9	-178.5	-64.2	178.4	0	0	0	112.7	I327 A328 L331 L348 W351 D362 L363 S368 Y369	I327-L366 HydrophobicContact CB-CD2 4.42Å; I327-L366 HydrophobicContact CG2-CD1 4.06Å; I327-L366 HydrophobicContact CG2-CD2 4.06Å; A328-L366 HydrophobicContact CB-CD2 3.79Å; L331-L366 HydrophobicContact CD1-CB 4.22Å; L331-L366 HydrophobicContact CD1-CD2 4.36Å; L348-L366 HydrophobicContact CD1-CB 3.72Å; L348-L366 HydrophobicContact CD1-CD1 3.61Å; L348-L366 HydrophobicContact CD1-CG 4.29Å; L348-L366 HydrophobicContact CD2-CB 3.82Å; L348-L366 HydrophobicContact CG-CB 4.46Å; W351-L366 HydrophobicContact CE3-CD1 4.03Å; W351-L366 HydrophobicContact CH2-CD1 4.08Å; W351-L366 HydrophobicContact CZ3-CD1 3.48Å; W351-L366 VanDerWaalsContact CZ3-CD1 3.48Å; D362-L366 HydrophobicContact CB-CD1 4.12Å; D362-L366 HydrophobicContact CB-CG 4.38Å; D362-L366 WeakPolarHBondContact O-CG 3.39Å; D362-L366 PolarHBondContact O-N 3.29Å; L363-L366 PolarHBondContact O-N 2.97Å; L363-L366 VanDerWaalsContact O-N 3.14Å; L366-S368 PolarHBondContact O-N 3.29Å; L366-Y369 PolarHBondContact O-N 3.24Å
367	L	92.3	Very high	90.7	Very high	3 Å²	3	51 Å²	51	2%	0.016	25%	0.25	C	C	.	.	H	α-helix	trans	-61.7	-29.1	172.3	-71.1	168.6	0	0	0	112.9	F345 L348 L363 Y369 I370 L372 F389 C395 L398	F345-L367 HydrophobicContact CD2-CD2 4.18Å; F345-L367 HydrophobicContact CE2-CD2 3.86Å; L348-L367 HydrophobicContact CD2-CD2 3.96Å; L348-L367 HydrophobicContact CD2-CG 4.19Å; L363-L367 HydrophobicContact CD1-CD1 3.78Å; L363-L367 HydrophobicContact CD1-CD2 4.34Å; L363-L367 HydrophobicContact CD1-CG 3.85Å; L363-L367 HydrophobicContact CG-CD1 3.72Å; L363-L367 HydrophobicContact CG-CG 4.26Å; L363-L367 WeakPolarHBondContact O-CB 3.26Å; L363-L367 VanDerWaalsContact O-CG 3.27Å; L363-L367 WeakPolarHBondContact O-CG 3.46Å; L363-L367 PolarHBondContact O-N 3.34Å; L367-Y369 PolarHBondContact O-N 3.34Å; L367-I370 PolarHBondContact O-N 3.43Å; L367-L372 HydrophobicContact CD2-CD2 4.4Å; L367-F389 HydrophobicContact CD1-CD1 3.99Å; L367-F389 HydrophobicContact CD1-CE1 3.58Å; L367-F389 HydrophobicContact CD2-CE1 4.15Å; L367-C395 HydrophobicContact CD1-CB 4.46Å; L367-L398 HydrophobicContact CB-CD1 3.91Å
368	S	92.6	Very high	90.9	Very high	47 Å²	47	50 Å²	50	33%	0.329	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-18.9	178.3	81.3	0	0	0	0	114	A364 K365 L366 R419	A364-S368 PolarHBondContact O-N 3.46Å; A364-S368 VanDerWaalsContact O-N 3.14Å; K365-S368 WeakPolarHBondContact O-CB 3.48Å; K365-S368 PolarHBondContact O-N 3.15Å; K365-S368 PolarHBondContact O-OG 2.86Å; L366-S368 PolarHBondContact O-N 3.29Å; S368-R419 VanDerWaalsContact O-CD 3.26Å; S368-R419 WeakPolarHBondContact O-CD 3.24Å
369	Y	93.8	Very high	91	Very high	74 Å²	74	46.3 Å²	46.3	29%	0.29	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-4.2	172.5	-56.7	-74.2	0	0	0	113.6	A328 C332 K365 L366 L367 R423	A328-Y369 HydrophobicContact CB-CD2 4.42Å; A328-Y369 HydrophobicContact CB-CE2 3.84Å; C332-Y369 HydrophobicContact CB-CD1 3.66Å; C332-Y369 HydrophobicContact CB-CE1 3.95Å; C332-Y369 HydrophobicContact CB-CG 4.36Å; K365-Y369 HydrophobicContact CG-CE2 4.28Å; K365-Y369 VanDerWaalsContact O-CD2 3.25Å; K365-Y369 WeakPolarHBondContact O-CD2 3.47Å; K365-Y369 WeakPolarHBondContact O-CE2 3.42Å; L366-Y369 PolarHBondContact O-N 3.24Å; L367-Y369 PolarHBondContact O-N 3.34Å; Y369-R423 PolarHBondContact O-NH2 2.8Å
370	I	94	Very high	91	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.221	C	C	.	.	S	Bend	trans	-96.9	135.3	177.4	-59.6	-170.8	0	0	0	109.5	E341 I344 L348 L367 L372 R419	E341-I370 HydrophobicContact CG-CG2 3.83Å; E341-I370 WeakPolarHBondContact OE1-CA 3.48Å; I344-I370 HydrophobicContact CG2-CD1 4.18Å; I344-I370 HydrophobicContact CG2-CG1 4.25Å; L348-I370 HydrophobicContact CB-CD1 4.01Å; L348-I370 HydrophobicContact CD2-CD1 3.58Å; L348-I370 HydrophobicContact CG-CD1 4.45Å; L367-I370 PolarHBondContact O-N 3.43Å; I370-L372 HydrophobicContact CB-CD2 4.31Å; I370-L372 HydrophobicContact CG2-CD2 3.85Å; I370-L372 HydrophobicContact CG2-CG 4.41Å; I370-L372 PolarHBondContact O-N 2.98Å; I370-R419 WeakPolarHBondContact O-CD 3.2Å; I370-R419 WeakPolarHBondContact O-CG 3.23Å
371	R	93.3	Very high	91.1	Very high	11 Å²	11	43.5 Å²	43.5	4%	0.042	22%	0.22	C	C	.	.			trans	-78.3	61.7	179.3	-66.1	126.8	148.3	111.5	2.8	111.8	D334 E341 P373 L374 R419 K421 R423	D334-R371 IonicContact OD1-CZ 2.78Å; D334-R371 IonicContact OD1-NH1 3.66Å; D334-R371 PolarHBondContact OD1-NH1 3.47Å; D334-R371 IonicContact OD1-NH2 2.88Å; D334-R371 PolarHBondContact OD1-NH2 2.89Å; D334-R371 IonicContact OD2-NH2 3.75Å; D334-R371 PolarHBondContact OD2-NH2 3.46Å; D334-R371 VanDerWaalsContact OD2-NH2 3.08Å; E341-R371 HydrophobicContact CG-CB 3.86Å; E341-R371 WeakPolarHBondContact OE1-CD 3.44Å; E341-R371 PolarHBondContact OE1-N 3.3Å; E341-R371 WeakPolarHBondContact OE2-CD 3.29Å; R371-P373 VanDerWaalsContact C-N 3.27Å; R371-P373 VanDerWaalsContact O-N 3.16Å; R371-L374 HydrophobicContact CB-CB 4.32Å; R371-L374 HydrophobicContact CB-CD1 3.82Å; R371-L374 HydrophobicContact CB-CG 4.11Å; R371-L374 HydrophobicContact CG-CD1 4.31Å; R371-L374 WeakPolarHBondContact O-CA 3.47Å; R371-L374 WeakPolarHBondContact O-CB 3.34Å; R371-L374 PolarHBondContact O-N 3.18Å; R371-R419 WeakPolarHBondContact CA-O 3.21Å; R371-R419 VanDerWaalsContact CB-O 3.28Å; R371-R419 WeakPolarHBondContact CB-O 3.22Å; R371-R419 WeakPolarHBondContact CG-O 3.39Å; R371-K421 PolarHBondContact NE-O 3.42Å; R371-K421 PolarHBondContact NH2-O 2.78Å; R371-R423 VanDerWaalsContact CZ-CG 3.44Å
372	L	92.4	Very high	91.1	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.01	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-49	-37.5	179	-56.6	174	0	0	0	114.2	F345 L367 I370 L374 L375 L398 A402	F345-L372 HydrophobicContact CD2-CD2 4.4Å; L367-L372 HydrophobicContact CD2-CD2 4.4Å; I370-L372 HydrophobicContact CB-CD2 4.31Å; I370-L372 HydrophobicContact CG2-CD2 3.85Å; I370-L372 HydrophobicContact CG2-CG 4.41Å; I370-L372 PolarHBondContact O-N 2.98Å; L372-L374 PolarHBondContact O-N 3.32Å; L372-L375 HydrophobicContact CD2-CD1 3.61Å; L372-L375 WeakPolarHBondContact O-CB 3.37Å; L372-L375 PolarHBondContact O-N 2.88Å; L372-L375 VanDerWaalsContact O-N 3.12Å; L372-L398 HydrophobicContact CD1-CB 3.81Å; L372-A402 HydrophobicContact CB-CB 3.9Å
373	P	91.7	Very high	90.9	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-63.7	-3.9	173.3	-22.5	34.7	0	0	0	116.1	R371 A402 Y405 R419 T420	R371-P373 VanDerWaalsContact C-N 3.27Å; R371-P373 VanDerWaalsContact O-N 3.16Å; P373-A402 HydrophobicContact CG-CB 4.26Å; P373-Y405 HydrophobicContact CB-CD1 3.66Å; P373-Y405 HydrophobicContact CB-CE1 4.23Å; P373-Y405 HydrophobicContact CB-CG 3.83Å; P373-Y405 VanDerWaalsContact O-CD1 3.22Å; P373-Y405 WeakPolarHBondContact O-CD1 3.38Å; P373-Y405 WeakPolarHBondContact O-CE1 3.44Å; P373-R419 HydrophobicContact CG-CB 4.4Å; P373-T420 HydrophobicContact CB-CG2 4.06Å; P373-T420 HydrophobicContact CG-CG2 4.18Å
374	L	90.1	Very high	90.6	Very high	60 Å²	60	41.7 Å²	41.7	31%	0.314	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-112.8	4.6	177.6	-53.7	-178.9	0	0	0	112.9	R371 L372 Y405 P422	R371-L374 HydrophobicContact CB-CB 4.32Å; R371-L374 HydrophobicContact CB-CD1 3.82Å; R371-L374 HydrophobicContact CB-CG 4.11Å; R371-L374 HydrophobicContact CG-CD1 4.31Å; R371-L374 WeakPolarHBondContact O-CA 3.47Å; R371-L374 WeakPolarHBondContact O-CB 3.34Å; R371-L374 PolarHBondContact O-N 3.18Å; L372-L374 PolarHBondContact O-N 3.32Å; L374-Y405 HydrophobicContact CD2-CE1 4.42Å; L374-P422 HydrophobicContact CD1-CB 3.85Å; L374-P422 HydrophobicContact CD1-CG 3.84Å
375	L	92.1	Very high	90.1	Very high	10 Å²	10	47.4 Å²	47.4	5%	0.052	25%	0.252	C	S	.	.	S	Bend	trans	-76.1	174	171.6	-65.7	-179.7	0	0	0	111.5	E341 E342 F345 L372 L379 L380 H406	E341-L375 HydrophobicContact CB-CD2 4.06Å; E341-L375 HydrophobicContact CG-CD2 4.24Å; E342-L375 HydrophobicContact CB-CD2 4Å; F345-L375 HydrophobicContact CB-CD2 4.48Å; F345-L375 HydrophobicContact CD2-CD1 4.5Å; F345-L375 HydrophobicContact CG-CD1 4.49Å; L372-L375 HydrophobicContact CD2-CD1 3.61Å; L372-L375 WeakPolarHBondContact O-CB 3.37Å; L372-L375 PolarHBondContact O-N 2.88Å; L372-L375 VanDerWaalsContact O-N 3.12Å; L375-L379 HydrophobicContact CD1-CD2 4.11Å; L375-L379 HydrophobicContact CD2-CD2 4.24Å; L375-L380 HydrophobicContact CB-CD2 4.36Å; L375-L380 HydrophobicContact CB-CG 4.29Å; L375-L380 HydrophobicContact CD1-CD2 4.22Å; L375-H406 PolarHBondContact O-CE1 2.83Å; L375-H406 VanDerWaalsContact O-CE1 3.29Å; L375-H406 PolarHBondContact O-NE2 2.91Å
376	S	91.2	Very high	89.7	Confident	39 Å²	39	45 Å²	45	27%	0.273	25%	0.246	S	C	.	.			trans	-74.1	142.2	173.1	74.6	0	0	0	0	110.7	Q378 L379 L380	S376-Q378 PolarHBondContact O-N 3.08Å; S376-L379 PolarHBondContact O-N 3.24Å; S376-L379 VanDerWaalsContact OG-CB 3.28Å; S376-L379 WeakPolarHBondContact OG-CB 3.36Å; S376-L379 PolarHBondContact OG-N 3.44Å; S376-L379 VanDerWaalsContact OG-N 3.15Å; S376-L380 PolarHBondContact O-N 3Å; S376-L380 VanDerWaalsContact O-N 3.12Å
377	P	89.6	Confident	88.9	Confident	82 Å²	82	49.2 Å²	49.2	53%	0.532	28%	0.275	S	S	.	.	H	α-helix	trans	-60.5	-24.2	174.7	-25.9	35	0	0	0	113.9	A381	P377-A381 PolarHBondContact O-N 3.14Å
378	Q	89.6	Confident	88.2	Confident	154 Å²	154	51.8 Å²	51.8	72%	0.72	29%	0.288	S	S	*	.	H	α-helix	trans	-67.9	-54.3	175	-70.1	171.6	-20.8	0	0	110.3	S376 L380 A381 D382	S376-Q378 PolarHBondContact O-N 3.08Å; Q378-L380 VanDerWaalsContact C-N 3.28Å; Q378-L380 PolarHBondContact O-N 3Å; Q378-A381 PolarHBondContact O-N 3.46Å; Q378-D382 PolarHBondContact O-N 3.06Å
379	L	89.4	Confident	87.6	Confident	19 Å²	19	49.8 Å²	49.8	10%	0.099	27%	0.273	C	S	.	.	H	α-helix	trans	-58.1	-40	177.3	179.6	61	0	0	0	111.9	E342 F345 L375 S376 A381 D382 L383	E342-L379 HydrophobicContact CB-CD2 4.47Å; E342-L379 HydrophobicContact CG-CD2 3.89Å; F345-L379 HydrophobicContact CD1-CD2 4.17Å; F345-L379 HydrophobicContact CE1-CD1 4.38Å; L375-L379 HydrophobicContact CD1-CD2 4.11Å; L375-L379 HydrophobicContact CD2-CD2 4.24Å; S376-L379 PolarHBondContact O-N 3.24Å; S376-L379 VanDerWaalsContact OG-CB 3.28Å; S376-L379 WeakPolarHBondContact OG-CB 3.36Å; S376-L379 PolarHBondContact OG-N 3.44Å; S376-L379 VanDerWaalsContact OG-N 3.15Å; L379-A381 VanDerWaalsContact C-N 3.33Å; L379-A381 PolarHBondContact O-N 2.85Å; L379-D382 PolarHBondContact O-N 2.92Å; L379-L383 HydrophobicContact CD1-CD1 4.32Å; L379-L383 HydrophobicContact CD1-CG 4.23Å; L379-L383 HydrophobicContact CG-CD1 4.14Å; L379-L383 HydrophobicContact CG-CG 4.47Å; L379-L383 WeakPolarHBondContact O-CB 3.43Å; L379-L383 WeakPolarHBondContact O-CG 3.49Å; L379-L383 PolarHBondContact O-N 3.03Å
380	L	90	Very high	86.7	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-62.4	-37.5	176.6	-69.4	174.1	0	0	0	113	L375 S376 Q378 E384 L399 A402 H406	L375-L380 HydrophobicContact CB-CD2 4.36Å; L375-L380 HydrophobicContact CB-CG 4.29Å; L375-L380 HydrophobicContact CD1-CD2 4.22Å; S376-L380 PolarHBondContact O-N 3Å; S376-L380 VanDerWaalsContact O-N 3.12Å; Q378-L380 VanDerWaalsContact C-N 3.28Å; Q378-L380 PolarHBondContact O-N 3Å; L380-E384 PolarHBondContact O-N 3.06Å; L380-E384 VanDerWaalsContact O-N 3.17Å; L380-L399 HydrophobicContact CD2-CD2 3.99Å; L380-A402 HydrophobicContact CD1-CB 3.78Å; L380-A402 HydrophobicContact CD2-CB 3.9Å; L380-H406 WeakPolarHBondContact CD1-CD2 3.29Å; L380-H406 WeakPolarHBondContact CD1-NE2 3.49Å
381	A	87.2	Confident	86	Confident	40 Å²	40	56.2 Å²	56.2	33%	0.331	32%	0.315	S	S	.	.	H	α-helix	trans	-72.5	-37.6	175.8	0	0	0	0	0	112.3	P377 Q378 L379 L383 E384 N385	P377-A381 PolarHBondContact O-N 3.14Å; Q378-A381 PolarHBondContact O-N 3.46Å; L379-A381 VanDerWaalsContact C-N 3.33Å; L379-A381 PolarHBondContact O-N 2.85Å; A381-L383 VanDerWaalsContact C-N 3.28Å; A381-L383 PolarHBondContact O-N 2.8Å; A381-E384 PolarHBondContact O-N 3.23Å; A381-N385 PolarHBondContact O-N 2.85Å; A381-N385 PolarHBondContact O-ND2 3.08Å
382	D	87.6	Confident	85.6	Confident	111 Å²	111	57.9 Å²	57.9	59%	0.594	33%	0.325	S	S	*	.	H	α-helix	trans	-63	-36.7	174.3	-65.9	-32.5	0	0	0	111.4	Q378 L379 N385	Q378-D382 PolarHBondContact O-N 3.06Å; L379-D382 PolarHBondContact O-N 2.92Å; D382-N385 PolarHBondContact O-N 3.2Å
383	L	86.1	Confident	85.4	Confident	13 Å²	13	62.5 Å²	62.5	7%	0.068	35%	0.349	C	S	.	.	H	α-helix	trans	-71.2	-38.7	177.7	-68.1	174.4	0	0	0	113.5	F345 L379 A381 N385 S386 F389 L399	F345-L383 HydrophobicContact CE1-CD1 4Å; F345-L383 HydrophobicContact CE1-CD2 3.86Å; F345-L383 HydrophobicContact CE1-CG 4.48Å; F345-L383 HydrophobicContact CE2-CD1 3.77Å; F345-L383 HydrophobicContact CE2-CD2 4.36Å; F345-L383 HydrophobicContact CZ-CD1 3.49Å; F345-L383 VanDerWaalsContact CZ-CD1 3.49Å; F345-L383 HydrophobicContact CZ-CD2 3.4Å; F345-L383 HydrophobicContact CZ-CG 4.08Å; L379-L383 HydrophobicContact CD1-CD1 4.32Å; L379-L383 HydrophobicContact CD1-CG 4.23Å; L379-L383 HydrophobicContact CG-CD1 4.14Å; L379-L383 HydrophobicContact CG-CG 4.47Å; L379-L383 WeakPolarHBondContact O-CB 3.43Å; L379-L383 WeakPolarHBondContact O-CG 3.49Å; L379-L383 PolarHBondContact O-N 3.03Å; A381-L383 VanDerWaalsContact C-N 3.28Å; A381-L383 PolarHBondContact O-N 2.8Å; L383-N385 PolarHBondContact O-N 2.74Å; L383-S386 PolarHBondContact O-N 3.12Å; L383-S386 PolarHBondContact O-OG 2.93Å; L383-F389 HydrophobicContact CD2-CE2 3.87Å; L383-F389 HydrophobicContact CD2-CZ 3.89Å; L383-L399 HydrophobicContact CB-CD1 4.46Å; L383-L399 HydrophobicContact CB-CD2 4.19Å; L383-L399 HydrophobicContact CD1-CD2 4.36Å
384	E	82.9	Confident	85.4	Confident	105 Å²	105	66.9 Å²	66.9	49%	0.491	37%	0.37	S	S	.	.	H	α-helix	trans	-56.7	-36	174.6	-176.4	176.5	-143.5	0	0	112	L380 A381 S386 M403	L380-E384 PolarHBondContact O-N 3.06Å; L380-E384 VanDerWaalsContact O-N 3.17Å; A381-E384 PolarHBondContact O-N 3.23Å; E384-S386 VanDerWaalsContact C-N 3.3Å; E384-S386 PolarHBondContact O-N 3.26Å; E384-M403 VanDerWaalsContact OE2-CE 3.25Å; E384-M403 WeakPolarHBondContact OE2-CE 3.17Å
385	N	80.8	Confident	85.4	Confident	137 Å²	137	64.1 Å²	64.1	73%	0.733	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-2.7	178.3	-72.4	-83.3	0	0	0	114.1	A381 D382 L383	A381-N385 PolarHBondContact O-N 2.85Å; A381-N385 PolarHBondContact O-ND2 3.08Å; D382-N385 PolarHBondContact O-N 3.2Å; L383-N385 PolarHBondContact O-N 2.74Å
386	S	83.4	Confident	85.3	Confident	36 Å²	36	67.1 Å²	67.1	25%	0.252	37%	0.369	S	S	.	.			trans	-100.1	123.2	-172.8	74.1	0	0	0	0	112.8	L383 E384 M388 F389 T390	L383-S386 PolarHBondContact O-N 3.12Å; L383-S386 PolarHBondContact O-OG 2.93Å; E384-S386 VanDerWaalsContact C-N 3.3Å; E384-S386 PolarHBondContact O-N 3.26Å; S386-M388 PolarHBondContact O-N 3.43Å; S386-F389 PolarHBondContact O-N 3.3Å; S386-F389 WeakPolarHBondContact OG-CD2 3.27Å; S386-T390 PolarHBondContact O-N 2.71Å; S386-T390 PolarHBondContact O-OG1 3.5Å
387	S	77.5	Confident	85.3	Confident	88 Å²	88	69.7 Å²	69.7	62%	0.615	38%	0.375	S	S	*	.	H	α-helix	trans	-58.8	-24.4	-169.5	55.4	0	0	0	0	115.2	F389 T390	S387-F389 PolarHBondContact O-N 2.92Å; S387-T390 PolarHBondContact O-N 2.91Å
388	M	77.3	Confident	85.4	Confident	57 Å²	57	66.6 Å²	66.6	28%	0.281	35%	0.354	S	S	.	.	H	α-helix	trans	-59.4	-26	174.8	-72	-176.4	65.9	0	0	113.7	M349 V352 Q360 L363 S386	M349-M388 HydrophobicContact CE-CE 3.89Å; M349-M388 HydrophobicContact CE-SD 3.95Å; V352-M388 HydrophobicContact CG1-CE 3.79Å; Q360-M388 PolarHBondContact NE2-O 3.26Å; L363-M388 HydrophobicContact CD2-CE 4.42Å; S386-M388 PolarHBondContact O-N 3.43Å
389	F	80	Confident	85.5	Confident	4 Å²	4	59.9 Å²	59.9	2%	0.018	32%	0.323	C	S	.	.	H	α-helix	trans	-108.3	-23.3	-176.5	-59.4	-108.6	0	0	0	111.9	F345 M349 L363 L367 L383 S386 S387 D391 D392 C395 L399	F345-F389 HydrophobicContact CE2-CE1 4.4Å; F345-F389 HydrophobicContact CE2-CZ 4.15Å; F345-F389 AromaticContact CZ-CZ 3.96Å; F345-F389 HydrophobicContact CZ-CZ 3.96Å; M349-F389 HydrophobicContact CE-CE2 3.83Å; M349-F389 HydrophobicContact CE-CZ 3.9Å; M349-F389 HydrophobicContact SD-CE2 4.36Å; M349-F389 HydrophobicContact SD-CZ 3.81Å; L363-F389 HydrophobicContact CD2-CE1 4.5Å; L363-F389 HydrophobicContact CD2-CZ 4.5Å; L367-F389 HydrophobicContact CD1-CD1 3.99Å; L367-F389 HydrophobicContact CD1-CE1 3.58Å; L367-F389 HydrophobicContact CD2-CE1 4.15Å; L383-F389 HydrophobicContact CD2-CE2 3.87Å; L383-F389 HydrophobicContact CD2-CZ 3.89Å; S386-F389 PolarHBondContact O-N 3.3Å; S386-F389 WeakPolarHBondContact OG-CD2 3.27Å; S387-F389 PolarHBondContact O-N 2.92Å; F389-D391 VanDerWaalsContact C-N 3.3Å; F389-D391 PolarHBondContact O-N 3.14Å; F389-D392 PolarHBondContact O-N 3.49Å; F389-C395 HydrophobicContact CB-CB 4.33Å; F389-C395 HydrophobicContact CD1-CB 4.19Å; F389-L399 HydrophobicContact CB-CD1 4.1Å; F389-L399 HydrophobicContact CD1-CD1 4.15Å; F389-L399 HydrophobicContact CG-CD1 4.41Å
390	T	73.9	Confident	85.5	Confident	71 Å²	71	64 Å²	64	44%	0.436	34%	0.343	S	S	.	.	H	α-helix	trans	-64.4	-32.7	179	-40.2	0	0	0	0	112.5	S386 S387 Q396	S386-T390 PolarHBondContact O-N 2.71Å; S386-T390 PolarHBondContact O-OG1 3.5Å; S387-T390 PolarHBondContact O-N 2.91Å; T390-Q396 PolarHBondContact O-NE2 3.39Å
391	D	79.9	Confident	85.6	Confident	139 Å²	139	66.7 Å²	66.7	74%	0.743	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-11.5	-176.5	-67.8	-22.1	0	0	0	114.4	F389	F389-D391 VanDerWaalsContact C-N 3.3Å; F389-D391 PolarHBondContact O-N 3.14Å
392	D	85.8	Confident	85.8	Confident	46 Å²	46	64.8 Å²	64.8	25%	0.246	34%	0.34	C	S	.	.			trans	-115.7	114.4	-174.9	-179.8	-6.3	0	0	0	112.4	A364 F389 E394 C395 Q396	A364-D392 WeakPolarHBondContact CB-OD2 3.22Å; F389-D392 PolarHBondContact O-N 3.49Å; D392-E394 VanDerWaalsContact C-N 3.31Å; D392-E394 PolarHBondContact O-N 2.71Å; D392-E394 PolarHBondContact OD1-N 2.71Å; D392-C395 HydrophobicContact CB-CB 3.95Å; D392-C395 WeakPolarHBondContact O-CB 3.41Å; D392-C395 PolarHBondContact O-N 2.84Å; D392-C395 PolarHBondContact OD2-SG 3.27Å; D392-Q396 WeakPolarHBondContact O-CG 3.04Å; D392-Q396 PolarHBondContact O-N 2.84Å
393	L	88.4	Confident	85.9	Confident	99 Å²	99	61.8 Å²	61.8	52%	0.518	32%	0.323	S	S	.	.	H	α-helix	trans	-61.4	-32	-179.4	-177.7	62.7	0	0	0	113.9	K397	L393-K397 WeakPolarHBondContact O-CD 3.35Å; L393-K397 VanDerWaalsContact O-CG 3.28Å; L393-K397 WeakPolarHBondContact O-CG 3.4Å; L393-K397 PolarHBondContact O-N 3.47Å
394	E	90.4	Very high	86.1	Confident	93 Å²	93	66.3 Å²	66.3	44%	0.435	34%	0.342	S	S	.	.	H	α-helix	trans	-75.9	-37.4	176.7	-58.4	-47.1	132	0	0	111.1	A364 D392 K397 L398	A364-E394 HydrophobicContact CB-CB 3.78Å; D392-E394 VanDerWaalsContact C-N 3.31Å; D392-E394 PolarHBondContact O-N 2.71Å; D392-E394 PolarHBondContact OD1-N 2.71Å; E394-K397 PolarHBondContact O-N 2.96Å; E394-K397 IonicContact OE1-NZ 3.42Å; E394-K397 PolarHBondContact OE1-NZ 3.48Å; E394-K397 WeakPolarHBondContact OE2-CD 3.33Å; E394-K397 IonicContact OE2-NZ 2.65Å; E394-K397 PolarHBondContact OE2-NZ 2.91Å; E394-L398 VanDerWaalsContact O-CG 3.3Å; E394-L398 WeakPolarHBondContact O-CG 3.42Å; E394-L398 PolarHBondContact O-N 3.46Å; E394-L398 VanDerWaalsContact O-N 3.1Å
395	C	89.9	Confident	86.4	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.007	32%	0.324	C	S	.	.	H	α-helix	trans	-58.7	-46.7	169.4	-70.7	0	0	0	0	111.4	L367 F389 D392 K397 L398 L399	L367-C395 HydrophobicContact CD1-CB 4.46Å; F389-C395 HydrophobicContact CB-CB 4.33Å; F389-C395 HydrophobicContact CD1-CB 4.19Å; D392-C395 HydrophobicContact CB-CB 3.95Å; D392-C395 WeakPolarHBondContact O-CB 3.41Å; D392-C395 PolarHBondContact O-N 2.84Å; D392-C395 PolarHBondContact OD2-SG 3.27Å; C395-K397 PolarHBondContact O-N 3.37Å; C395-L398 PolarHBondContact O-N 3.49Å; C395-L399 WeakPolarHBondContact O-CG 3.41Å; C395-L399 PolarHBondContact O-N 3.19Å; C395-L399 VanDerWaalsContact O-N 3.07Å
396	Q	89.7	Confident	86.7	Confident	73 Å²	73	58.3 Å²	58.3	34%	0.341	30%	0.299	S	S	.	.	H	α-helix	trans	-58.6	-44.9	175.8	-69.3	-179.5	8.4	0	0	112.7	T390 D392 L398 L399 M400	T390-Q396 PolarHBondContact O-NE2 3.39Å; D392-Q396 WeakPolarHBondContact O-CG 3.04Å; D392-Q396 PolarHBondContact O-N 2.84Å; Q396-L398 VanDerWaalsContact C-N 3.34Å; Q396-L398 PolarHBondContact O-N 2.92Å; Q396-L399 PolarHBondContact O-N 2.79Å; Q396-M400 HydrophobicContact CB-CE 4.38Å; Q396-M400 WeakPolarHBondContact O-CB 3.33Å; Q396-M400 WeakPolarHBondContact O-CG 3.4Å; Q396-M400 PolarHBondContact O-N 2.71Å
397	K	91.6	Very high	87	Confident	93 Å²	93	63 Å²	63	40%	0.404	32%	0.32	S	S	.	.	H	α-helix	trans	-58.8	-44.1	177.4	-76.6	160.8	173.6	174.7	0	112.3	L393 E394 C395 M400 E401	L393-K397 WeakPolarHBondContact O-CD 3.35Å; L393-K397 VanDerWaalsContact O-CG 3.28Å; L393-K397 WeakPolarHBondContact O-CG 3.4Å; L393-K397 PolarHBondContact O-N 3.47Å; E394-K397 PolarHBondContact O-N 2.96Å; E394-K397 IonicContact OE1-NZ 3.42Å; E394-K397 PolarHBondContact OE1-NZ 3.48Å; E394-K397 WeakPolarHBondContact OE2-CD 3.33Å; E394-K397 IonicContact OE2-NZ 2.65Å; E394-K397 PolarHBondContact OE2-NZ 2.91Å; C395-K397 PolarHBondContact O-N 3.37Å; K397-M400 HydrophobicContact CG-CE 4.46Å; K397-M400 PolarHBondContact O-N 3Å; K397-E401 PolarHBondContact O-N 2.96Å
398	L	91.9	Very high	87.5	Confident	18 Å²	18	61.3 Å²	61.3	9%	0.094	30%	0.304	C	S	.	.	H	α-helix	trans	-64.7	-39.5	179.3	-70.3	172.4	0	0	0	112	L367 L372 E394 C395 Q396 A402 R419	L367-L398 HydrophobicContact CB-CD1 3.91Å; L372-L398 HydrophobicContact CD1-CB 3.81Å; E394-L398 VanDerWaalsContact O-CG 3.3Å; E394-L398 WeakPolarHBondContact O-CG 3.42Å; E394-L398 PolarHBondContact O-N 3.46Å; E394-L398 VanDerWaalsContact O-N 3.1Å; C395-L398 PolarHBondContact O-N 3.49Å; Q396-L398 VanDerWaalsContact C-N 3.34Å; Q396-L398 PolarHBondContact O-N 2.92Å; L398-A402 PolarHBondContact O-N 3.48Å; L398-R419 VanDerWaalsContact CD2-CZ 3.43Å
399	L	91.4	Very high	87.5	Confident	12 Å²	12	61.5 Å²	61.5	6%	0.063	31%	0.309	C	S	.	.	H	α-helix	trans	-67.9	-46.3	174	-69.8	173.2	0	0	0	112	L380 L383 F389 C395 Q396 E401 A402 M403	L380-L399 HydrophobicContact CD2-CD2 3.99Å; L383-L399 HydrophobicContact CB-CD1 4.46Å; L383-L399 HydrophobicContact CB-CD2 4.19Å; L383-L399 HydrophobicContact CD1-CD2 4.36Å; F389-L399 HydrophobicContact CB-CD1 4.1Å; F389-L399 HydrophobicContact CD1-CD1 4.15Å; F389-L399 HydrophobicContact CG-CD1 4.41Å; C395-L399 WeakPolarHBondContact O-CG 3.41Å; C395-L399 PolarHBondContact O-N 3.19Å; C395-L399 VanDerWaalsContact O-N 3.07Å; Q396-L399 PolarHBondContact O-N 2.79Å; L399-E401 VanDerWaalsContact C-N 3.28Å; L399-E401 PolarHBondContact O-N 2.88Å; L399-A402 WeakPolarHBondContact O-CB 3.12Å; L399-A402 PolarHBondContact O-N 3.03Å; L399-A402 VanDerWaalsContact O-N 3.08Å; L399-M403 WeakPolarHBondContact O-CG 3.23Å; L399-M403 PolarHBondContact O-N 3.36Å
400	M	89.6	Confident	87.3	Confident	105 Å²	105	67.8 Å²	67.8	52%	0.517	34%	0.339	S	S	.	.	H	α-helix	trans	-58.8	-36.4	177.2	-77.5	-170.4	-74.5	0	0	112.8	Q396 K397 K404	Q396-M400 HydrophobicContact CB-CE 4.38Å; Q396-M400 WeakPolarHBondContact O-CB 3.33Å; Q396-M400 WeakPolarHBondContact O-CG 3.4Å; Q396-M400 PolarHBondContact O-N 2.71Å; K397-M400 HydrophobicContact CG-CE 4.46Å; K397-M400 PolarHBondContact O-N 3Å; M400-K404 WeakPolarHBondContact O-CB 3.31Å; M400-K404 PolarHBondContact O-N 2.95Å
401	E	91.8	Very high	87.6	Confident	59 Å²	59	71.2 Å²	71.2	28%	0.276	34%	0.344	S	S	.	.	H	α-helix	trans	-63.5	-45.6	173.6	-173.9	-172.3	152.9	0	0	111.8	K397 L399 K404 Y405 S417 R419	K397-E401 PolarHBondContact O-N 2.96Å; L399-E401 VanDerWaalsContact C-N 3.28Å; L399-E401 PolarHBondContact O-N 2.88Å; E401-K404 PolarHBondContact O-N 2.92Å; E401-Y405 PolarHBondContact O-N 3.2Å; E401-S417 PolarHBondContact OE1-OG 3.08Å; E401-R419 IonicContact OE1-CZ 2.78Å; E401-R419 IonicContact OE1-NH1 3.8Å; E401-R419 PolarHBondContact OE1-NH1 3.01Å; E401-R419 IonicContact OE1-NH2 3.68Å; E401-R419 PolarHBondContact OE1-NH2 3.01Å; E401-R419 IonicContact OE2-CZ 2.79Å; E401-R419 IonicContact OE2-NH1 3.72Å; E401-R419 PolarHBondContact OE2-NH1 2.89Å; E401-R419 IonicContact OE2-NH2 2.71Å; E401-R419 PolarHBondContact OE2-NH2 3.23Å
402	A	91.3	Very high	87.7	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-62.4	-49.6	177.8	0	0	0	0	0	111.4	L372 P373 L380 L398 L399 K404 Y405 H406	L372-A402 HydrophobicContact CB-CB 3.9Å; P373-A402 HydrophobicContact CG-CB 4.26Å; L380-A402 HydrophobicContact CD1-CB 3.78Å; L380-A402 HydrophobicContact CD2-CB 3.9Å; L398-A402 PolarHBondContact O-N 3.48Å; L399-A402 WeakPolarHBondContact O-CB 3.12Å; L399-A402 PolarHBondContact O-N 3.03Å; L399-A402 VanDerWaalsContact O-N 3.08Å; A402-K404 VanDerWaalsContact C-N 3.32Å; A402-K404 PolarHBondContact O-N 3.33Å; A402-Y405 WeakPolarHBondContact O-CB 3.38Å; A402-Y405 PolarHBondContact O-N 2.84Å; A402-H406 PolarHBondContact O-CD2 3.19Å; A402-H406 PolarHBondContact O-N 2.88Å; A402-H406 VanDerWaalsContact O-N 3.11Å
403	M	90	Very high	87.2	Confident	48 Å²	48	69.2 Å²	69.2	24%	0.236	33%	0.332	C	S	.	.	H	α-helix	trans	-57.4	-44.5	176.2	-64.7	169.2	85.4	0	0	111.5	E384 L399 Y405 H406 L407	E384-M403 VanDerWaalsContact OE2-CE 3.25Å; E384-M403 WeakPolarHBondContact OE2-CE 3.17Å; L399-M403 WeakPolarHBondContact O-CG 3.23Å; L399-M403 PolarHBondContact O-N 3.36Å; M403-Y405 VanDerWaalsContact C-N 3.3Å; M403-Y405 PolarHBondContact O-N 2.94Å; M403-H406 PolarHBondContact O-N 2.92Å; M403-H406 VanDerWaalsContact O-N 3.15Å; M403-L407 WeakPolarHBondContact O-CB 3.49Å; M403-L407 VanDerWaalsContact O-CG 3.28Å; M403-L407 WeakPolarHBondContact O-CG 3.36Å; M403-L407 PolarHBondContact O-N 3.19Å
404	K	90.3	Very high	86.8	Confident	109 Å²	109	71.2 Å²	71.2	47%	0.474	34%	0.34	S	S	.	.	H	α-helix	trans	-60.4	-35	175.6	-179.8	-177.6	176.1	-173.7	0	113	M400 E401 A402 L408 L415	M400-K404 WeakPolarHBondContact O-CB 3.31Å; M400-K404 PolarHBondContact O-N 2.95Å; E401-K404 PolarHBondContact O-N 2.92Å; A402-K404 VanDerWaalsContact C-N 3.32Å; A402-K404 PolarHBondContact O-N 3.33Å; K404-L408 HydrophobicContact CG-CD1 3.96Å; K404-L408 PolarHBondContact O-N 3.12Å; K404-L415 HydrophobicContact CG-CD1 4.48Å
405	Y	89.4	Confident	86.4	Confident	30 Å²	30	69 Å²	69	12%	0.118	33%	0.331	C	S	.	.	H	α-helix	trans	-70.2	-34.1	175.5	-175.4	-98	0	0	0	112.6	P373 L374 E401 A402 M403 R412 L415 T420	P373-Y405 HydrophobicContact CB-CD1 3.66Å; P373-Y405 HydrophobicContact CB-CE1 4.23Å; P373-Y405 HydrophobicContact CB-CG 3.83Å; P373-Y405 VanDerWaalsContact O-CD1 3.22Å; P373-Y405 WeakPolarHBondContact O-CD1 3.38Å; P373-Y405 WeakPolarHBondContact O-CE1 3.44Å; L374-Y405 HydrophobicContact CD2-CE1 4.42Å; E401-Y405 PolarHBondContact O-N 3.2Å; A402-Y405 WeakPolarHBondContact O-CB 3.38Å; A402-Y405 PolarHBondContact O-N 2.84Å; M403-Y405 VanDerWaalsContact C-N 3.3Å; M403-Y405 PolarHBondContact O-N 2.94Å; Y405-R412 HydrophobicContact CD2-CB 4.37Å; Y405-R412 HydrophobicContact CD2-CG 3.86Å; Y405-R412 HydrophobicContact CE1-CG 4.38Å; Y405-R412 HydrophobicContact CE2-CB 3.73Å; Y405-R412 HydrophobicContact CE2-CG 3.57Å; Y405-R412 HydrophobicContact CG-CG 4.37Å; Y405-R412 PolarHBondContact O-NE 3.2Å; Y405-R412 PolarHBondContact O-NH2 3.23Å; Y405-L415 HydrophobicContact CD2-CB 4.21Å; Y405-T420 HydrophobicContact CD2-CG2 3.74Å; Y405-T420 HydrophobicContact CE2-CG2 3.53Å; Y405-T420 HydrophobicContact CG-CG2 4.41Å
406	H	87.8	Confident	86	Confident	44 Å²	44	72.5 Å²	72.5	20%	0.204	35%	0.347	C	S	.	.	H	α-helix	trans	-70.5	-45.5	170.7	-68.3	-74	0	0	0	112	L375 L380 A402 M403 L408 R412	L375-H406 PolarHBondContact O-CE1 2.83Å; L375-H406 VanDerWaalsContact O-CE1 3.29Å; L375-H406 PolarHBondContact O-NE2 2.91Å; L380-H406 WeakPolarHBondContact CD1-CD2 3.29Å; L380-H406 WeakPolarHBondContact CD1-NE2 3.49Å; A402-H406 PolarHBondContact O-CD2 3.19Å; A402-H406 PolarHBondContact O-N 2.88Å; A402-H406 VanDerWaalsContact O-N 3.11Å; M403-H406 PolarHBondContact O-N 2.92Å; M403-H406 VanDerWaalsContact O-N 3.15Å; H406-L408 VanDerWaalsContact C-N 3.32Å; H406-L408 PolarHBondContact O-N 3.07Å; H406-R412 PolarHBondContact O-NH2 2.78Å
407	L	89.1	Confident	85.9	Confident	134 Å²	134	70.5 Å²	70.5	70%	0.702	34%	0.342	S	S	*	.	H	α-helix	trans	-69.9	-16.2	-175.5	-71.3	169.6	0	0	0	115.5	M403	M403-L407 WeakPolarHBondContact O-CB 3.49Å; M403-L407 VanDerWaalsContact O-CG 3.28Å; M403-L407 WeakPolarHBondContact O-CG 3.36Å; M403-L407 PolarHBondContact O-N 3.19Å
408	L	87.1	Confident	85.6	Confident	52 Å²	52	71.6 Å²	71.6	27%	0.272	36%	0.358	S	S	.	.			trans	-128.2	64.9	-177.3	-61.3	170.8	0	0	0	113	K404 H406 E410 R411 R412 L415	K404-L408 HydrophobicContact CG-CD1 3.96Å; K404-L408 PolarHBondContact O-N 3.12Å; H406-L408 VanDerWaalsContact C-N 3.32Å; H406-L408 PolarHBondContact O-N 3.07Å; L408-E410 VanDerWaalsContact C-N 3.29Å; L408-E410 PolarHBondContact O-N 3.02Å; L408-R411 HydrophobicContact CB-CB 4.15Å; L408-R411 HydrophobicContact CB-CG 4.43Å; L408-R411 PolarHBondContact O-N 2.8Å; L408-R412 PolarHBondContact O-N 3.29Å; L408-L415 HydrophobicContact CB-CD1 4.42Å
409	P	78.6	Confident	85.5	Confident	61 Å²	61	72.7 Å²	72.7	40%	0.396	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-53.9	-40.9	-176.6	-24.6	34.8	0	0	0	114.2	R411 R412	P409-R411 PolarHBondContact O-N 3.07Å; P409-R412 WeakPolarHBondContact O-CG 3.47Å; P409-R412 PolarHBondContact O-N 3.44Å
410	E	76.5	Confident	85.3	Confident	137 Å²	137	72.3 Å²	72.3	64%	0.64	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-70.8	-12.7	-176.1	-48.3	69.7	-150.2	0	0	112.6	L408	L408-E410 VanDerWaalsContact C-N 3.29Å; L408-E410 PolarHBondContact O-N 3.02Å
411	R	80.1	Confident	85.2	Confident	142 Å²	142	70.8 Å²	70.8	54%	0.536	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-109.5	0.5	-179.3	-56.8	-168.1	-178.9	-170.3	0.6	113.4	L408 P409 S413 M414 L415	L408-R411 HydrophobicContact CB-CB 4.15Å; L408-R411 HydrophobicContact CB-CG 4.43Å; L408-R411 PolarHBondContact O-N 2.8Å; P409-R411 PolarHBondContact O-N 3.07Å; R411-S413 PolarHBondContact O-N 2.71Å; R411-S413 VanDerWaalsContact O-N 3.14Å; R411-M414 HydrophobicContact CB-CE 3.76Å; R411-M414 HydrophobicContact CG-CE 3.7Å; R411-M414 WeakPolarHBondContact O-CA 3.28Å; R411-M414 PolarHBondContact O-N 2.86Å; R411-L415 HydrophobicContact CB-CD1 4.37Å; R411-L415 PolarHBondContact O-N 2.84Å
412	R	82.1	Confident	85.1	Confident	83 Å²	83	69.8 Å²	69.8	31%	0.313	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-55.6	-33.3	-177.6	-72.4	-178.6	-179.3	156.4	11	113.7	Y405 H406 L408 P409 M414 L415 Q416	Y405-R412 HydrophobicContact CD2-CB 4.37Å; Y405-R412 HydrophobicContact CD2-CG 3.86Å; Y405-R412 HydrophobicContact CE1-CG 4.38Å; Y405-R412 HydrophobicContact CE2-CB 3.73Å; Y405-R412 HydrophobicContact CE2-CG 3.57Å; Y405-R412 HydrophobicContact CG-CG 4.37Å; Y405-R412 PolarHBondContact O-NE 3.2Å; Y405-R412 PolarHBondContact O-NH2 3.23Å; H406-R412 PolarHBondContact O-NH2 2.78Å; L408-R412 PolarHBondContact O-N 3.29Å; P409-R412 WeakPolarHBondContact O-CG 3.47Å; P409-R412 PolarHBondContact O-N 3.44Å; R412-M414 PolarHBondContact O-N 3.4Å; R412-L415 CarbonylContact O-C 3.59Å; R412-L415 PolarHBondContact O-N 3.38Å; R412-L415 VanDerWaalsContact O-N 3.11Å; R412-Q416 PolarHBondContact O-NE2 3.1Å
413	S	75.1	Confident	85.1	Confident	60 Å²	60	69.8 Å²	69.8	42%	0.42	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-65.2	-23	174.1	51.1	0	0	0	0	114.2	R411	R411-S413 PolarHBondContact O-N 2.71Å; R411-S413 VanDerWaalsContact O-N 3.14Å
414	M	78.5	Confident	85.1	Confident	141 Å²	141	70.5 Å²	70.5	70%	0.695	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-97.2	-0.7	174	-59.1	-180	-69.6	0	0	112.9	R411 R412	R411-M414 HydrophobicContact CB-CE 3.76Å; R411-M414 HydrophobicContact CG-CE 3.7Å; R411-M414 WeakPolarHBondContact O-CA 3.28Å; R411-M414 PolarHBondContact O-N 2.86Å; R412-M414 PolarHBondContact O-N 3.4Å
415	L	82.8	Confident	85.2	Confident	46 Å²	46	66.6 Å²	66.6	24%	0.241	34%	0.336	C	S	.	.	S	Bend	trans	-115.3	24.3	179.8	-62.8	174.9	0	0	0	111.3	K404 Y405 L408 R411 R412 T420	K404-L415 HydrophobicContact CG-CD1 4.48Å; Y405-L415 HydrophobicContact CD2-CB 4.21Å; L408-L415 HydrophobicContact CB-CD1 4.42Å; R411-L415 HydrophobicContact CB-CD1 4.37Å; R411-L415 PolarHBondContact O-N 2.84Å; R412-L415 CarbonylContact O-C 3.59Å; R412-L415 PolarHBondContact O-N 3.38Å; R412-L415 VanDerWaalsContact O-N 3.11Å; L415-T420 WeakPolarHBondContact O-CG2 3.42Å
416	Q	82.2	Confident	85.2	Confident	76 Å²	76	66.6 Å²	66.6	36%	0.355	34%	0.339	S	S	.	.			trans	-72.5	132.7	-179.5	-68.8	-58.5	-57.3	0	0	111.7	R412 T420	R412-Q416 PolarHBondContact O-NE2 3.1Å; Q416-T420 WeakPolarHBondContact CA-OG1 3.28Å; Q416-T420 PolarHBondContact OE1-OG1 3.08Å
417	S	86.3	Confident	85.3	Confident	31 Å²	31	64.9 Å²	64.9	22%	0.217	33%	0.332	C	S	.	.			trans	-145.3	168.6	173.9	80	0	0	0	0	109.4	E401 R419 T420	E401-S417 PolarHBondContact OE1-OG 3.08Å; S417-R419 PolarHBondContact O-N 2.72Å; S417-R419 PolarHBondContact OG-N 2.97Å; S417-T420 PolarHBondContact N-OG1 2.83Å; S417-T420 PolarHBondContact O-N 2.7Å; S417-T420 PolarHBondContact O-OG1 3.22Å
418	P	85.6	Confident	85.4	Confident	116 Å²	116	59.1 Å²	59.1	75%	0.753	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-25	173.1	-27.5	36.5	0	0	0	113.7
419	R	89.2	Confident	85.8	Confident	40 Å²	40	56.9 Å²	56.9	15%	0.151	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-9.5	175.3	-80.7	-176.3	-78.7	111	10.9	114.7	S368 I370 R371 P373 L398 E401 S417	S368-R419 VanDerWaalsContact O-CD 3.26Å; S368-R419 WeakPolarHBondContact O-CD 3.24Å; I370-R419 WeakPolarHBondContact O-CD 3.2Å; I370-R419 WeakPolarHBondContact O-CG 3.23Å; R371-R419 WeakPolarHBondContact CA-O 3.21Å; R371-R419 VanDerWaalsContact CB-O 3.28Å; R371-R419 WeakPolarHBondContact CB-O 3.22Å; R371-R419 WeakPolarHBondContact CG-O 3.39Å; P373-R419 HydrophobicContact CG-CB 4.4Å; L398-R419 VanDerWaalsContact CD2-CZ 3.43Å; E401-R419 IonicContact OE1-CZ 2.78Å; E401-R419 IonicContact OE1-NH1 3.8Å; E401-R419 PolarHBondContact OE1-NH1 3.01Å; E401-R419 IonicContact OE1-NH2 3.68Å; E401-R419 PolarHBondContact OE1-NH2 3.01Å; E401-R419 IonicContact OE2-CZ 2.79Å; E401-R419 IonicContact OE2-NH1 3.72Å; E401-R419 PolarHBondContact OE2-NH1 2.89Å; E401-R419 IonicContact OE2-NH2 2.71Å; E401-R419 PolarHBondContact OE2-NH2 3.23Å; S417-R419 PolarHBondContact O-N 2.72Å; S417-R419 PolarHBondContact OG-N 2.97Å
420	T	87.6	Confident	86.6	Confident	5 Å²	5	54 Å²	54	3%	0.031	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-13.7	172	63.3	0	0	0	0	113.4	P373 Y405 L415 Q416 S417	P373-T420 HydrophobicContact CB-CG2 4.06Å; P373-T420 HydrophobicContact CG-CG2 4.18Å; Y405-T420 HydrophobicContact CD2-CG2 3.74Å; Y405-T420 HydrophobicContact CE2-CG2 3.53Å; Y405-T420 HydrophobicContact CG-CG2 4.41Å; L415-T420 WeakPolarHBondContact O-CG2 3.42Å; Q416-T420 WeakPolarHBondContact CA-OG1 3.28Å; Q416-T420 PolarHBondContact OE1-OG1 3.08Å; S417-T420 PolarHBondContact N-OG1 2.83Å; S417-T420 PolarHBondContact O-N 2.7Å; S417-T420 PolarHBondContact O-OG1 3.22Å
421	K	88.1	Confident	87.6	Confident	73 Å²	73	47.6 Å²	47.6	32%	0.317	25%	0.245	S	C	.	.	S	Bend	trans	-79.5	121.1	172.9	175.8	169.4	178	154.3	0	110.3	R371 D669	R371-K421 PolarHBondContact NE-O 3.42Å; R371-K421 PolarHBondContact NH2-O 2.78Å; K421-D669 WeakPolarHBondContact CD-OD2 3.39Å; K421-D669 VanDerWaalsContact CE-CG 3.47Å; K421-D669 WeakPolarHBondContact CE-OD1 3.45Å; K421-D669 WeakPolarHBondContact CE-OD2 3.26Å; K421-D669 IonicContact NZ-OD1 2.92Å; K421-D669 PolarHBondContact NZ-OD1 3.34Å; K421-D669 IonicContact NZ-OD2 3.23Å; K421-D669 PolarHBondContact NZ-OD2 2.78Å
422	P	89.2	Confident	88.3	Confident	37 Å²	37	40.9 Å²	40.9	24%	0.24	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-66.6	161.1	177.8	-15.4	28.6	0	0	0	113.2	L374 T426 V427	L374-P422 HydrophobicContact CD1-CB 3.85Å; L374-P422 HydrophobicContact CD1-CG 3.84Å; P422-T426 VanDerWaalsContact CB-OG1 3.29Å; P422-T426 WeakPolarHBondContact CB-OG1 3.04Å; P422-V427 HydrophobicContact CB-CG1 3.84Å; P422-V427 HydrophobicContact CG-CG1 4.22Å
423	R	90.7	Very high	89	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-72.4	154.9	172.8	-65.3	-173.7	-160.3	-100.6	-0	110.9	L331 S333 E341 Y369 R371 S425 T426 V427	L331-R423 PolarHBondContact O-NH1 3.26Å; L331-R423 PolarHBondContact O-NH2 3.19Å; S333-R423 PolarHBondContact O-NH1 3.05Å; E341-R423 IonicContact OE1-CZ 2.8Å; E341-R423 IonicContact OE1-NE 3.92Å; E341-R423 PolarHBondContact OE1-NE 2.84Å; E341-R423 IonicContact OE1-NH2 3.2Å; E341-R423 PolarHBondContact OE1-NH2 2.78Å; E341-R423 IonicContact OE2-CZ 3.57Å; E341-R423 IonicContact OE2-NE 3.3Å; E341-R423 PolarHBondContact OE2-NE 3.06Å; E341-R423 IonicContact OE2-NH2 2.71Å; Y369-R423 PolarHBondContact O-NH2 2.8Å; R371-R423 VanDerWaalsContact CZ-CG 3.44Å; R423-S425 PolarHBondContact O-N 3.06Å; R423-S425 VanDerWaalsContact O-N 3.16Å; R423-T426 HydrophobicContact CB-CG2 4.37Å; R423-T426 PolarHBondContact N-OG1 3.16Å; R423-T426 PolarHBondContact O-N 2.86Å; R423-T426 PolarHBondContact O-OG1 2.88Å; R423-V427 PolarHBondContact O-N 2.8Å
424	K	91.7	Very high	89.9	Confident	63 Å²	63	34 Å²	34	27%	0.274	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-29.4	-174.3	-57.8	-175.9	-153.5	162.8	0	113.5	D334 D335 V427 L450 R451	D334-K424 PolarHBondContact O-N 3.45Å; D334-K424 VanDerWaalsContact O-N 3.12Å; D335-K424 VanDerWaalsContact OD1-CD 3.31Å; D335-K424 WeakPolarHBondContact OD1-CD 3.27Å; D335-K424 WeakPolarHBondContact OD1-CE 3.42Å; D335-K424 IonicContact OD1-NZ 2.71Å; D335-K424 PolarHBondContact OD1-NZ 3.29Å; D335-K424 IonicContact OD2-NZ 3.72Å; D335-K424 PolarHBondContact OD2-NZ 2.97Å; K424-V427 WeakPolarHBondContact O-CG2 3.44Å; K424-L450 HydrophobicContact CB-CB 4.29Å; K424-L450 HydrophobicContact CB-CD2 4.26Å; K424-L450 HydrophobicContact CB-CG 4.13Å; K424-L450 HydrophobicContact CD-CG 4.29Å; K424-L450 WeakPolarHBondContact CD-O 3.46Å; K424-L450 HydrophobicContact CG-CD2 4.2Å; K424-L450 HydrophobicContact CG-CG 4.12Å; K424-R451 HydrophobicContact CB-CB 4.22Å
425	S	90.6	Very high	90.6	Very high	27 Å²	27	27.3 Å²	27.3	19%	0.189	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-34.4	171.3	44.5	0	0	0	0	113.8	I336 R423	I336-S425 WeakPolarHBondContact O-CB 3.4Å; I336-S425 PolarHBondContact O-OG 3.35Å; R423-S425 PolarHBondContact O-N 3.06Å; R423-S425 VanDerWaalsContact O-N 3.16Å
426	T	89.9	Confident	91	Very high	30 Å²	30	27.8 Å²	27.8	18%	0.184	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-10.8	-170.2	64.8	0	0	0	0	115.2	V338 P422 R423 G428	V338-T426 HydrophobicContact CG2-CG2 4.38Å; P422-T426 VanDerWaalsContact CB-OG1 3.29Å; P422-T426 WeakPolarHBondContact CB-OG1 3.04Å; R423-T426 HydrophobicContact CB-CG2 4.37Å; R423-T426 PolarHBondContact N-OG1 3.16Å; R423-T426 PolarHBondContact O-N 2.86Å; R423-T426 PolarHBondContact O-OG1 2.88Å; T426-G428 VanDerWaalsContact C-N 3.25Å; T426-G428 PolarHBondContact O-N 2.65Å
427	V	90.4	Very high	91.4	Very high	9 Å²	9	25 Å²	25	6%	0.055	14%	0.141	C	C	.	.	S	Bend	trans	-73.5	-18.1	179.2	-63	0	0	0	0	113.1	P422 R423 K424 L450 L667 G668 K715	P422-V427 HydrophobicContact CB-CG1 3.84Å; P422-V427 HydrophobicContact CG-CG1 4.22Å; R423-V427 PolarHBondContact O-N 2.8Å; K424-V427 WeakPolarHBondContact O-CG2 3.44Å; V427-L450 HydrophobicContact CG2-CB 4.45Å; V427-L450 HydrophobicContact CG2-CD2 3.76Å; V427-L667 HydrophobicContact CB-CD1 4.41Å; V427-L667 HydrophobicContact CG2-CD1 3.93Å; V427-L667 HydrophobicContact CG2-CG 4.25Å; V427-G668 VanDerWaalsContact CG1-CA 3.48Å; V427-K715 WeakPolarHBondContact O-CE 3.08Å
428	G	91.4	Very high	91.4	Very high	12 Å²	12	28 Å²	28	12%	0.124	17%	0.168	C	C	.	.			trans	93.2	-169.8	-168.4	0	0	0	0	0	112.1	T426 V714	T426-G428 VanDerWaalsContact C-N 3.25Å; T426-G428 PolarHBondContact O-N 2.65Å; G428-V714 CarbonylContact C-O 3.45Å; G428-V714 WeakPolarHBondContact CA-O 3.38Å
429	A	94.2	Very high	91.3	Very high	6 Å²	6	26.4 Å²	26.4	5%	0.05	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	149.5	-179.7	0	0	0	0	0	111.6	Y431 K447 Y448 V713 V714	A429-Y431 HydrophobicContact CB-CE2 3.93Å; A429-Y431 WeakPolarHBondContact O-CD2 3.5Å; A429-K447 HydrophobicContact CB-CD 4.12Å; A429-K447 HydrophobicContact CB-CG 3.8Å; A429-Y448 WeakPolarHBondContact CB-O 3.31Å; A429-V713 CarbonylContact O-C 3.55Å; A429-V713 VanDerWaalsContact O-CA 3.31Å; A429-V713 WeakPolarHBondContact O-CA 3.44Å; A429-V714 PolarHBondContact N-O 2.89Å; A429-V714 PolarHBondContact O-N 2.76Å
430	L	95.9	Very high	90.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	127.1	-175.6	-173.6	76.1	0	0	0	109.4	K447 Y448 W455 C665 L667 Y672 V674 V711 V713	L430-K447 CarbonylContact O-C 3.57Å; L430-K447 WeakPolarHBondContact O-CA 3.43Å; L430-Y448 HydrophobicContact CB-CD1 4.29Å; L430-Y448 HydrophobicContact CD2-CD1 4.39Å; L430-Y448 PolarHBondContact N-O 3.01Å; L430-Y448 VanDerWaalsContact N-O 3.1Å; L430-Y448 PolarHBondContact O-N 3.19Å; L430-W455 HydrophobicContact CD2-CH2 3.87Å; L430-W455 HydrophobicContact CD2-CZ2 4.2Å; L430-W455 HydrophobicContact CG-CH2 4.33Å; L430-C665 HydrophobicContact CD1-CB 3.7Å; L430-L667 HydrophobicContact CB-CD2 4.22Å; L430-Y672 HydrophobicContact CD2-CG 4.38Å; L430-V674 HydrophobicContact CD2-CG2 4.14Å; L430-V711 HydrophobicContact CD1-CG1 3.33Å; L430-V711 HydrophobicContact CD2-CG1 4.16Å; L430-V711 HydrophobicContact CG-CG1 3.63Å; L430-V713 HydrophobicContact CB-CG2 4.47Å; L430-V713 HydrophobicContact CD1-CG2 3.62Å
431	Y	96.9	Very high	90.6	Very high	3 Å²	3	31.8 Å²	31.8	1%	0.012	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	116.1	-176.3	-75.9	-104.7	0	0	0	110.5	A429 I445 E446 K447 I458 L477 P497 V711 V712 V714 L716	A429-Y431 HydrophobicContact CB-CE2 3.93Å; A429-Y431 WeakPolarHBondContact O-CD2 3.5Å; Y431-I445 HydrophobicContact CD1-CG2 3.94Å; Y431-E446 CarbonylContact C-O 3.58Å; Y431-E446 WeakPolarHBondContact CA-O 3.34Å; Y431-K447 HydrophobicContact CD1-CB 4.34Å; Y431-K447 HydrophobicContact CE1-CB 4.02Å; Y431-K447 HydrophobicContact CE1-CG 4.2Å; Y431-K447 HydrophobicContact CE2-CG 3.98Å; Y431-I458 HydrophobicContact CD1-CG2 4.22Å; Y431-I458 HydrophobicContact CE1-CG1 4.44Å; Y431-I458 HydrophobicContact CE1-CG2 3.95Å; Y431-L477 HydrophobicContact CD1-CD1 3.93Å; Y431-L477 HydrophobicContact CG-CD1 4.28Å; Y431-P497 HydrophobicContact CE1-CB 3.8Å; Y431-V711 VanDerWaalsContact O-CA 3.31Å; Y431-V711 WeakPolarHBondContact O-CA 3.2Å; Y431-V712 PolarHBondContact N-O 2.74Å; Y431-V712 PolarHBondContact O-N 2.71Å; Y431-V714 HydrophobicContact CD2-CB 3.95Å; Y431-V714 HydrophobicContact CD2-CG2 3.67Å; Y431-V714 HydrophobicContact CE2-CB 3.69Å; Y431-V714 HydrophobicContact CE2-CG2 3.84Å; Y431-V714 HydrophobicContact CG-CG2 4.32Å; Y431-L716 WeakPolarHBondContact OH-CD1 3.47Å
432	A	96.5	Very high	90.7	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	111.4	171.1	0	0	0	0	0	110	I445 E446 W455 V702 V711	A432-I445 WeakPolarHBondContact O-CA 3.38Å; A432-E446 PolarHBondContact N-O 2.91Å; A432-E446 PolarHBondContact O-N 3.39Å; A432-W455 HydrophobicContact CB-CE3 4.49Å; A432-W455 HydrophobicContact CB-CH2 3.97Å; A432-W455 HydrophobicContact CB-CZ3 3.57Å; A432-V702 HydrophobicContact CB-CG2 4.49Å; A432-V711 HydrophobicContact CB-CG2 4.04Å
433	V	96.4	Very high	90.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	113.5	-173.8	-173.7	0	0	0	0	109.8	I445 M461 F468 V470 L477 V479 C710	V433-I445 HydrophobicContact CG1-CD1 4.36Å; V433-I445 HydrophobicContact CG1-CG1 4.26Å; V433-I445 HydrophobicContact CG2-CG2 4.3Å; V433-M461 HydrophobicContact CG1-SD 3.98Å; V433-F468 HydrophobicContact CB-CE2 4.36Å; V433-F468 HydrophobicContact CG1-CE2 3.82Å; V433-F468 HydrophobicContact CG1-CZ 4.07Å; V433-F468 WeakPolarHBondContact O-CZ 3.32Å; V433-V470 HydrophobicContact CB-CG2 4.17Å; V433-V470 HydrophobicContact CG1-CG2 4.08Å; V433-V470 HydrophobicContact CG2-CG2 4.37Å; V433-L477 HydrophobicContact CG2-CD1 3.88Å; V433-V479 HydrophobicContact CG1-CG2 4.37Å; V433-C710 HydrophobicContact CB-CB 4.47Å; V433-C710 PolarHBondContact N-O 2.97Å; V433-C710 PolarHBondContact O-N 2.79Å; V433-C710 VanDerWaalsContact O-N 3.11Å
434	G	94.3	Very high	91.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	56	-148.9	172.4	0	0	0	0	0	114.5	T442 T444 R706 A709	G434-T442 VanDerWaalsContact C-CG2 3.41Å; G434-T442 VanDerWaalsContact CA-O 3.22Å; G434-T442 WeakPolarHBondContact CA-O 3.43Å; G434-T442 WeakPolarHBondContact O-CG2 3.14Å; G434-T444 PolarHBondContact N-O 3Å; G434-R706 PolarHBondContact O-NH1 3.01Å; G434-A709 WeakPolarHBondContact O-CB 3.29Å
435	G	92.3	Very high	91.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	122.1	-177.4	179.7	0	0	0	0	0	112.6	G441 T442 L466	G435-G441 CarbonylContact O-C 3.6Å; G435-G441 WeakPolarHBondContact O-CA 3.41Å; G435-T442 PolarHBondContact N-O 3.36Å; G435-T442 PolarHBondContact O-N 3.49Å; G435-L466 WeakPolarHBondContact O-CD2 3.33Å
436	M	91.6	Very high	91.5	Very high	55 Å²	55	25.6 Å²	25.6	27%	0.271	16%	0.164	S	C	.	.	B	Isolated β-bridge	trans	-95.4	129.6	169.9	-168.1	169.6	-70.9	0	0	110.1	L466 Y682 R706 A707	M436-L466 HydrophobicContact CB-CD2 4.05Å; M436-L466 HydrophobicContact CE-CD1 3.56Å; M436-L466 HydrophobicContact CE-CD2 4.16Å; M436-L466 HydrophobicContact CE-CG 4.46Å; M436-Y682 HydrophobicContact CB-CD1 4.48Å; M436-Y682 HydrophobicContact CB-CE1 3.98Å; M436-Y682 HydrophobicContact CG-CD1 4.46Å; M436-Y682 HydrophobicContact CG-CE1 3.63Å; M436-Y682 WeakPolarHBondContact O-CD1 3.41Å; M436-Y682 HydrophobicContact SD-CE1 4.02Å; M436-Y682 PolarHBondContact SD-OH 3.49Å; M436-Y682 VanDerWaalsContact SD-OH 3.41Å; M436-R706 CarbonylContact O-C 3.54Å; M436-R706 WeakPolarHBondContact O-CA 3.38Å; M436-A707 PolarHBondContact N-O 3.33Å; M436-A707 PolarHBondContact O-N 3.04Å
437	D	90.1	Very high	91.8	Very high	19 Å²	19	25.8 Å²	25.8	10%	0.102	16%	0.162	C	C	.	.			trans	-122.2	-173.8	177.3	64.1	-1.1	0	0	0	110.2	A439 K440 G441 T442 Y682 I704 G705	D437-A439 PolarHBondContact O-N 3.33Å; D437-A439 VanDerWaalsContact OD1-C 3.25Å; D437-A439 WeakPolarHBondContact OD1-CA 3.07Å; D437-A439 WeakPolarHBondContact OD1-CB 3.49Å; D437-A439 PolarHBondContact OD1-N 2.77Å; D437-K440 WeakPolarHBondContact O-CA 3.47Å; D437-K440 PolarHBondContact O-N 3.11Å; D437-K440 PolarHBondContact OD1-N 3.43Å; D437-G441 PolarHBondContact OD1-N 3.46Å; D437-T442 PolarHBondContact OD1-N 3.15Å; D437-T442 VanDerWaalsContact OD2-CB 3.3Å; D437-T442 WeakPolarHBondContact OD2-CB 3.41Å; D437-Y682 VanDerWaalsContact O-CE2 3.29Å; D437-Y682 WeakPolarHBondContact O-CE2 3.33Å; D437-I704 HydrophobicContact CB-CG2 4.11Å; D437-G705 WeakPolarHBondContact CB-O 3.48Å
438	A	85.7	Confident	92.1	Very high	93 Å²	93	25.6 Å²	25.6	77%	0.769	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-27.6	175	0	0	0	0	0	113.5	K440	A438-K440 PolarHBondContact O-N 3.01Å
439	A	84.2	Confident	92.1	Very high	83 Å²	83	26.3 Å²	26.3	69%	0.686	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	6.5	172.5	0	0	0	0	0	113.5	D437 G441	D437-A439 PolarHBondContact O-N 3.33Å; D437-A439 VanDerWaalsContact OD1-C 3.25Å; D437-A439 WeakPolarHBondContact OD1-CA 3.07Å; D437-A439 WeakPolarHBondContact OD1-CB 3.49Å; D437-A439 PolarHBondContact OD1-N 2.77Å; A439-G441 VanDerWaalsContact C-N 3.35Å
440	K	79.6	Confident	92	Very high	145 Å²	145	27.4 Å²	27.4	63%	0.63	17%	0.166	S	C	*	.	S	Bend	trans	70.6	18.2	179.1	-49.6	173.8	-177.4	172.8	0	114.8	D437 A438 R464	D437-K440 WeakPolarHBondContact O-CA 3.47Å; D437-K440 PolarHBondContact O-N 3.11Å; D437-K440 PolarHBondContact OD1-N 3.43Å; A438-K440 PolarHBondContact O-N 3.01Å; K440-R464 VanDerWaalsContact O-CZ 3.32Å; K440-R464 PolarHBondContact O-NE 3.22Å; K440-R464 PolarHBondContact O-NH2 3.18Å
441	G	83.5	Confident	91.7	Very high	13 Å²	13	29.5 Å²	29.5	13%	0.134	17%	0.174	C	C	.	.			trans	159	103.6	169.9	0	0	0	0	0	113.9	G435 D437 A439	G435-G441 CarbonylContact O-C 3.6Å; G435-G441 WeakPolarHBondContact O-CA 3.41Å; D437-G441 PolarHBondContact OD1-N 3.46Å; A439-G441 VanDerWaalsContact C-N 3.35Å
442	T	89.4	Confident	91.4	Very high	8 Å²	8	32 Å²	32	5%	0.049	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	136.9	173.7	-164	0	0	0	0	110.8	G434 G435 D437 T444	G434-T442 VanDerWaalsContact C-CG2 3.41Å; G434-T442 VanDerWaalsContact CA-O 3.22Å; G434-T442 WeakPolarHBondContact CA-O 3.43Å; G434-T442 WeakPolarHBondContact O-CG2 3.14Å; G435-T442 PolarHBondContact N-O 3.36Å; G435-T442 PolarHBondContact O-N 3.49Å; D437-T442 PolarHBondContact OD1-N 3.15Å; D437-T442 VanDerWaalsContact OD2-CB 3.3Å; D437-T442 WeakPolarHBondContact OD2-CB 3.41Å; T442-T444 PolarHBondContact OG1-N 2.95Å; T442-T444 PolarHBondContact OG1-OG1 3.23Å
443	T	93.3	Very high	91.1	Very high	39 Å²	39	35.4 Å²	35.4	24%	0.239	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	3.1	172.6	48.5	0	0	0	0	112.5	T460 M461 G463 R464	T443-T460 CarbonylContact O-C 3.6Å; T443-T460 WeakPolarHBondContact O-CA 3.38Å; T443-T460 VanDerWaalsContact OG1-CG2 3.3Å; T443-T460 WeakPolarHBondContact OG1-CG2 3.42Å; T443-M461 HydrophobicContact CG2-CB 4.46Å; T443-M461 WeakPolarHBondContact O-CG 3.35Å; T443-M461 PolarHBondContact O-N 2.87Å; T443-G463 WeakPolarHBondContact CG2-O 3.5Å; T443-R464 HydrophobicContact CG2-CB 4.35Å
444	T	94.8	Very high	91.1	Very high	20 Å²	20	38.4 Å²	38.4	12%	0.123	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	143.2	-174.9	57.8	0	0	0	0	112.9	G434 T442 I704 R706	G434-T444 PolarHBondContact N-O 3Å; T442-T444 PolarHBondContact OG1-N 2.95Å; T442-T444 PolarHBondContact OG1-OG1 3.23Å; T444-I704 HydrophobicContact CG2-CD1 3.67Å; T444-R706 PolarHBondContact O-NH1 3.13Å; T444-R706 PolarHBondContact OG1-NH2 3.1Å
445	I	95.7	Very high	91.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	119.9	164.1	-52.2	-175.4	0	0	0	107.5	Y431 A432 V433 H457 I458 G459 M461 L477 F495 W502	Y431-I445 HydrophobicContact CD1-CG2 3.94Å; A432-I445 WeakPolarHBondContact O-CA 3.38Å; V433-I445 HydrophobicContact CG1-CD1 4.36Å; V433-I445 HydrophobicContact CG1-CG1 4.26Å; V433-I445 HydrophobicContact CG2-CG2 4.3Å; I445-H457 PolarHBondContact O-CD2 3.3Å; I445-I458 HydrophobicContact CB-CG2 3.89Å; I445-I458 HydrophobicContact CG2-CG2 3.52Å; I445-I458 PolarHBondContact O-N 2.86Å; I445-G459 WeakPolarHBondContact CB-O 3.43Å; I445-G459 PolarHBondContact N-O 2.84Å; I445-M461 HydrophobicContact CD1-CG 4.45Å; I445-M461 HydrophobicContact CG1-CG 4.38Å; I445-L477 HydrophobicContact CD1-CD1 4.36Å; I445-L477 HydrophobicContact CG2-CD1 4.15Å; I445-F495 HydrophobicContact CD1-CD1 3.92Å; I445-F495 HydrophobicContact CD1-CE1 4.12Å; I445-F495 HydrophobicContact CD1-CG 4.22Å; I445-W502 HydrophobicContact CD1-CH2 4.05Å; I445-W502 HydrophobicContact CD1-CZ2 3.73Å
446	E	96	Very high	91.3	Very high	3 Å²	3	42.3 Å²	42.3	1%	0.014	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	137.1	174.4	-61.2	-173.8	-131.8	0	0	110	Y431 A432 W455 I456 V702 N703 I704 R706	Y431-E446 CarbonylContact C-O 3.58Å; Y431-E446 WeakPolarHBondContact CA-O 3.34Å; A432-E446 PolarHBondContact N-O 2.91Å; A432-E446 PolarHBondContact O-N 3.39Å; E446-W455 HydrophobicContact CB-CE3 3.74Å; E446-W455 HydrophobicContact CB-CZ3 4.32Å; E446-I456 CarbonylContact C-O 3.57Å; E446-I456 WeakPolarHBondContact CA-O 3.41Å; E446-V702 HydrophobicContact CB-CG2 4.36Å; E446-V702 VanDerWaalsContact CD-CG2 3.41Å; E446-V702 HydrophobicContact CG-CG2 4.41Å; E446-V702 WeakPolarHBondContact OE1-CG2 3.39Å; E446-V702 VanDerWaalsContact OE2-CG2 3.29Å; E446-V702 WeakPolarHBondContact OE2-CG2 3.49Å; E446-N703 VanDerWaalsContact OE2-CB 3.24Å; E446-N703 WeakPolarHBondContact OE2-CB 3.28Å; E446-N703 PolarHBondContact OE2-N 3.35Å; E446-N703 PolarHBondContact OE2-ND2 3.04Å; E446-I704 PolarHBondContact OE1-N 3.38Å; E446-I704 VanDerWaalsContact OE1-N 3.11Å; E446-R706 IonicContact OE1-CZ 2.89Å; E446-R706 IonicContact OE1-NH2 3.84Å; E446-R706 PolarHBondContact OE1-NH2 3.37Å
447	K	95.9	Very high	91.4	Very high	33 Å²	33	44.6 Å²	44.6	14%	0.143	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	123.1	174	178.9	-143.1	179.4	-164.9	0	108.6	A429 L430 Y431 D449 W455 I456 I458	A429-K447 HydrophobicContact CB-CD 4.12Å; A429-K447 HydrophobicContact CB-CG 3.8Å; L430-K447 CarbonylContact O-C 3.57Å; L430-K447 WeakPolarHBondContact O-CA 3.43Å; Y431-K447 HydrophobicContact CD1-CB 4.34Å; Y431-K447 HydrophobicContact CE1-CB 4.02Å; Y431-K447 HydrophobicContact CE1-CG 4.2Å; Y431-K447 HydrophobicContact CE2-CG 3.98Å; K447-D449 IonicContact NZ-OD2 2.97Å; K447-D449 PolarHBondContact NZ-OD2 2.8Å; K447-W455 CarbonylContact O-C 3.58Å; K447-W455 WeakPolarHBondContact O-CA 3.37Å; K447-I456 HydrophobicContact CB-CG1 4.01Å; K447-I456 HydrophobicContact CD-CD1 4Å; K447-I456 HydrophobicContact CD-CG1 4.14Å; K447-I456 PolarHBondContact N-O 3.31Å; K447-I456 PolarHBondContact O-N 3.42Å; K447-I458 HydrophobicContact CB-CB 4.39Å
448	Y	95.9	Very high	91.6	Very high	5 Å²	5	44.8 Å²	44.8	2%	0.02	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	133.6	163.1	173.7	-101	0	0	0	110.8	A429 L430 L450 N453 N454 W455 L667 Y672	A429-Y448 WeakPolarHBondContact CB-O 3.31Å; L430-Y448 HydrophobicContact CB-CD1 4.29Å; L430-Y448 HydrophobicContact CD2-CD1 4.39Å; L430-Y448 PolarHBondContact N-O 3.01Å; L430-Y448 VanDerWaalsContact N-O 3.1Å; L430-Y448 PolarHBondContact O-N 3.19Å; Y448-L450 HydrophobicContact CE1-CB 4.4Å; Y448-L450 HydrophobicContact CE1-CD1 3.97Å; Y448-N453 WeakPolarHBondContact CE2-OD1 3.31Å; Y448-N453 PolarHBondContact OH-OD1 2.54Å; Y448-N454 WeakPolarHBondContact CA-O 3.39Å; Y448-W455 AromaticContact CD2-CD1 3.92Å; Y448-W455 HydrophobicContact CD2-CD2 4.34Å; Y448-W455 HydrophobicContact CD2-CG 4.28Å; Y448-W455 AromaticContact CD2-NE1 3.77Å; Y448-W455 HydrophobicContact CG-CD2 4.4Å; Y448-W455 HydrophobicContact CG-CZ2 4.32Å; Y448-L667 HydrophobicContact CD1-CD2 4.06Å; Y448-L667 HydrophobicContact CE1-CD2 4.04Å; Y448-Y672 HydrophobicContact CE1-CE1 4.25Å
449	D	91.6	Very high	92	Very high	28 Å²	28	41 Å²	41	15%	0.15	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	120.7	179.2	-170.1	-49.6	0	0	0	109.7	K447 R451 T452 N453 N454	K447-D449 IonicContact NZ-OD2 2.97Å; K447-D449 PolarHBondContact NZ-OD2 2.8Å; D449-R451 VanDerWaalsContact C-N 3.28Å; D449-R451 PolarHBondContact O-N 3.23Å; D449-R451 WeakPolarHBondContact OD1-CB 3.41Å; D449-R451 PolarHBondContact OD1-N 3.45Å; D449-T452 WeakPolarHBondContact CB-OG1 3.33Å; D449-N453 WeakPolarHBondContact O-CA 3.44Å; D449-N453 PolarHBondContact O-N 3.27Å; D449-N454 PolarHBondContact N-O 3.48Å
450	L	91.4	Very high	92.4	Very high	29 Å²	29	40.1 Å²	40.1	15%	0.152	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-21.6	-172	-171	64.2	0	0	0	112.9	K424 V427 Y448 L667 Y672	K424-L450 HydrophobicContact CB-CB 4.29Å; K424-L450 HydrophobicContact CB-CD2 4.26Å; K424-L450 HydrophobicContact CB-CG 4.13Å; K424-L450 HydrophobicContact CD-CG 4.29Å; K424-L450 WeakPolarHBondContact CD-O 3.46Å; K424-L450 HydrophobicContact CG-CD2 4.2Å; K424-L450 HydrophobicContact CG-CG 4.12Å; V427-L450 HydrophobicContact CG2-CB 4.45Å; V427-L450 HydrophobicContact CG2-CD2 3.76Å; Y448-L450 HydrophobicContact CE1-CB 4.4Å; Y448-L450 HydrophobicContact CE1-CD1 3.97Å; L450-L667 HydrophobicContact CB-CD2 4.36Å; L450-L667 HydrophobicContact CD1-CD2 4.49Å; L450-L667 HydrophobicContact CD2-CD2 4.5Å; L450-Y672 WeakPolarHBondContact CD1-OH 3.2Å
451	R	90.5	Very high	93	Very high	44 Å²	44	33.7 Å²	33.7	17%	0.166	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-44.2	177.8	-177.5	-173.4	62.3	91.5	-0.2	111.3	E308 D335 K424 D449	E308-R451 VanDerWaalsContact CD-NH1 3.32Å; E308-R451 IonicContact OE1-CZ 2.68Å; E308-R451 IonicContact OE1-NH1 2.68Å; E308-R451 PolarHBondContact OE1-NH1 2.84Å; E308-R451 IonicContact OE1-NH2 3.71Å; E308-R451 PolarHBondContact OE1-NH2 3.47Å; E308-R451 IonicContact OE2-NH1 3.45Å; D335-R451 WeakPolarHBondContact O-CD 3.36Å; K424-R451 HydrophobicContact CB-CB 4.22Å; D449-R451 VanDerWaalsContact C-N 3.28Å; D449-R451 PolarHBondContact O-N 3.23Å; D449-R451 WeakPolarHBondContact OD1-CB 3.41Å; D449-R451 PolarHBondContact OD1-N 3.45Å
452	T	90.1	Very high	93.2	Very high	54 Å²	54	36.9 Å²	36.9	33%	0.331	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-8.6	179	50.2	0	0	0	0	113.6	D449 N454	D449-T452 WeakPolarHBondContact CB-OG1 3.33Å; T452-N454 VanDerWaalsContact C-N 3.33Å; T452-N454 WeakPolarHBondContact CB-OD1 3.37Å; T452-N454 PolarHBondContact O-N 2.77Å; T452-N454 PolarHBondContact OG1-OD1 2.87Å
453	N	91.8	Very high	93	Very high	73 Å²	73	38.3 Å²	38.3	39%	0.39	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	48.3	-179.8	-164.1	21	0	0	0	113.1	Y448 D449 V700	Y448-N453 WeakPolarHBondContact CE2-OD1 3.31Å; Y448-N453 PolarHBondContact OH-OD1 2.54Å; D449-N453 WeakPolarHBondContact O-CA 3.44Å; D449-N453 PolarHBondContact O-N 3.27Å; N453-V700 WeakPolarHBondContact OD1-CG2 3.42Å
454	N	94.5	Very high	92.8	Very high	63 Å²	63	40.7 Å²	40.7	34%	0.337	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	154.1	-179.2	66.3	-13.5	0	0	0	112.8	Y448 D449 T452	Y448-N454 WeakPolarHBondContact CA-O 3.39Å; D449-N454 PolarHBondContact N-O 3.48Å; T452-N454 VanDerWaalsContact C-N 3.33Å; T452-N454 WeakPolarHBondContact CB-OD1 3.37Å; T452-N454 PolarHBondContact O-N 2.77Å; T452-N454 PolarHBondContact OG1-OD1 2.87Å
455	W	96.2	Very high	92.7	Very high	14 Å²	14	40.6 Å²	40.6	5%	0.053	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	123.6	170.6	-70.8	90.8	0	0	0	110	L430 A432 E446 K447 Y448 V674 V686 V700 V702 N703	L430-W455 HydrophobicContact CD2-CH2 3.87Å; L430-W455 HydrophobicContact CD2-CZ2 4.2Å; L430-W455 HydrophobicContact CG-CH2 4.33Å; A432-W455 HydrophobicContact CB-CE3 4.49Å; A432-W455 HydrophobicContact CB-CH2 3.97Å; A432-W455 HydrophobicContact CB-CZ3 3.57Å; E446-W455 HydrophobicContact CB-CE3 3.74Å; E446-W455 HydrophobicContact CB-CZ3 4.32Å; K447-W455 CarbonylContact O-C 3.58Å; K447-W455 WeakPolarHBondContact O-CA 3.37Å; Y448-W455 AromaticContact CD2-CD1 3.92Å; Y448-W455 HydrophobicContact CD2-CD2 4.34Å; Y448-W455 HydrophobicContact CD2-CG 4.28Å; Y448-W455 AromaticContact CD2-NE1 3.77Å; Y448-W455 HydrophobicContact CG-CD2 4.4Å; Y448-W455 HydrophobicContact CG-CZ2 4.32Å; W455-V674 HydrophobicContact CH2-CG1 4.17Å; W455-V674 HydrophobicContact CH2-CG2 4.07Å; W455-V674 HydrophobicContact CZ2-CG1 4.23Å; W455-V674 HydrophobicContact CZ2-CG2 4.08Å; W455-V686 HydrophobicContact CZ2-CG2 3.9Å; W455-V700 PolarHBondContact NE1-O 3.13Å; W455-V702 HydrophobicContact CD2-CB 3.98Å; W455-V702 HydrophobicContact CD2-CG2 3.91Å; W455-V702 HydrophobicContact CE3-CB 4.44Å; W455-V702 HydrophobicContact CE3-CG2 3.92Å; W455-V702 HydrophobicContact CG-CB 4.35Å; W455-V702 HydrophobicContact CG-CG2 4.42Å; W455-V702 HydrophobicContact CZ2-CB 4.22Å; W455-V702 HydrophobicContact CZ3-CG2 4.27Å; W455-N703 VanDerWaalsContact CB-ND2 3.31Å; W455-N703 WeakPolarHBondContact CB-ND2 3.25Å; W455-N703 PolarHBondContact O-ND2 2.88Å
456	I	95.4	Very high	92.6	Very high	68 Å²	68	41 Å²	41	35%	0.349	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.8	176	65.9	174.6	0	0	0	111	E446 K447 I458	E446-I456 CarbonylContact C-O 3.57Å; E446-I456 WeakPolarHBondContact CA-O 3.41Å; K447-I456 HydrophobicContact CB-CG1 4.01Å; K447-I456 HydrophobicContact CD-CD1 4Å; K447-I456 HydrophobicContact CD-CG1 4.14Å; K447-I456 PolarHBondContact N-O 3.31Å; K447-I456 PolarHBondContact O-N 3.42Å; I456-I458 PolarHBondContact O-N 2.84Å
457	H	94.9	Very high	92.6	Very high	103 Å²	103	43.7 Å²	43.7	48%	0.477	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	125	171.2	179.5	-111.3	0	0	0	109.9	I445 G459 T460	I445-H457 PolarHBondContact O-CD2 3.3Å; H457-G459 PolarHBondContact CD2-O 3.28Å; H457-G459 PolarHBondContact NE2-O 3.26Å; H457-T460 PolarHBondContact CE1-OG1 3.12Å; H457-T460 PolarHBondContact NE2-OG1 3.39Å
458	I	94	Very high	92.6	Very high	23 Å²	23	42.5 Å²	42.5	12%	0.118	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-24.5	-174.5	-156.3	67.6	0	0	0	113	Y431 I445 K447 I456 F495 K500	Y431-I458 HydrophobicContact CD1-CG2 4.22Å; Y431-I458 HydrophobicContact CE1-CG1 4.44Å; Y431-I458 HydrophobicContact CE1-CG2 3.95Å; I445-I458 HydrophobicContact CB-CG2 3.89Å; I445-I458 HydrophobicContact CG2-CG2 3.52Å; I445-I458 PolarHBondContact O-N 2.86Å; K447-I458 HydrophobicContact CB-CB 4.39Å; I456-I458 PolarHBondContact O-N 2.84Å; I458-F495 HydrophobicContact CG2-CE1 4.28Å; I458-K500 WeakPolarHBondContact O-CD 3.23Å; I458-K500 WeakPolarHBondContact O-CE 3.35Å
459	G	92.4	Very high	92.6	Very high	13 Å²	13	42.4 Å²	42.4	13%	0.134	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.3	177.8	-177.8	0	0	0	0	0	112.9	I445 H457	I445-G459 WeakPolarHBondContact CB-O 3.43Å; I445-G459 PolarHBondContact N-O 2.84Å; H457-G459 PolarHBondContact CD2-O 3.28Å; H457-G459 PolarHBondContact NE2-O 3.26Å
460	T	94.1	Very high	92.9	Very high	64 Å²	64	41.6 Å²	41.6	39%	0.393	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	142.9	-176.1	-56.9	0	0	0	0	109.5	T443 H457 W502	T443-T460 CarbonylContact O-C 3.6Å; T443-T460 WeakPolarHBondContact O-CA 3.38Å; T443-T460 VanDerWaalsContact OG1-CG2 3.3Å; T443-T460 WeakPolarHBondContact OG1-CG2 3.42Å; H457-T460 PolarHBondContact CE1-OG1 3.12Å; H457-T460 PolarHBondContact NE2-OG1 3.39Å; T460-W502 PolarHBondContact O-NE1 2.97Å
461	M	92.4	Very high	93.1	Very high	10 Å²	10	40.3 Å²	40.3	5%	0.049	22%	0.221	C	C	.	.			trans	-69.3	147.7	177.9	-62.1	174.6	62.1	0	0	112.3	V433 T443 I445 G463 R465 F468 V479 W502	V433-M461 HydrophobicContact CG1-SD 3.98Å; T443-M461 HydrophobicContact CG2-CB 4.46Å; T443-M461 WeakPolarHBondContact O-CG 3.35Å; T443-M461 PolarHBondContact O-N 2.87Å; I445-M461 HydrophobicContact CD1-CG 4.45Å; I445-M461 HydrophobicContact CG1-CG 4.38Å; M461-G463 PolarHBondContact O-N 2.73Å; M461-R465 HydrophobicContact CE-CB 3.8Å; M461-F468 HydrophobicContact CE-CE1 4.17Å; M461-F468 HydrophobicContact CE-CE2 4.48Å; M461-F468 HydrophobicContact CE-CZ 4.07Å; M461-F468 HydrophobicContact SD-CE1 4.47Å; M461-F468 HydrophobicContact SD-CZ 4.05Å; M461-V479 HydrophobicContact CE-CG1 3.82Å; M461-W502 HydrophobicContact CB-CH2 4.41Å; M461-W502 HydrophobicContact CB-CZ2 4.15Å; M461-W502 HydrophobicContact CG-CH2 3.94Å; M461-W502 HydrophobicContact CG-CZ2 3.91Å
462	S	86.2	Confident	93.3	Very high	80 Å²	80	39.8 Å²	39.8	56%	0.559	22%	0.223	S	C	*	.	S	Bend	trans	-55.8	-20.1	-179.7	-40.8	0	0	0	0	114.9	E493	S462-E493 WeakPolarHBondContact CB-OE1 3.39Å; S462-E493 PolarHBondContact OG-OE1 2.77Å
463	G	86.2	Confident	93.3	Very high	39 Å²	39	38.6 Å²	38.6	40%	0.402	22%	0.215	S	C	.	.	S	Bend	trans	-171.5	171.1	177.6	0	0	0	0	0	111.3	T443 M461 R465	T443-G463 WeakPolarHBondContact CG2-O 3.5Å; M461-G463 PolarHBondContact O-N 2.73Å; G463-R465 PolarHBondContact O-N 3.45Å
464	R	88.6	Confident	93.2	Very high	88 Å²	88	40.9 Å²	40.9	33%	0.332	23%	0.227	S	C	.	.			trans	-66.8	129.9	177.3	-179.1	167.3	162.9	-89.2	8.9	110.2	K440 T443 D484	K440-R464 VanDerWaalsContact O-CZ 3.32Å; K440-R464 PolarHBondContact O-NE 3.22Å; K440-R464 PolarHBondContact O-NH2 3.18Å; T443-R464 HydrophobicContact CG2-CB 4.35Å; R464-D484 IonicContact NH1-OD1 3.21Å; R464-D484 PolarHBondContact NH1-OD1 2.69Å; R464-D484 WeakPolarHBondContact O-CB 3.33Å; R464-D484 VanDerWaalsContact O-CG 3.32Å
465	R	93.8	Very high	93.1	Very high	19 Å²	19	40.6 Å²	40.6	7%	0.072	23%	0.226	C	C	.	.			trans	-145.6	140.4	179.2	-169.4	178	-81.8	166.6	9.9	109.2	M461 G463 F468 G481 R483 L489 T491 E493	M461-R465 HydrophobicContact CE-CB 3.8Å; G463-R465 PolarHBondContact O-N 3.45Å; R465-F468 HydrophobicContact CB-CD1 4.03Å; R465-F468 HydrophobicContact CB-CE1 4.34Å; R465-F468 HydrophobicContact CG-CB 4.03Å; R465-F468 HydrophobicContact CG-CD1 3.63Å; R465-F468 HydrophobicContact CG-CE1 4.42Å; R465-F468 HydrophobicContact CG-CG 4.09Å; R465-F468 WeakPolarHBondContact O-CE1 3.31Å; R465-G481 WeakPolarHBondContact CD-O 3.38Å; R465-G481 PolarHBondContact NE-O 2.67Å; R465-R483 CarbonylContact C-O 3.51Å; R465-R483 WeakPolarHBondContact CA-O 3.39Å; R465-L489 HydrophobicContact CG-CD1 4.17Å; R465-T491 PolarHBondContact NH2-OG1 2.92Å; R465-E493 IonicContact CZ-OE2 3.1Å; R465-E493 IonicContact NH1-OE2 3.76Å; R465-E493 PolarHBondContact NH1-OE2 2.94Å; R465-E493 IonicContact NH2-OE2 2.64Å; R465-E493 PolarHBondContact NH2-OE2 2.98Å
466	L	93.8	Very high	93	Very high	9 Å²	9	42.9 Å²	42.9	5%	0.047	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-132.7	149.7	-178.5	-64.8	171	0	0	0	110.1	G435 M436 F468 G482 R483	G435-L466 WeakPolarHBondContact O-CD2 3.33Å; M436-L466 HydrophobicContact CB-CD2 4.05Å; M436-L466 HydrophobicContact CE-CD1 3.56Å; M436-L466 HydrophobicContact CE-CD2 4.16Å; M436-L466 HydrophobicContact CE-CG 4.46Å; L466-F468 PolarHBondContact O-N 3.44Å; L466-F468 VanDerWaalsContact O-N 3.17Å; L466-G482 CarbonylContact O-C 3.54Å; L466-G482 VanDerWaalsContact O-CA 3.31Å; L466-G482 WeakPolarHBondContact O-CA 3.32Å; L466-R483 HydrophobicContact CB-CG 4.23Å; L466-R483 PolarHBondContact N-O 3.21Å; L466-R483 PolarHBondContact O-N 3Å
467	Q	94.1	Very high	93	Very high	58 Å²	58	39.7 Å²	39.7	27%	0.271	22%	0.22	S	C	.	.	S	Bend	trans	53	36.5	176.1	-55.3	-179.7	-46.1	0	0	113.4	G482 R483 H513 G514	Q467-G482 WeakPolarHBondContact O-CA 3.39Å; Q467-R483 VanDerWaalsContact OE1-NH1 3.17Å; Q467-H513 PolarHBondContact OE1-CD2 2.82Å; Q467-G514 PolarHBondContact O-N 2.98Å
468	F	96.5	Very high	93.1	Very high	8 Å²	8	35.8 Å²	35.8	4%	0.035	20%	0.201	C	C	.	.			trans	-83.7	170.8	167.8	55.1	-85.2	0	0	0	109.9	V433 M461 R465 L466 V470 V479 V480 C710	V433-F468 HydrophobicContact CB-CE2 4.36Å; V433-F468 HydrophobicContact CG1-CE2 3.82Å; V433-F468 HydrophobicContact CG1-CZ 4.07Å; V433-F468 WeakPolarHBondContact O-CZ 3.32Å; M461-F468 HydrophobicContact CE-CE1 4.17Å; M461-F468 HydrophobicContact CE-CE2 4.48Å; M461-F468 HydrophobicContact CE-CZ 4.07Å; M461-F468 HydrophobicContact SD-CE1 4.47Å; M461-F468 HydrophobicContact SD-CZ 4.05Å; R465-F468 HydrophobicContact CB-CD1 4.03Å; R465-F468 HydrophobicContact CB-CE1 4.34Å; R465-F468 HydrophobicContact CG-CB 4.03Å; R465-F468 HydrophobicContact CG-CD1 3.63Å; R465-F468 HydrophobicContact CG-CE1 4.42Å; R465-F468 HydrophobicContact CG-CG 4.09Å; R465-F468 WeakPolarHBondContact O-CE1 3.31Å; L466-F468 PolarHBondContact O-N 3.44Å; L466-F468 VanDerWaalsContact O-N 3.17Å; F468-V470 HydrophobicContact CD2-CG2 3.78Å; F468-V470 HydrophobicContact CE2-CG2 3.61Å; F468-V479 HydrophobicContact CB-CG1 4.27Å; F468-V479 HydrophobicContact CD2-CG1 3.52Å; F468-V479 HydrophobicContact CE2-CG1 3.97Å; F468-V479 HydrophobicContact CG-CG1 3.96Å; F468-V480 WeakPolarHBondContact CB-O 3.26Å; F468-C710 HydrophobicContact CE2-CB 4.15Å; F468-C710 PolarHBondContact O-SG 3.4Å
469	G	96.6	Very high	93.2	Very high	4 Å²	4	34.7 Å²	34.7	4%	0.041	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	158.5	164.3	0	0	0	0	0	111.3	V480	G469-V480 PolarHBondContact N-O 2.88Å; G469-V480 VanDerWaalsContact N-O 3.1Å; G469-V480 PolarHBondContact O-N 2.63Å
470	V	96.8	Very high	93.5	Very high	10 Å²	10	34 Å²	34	6%	0.061	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	134.3	170.9	178.9	0	0	0	0	110.3	V433 F468 L477 Y478 V479 C710 V712	V433-V470 HydrophobicContact CB-CG2 4.17Å; V433-V470 HydrophobicContact CG1-CG2 4.08Å; V433-V470 HydrophobicContact CG2-CG2 4.37Å; F468-V470 HydrophobicContact CD2-CG2 3.78Å; F468-V470 HydrophobicContact CE2-CG2 3.61Å; V470-L477 HydrophobicContact CG1-CB 4.32Å; V470-Y478 VanDerWaalsContact CA-O 3.27Å; V470-Y478 WeakPolarHBondContact CA-O 3.26Å; V470-V479 HydrophobicContact CG2-CG2 4.27Å; V470-C710 HydrophobicContact CB-CB 3.68Å; V470-C710 HydrophobicContact CG2-CB 3.43Å; V470-C710 VanDerWaalsContact CG2-CB 3.43Å; V470-V712 HydrophobicContact CB-CG1 4.29Å; V470-V712 HydrophobicContact CG1-CG1 4.07Å; V470-V712 HydrophobicContact CG1-CG2 4Å
471	A	95.7	Very high	93.6	Very high	3 Å²	3	31 Å²	31	3%	0.025	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	160.5	165.4	0	0	0	0	0	110.9	Y478 V517 T519 M524	A471-Y478 PolarHBondContact N-O 2.86Å; A471-Y478 PolarHBondContact O-N 2.88Å; A471-V517 HydrophobicContact CB-CG1 3.89Å; A471-T519 HydrophobicContact CB-CG2 4.13Å; A471-M524 HydrophobicContact CB-CG 3.79Å; A471-M524 HydrophobicContact CB-SD 3.65Å
472	V	94.5	Very high	93.8	Very high	33 Å²	33	30.5 Å²	30.5	20%	0.2	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	122.8	168.6	-177.5	0	0	0	0	108.6	K476 L477 V712 V714	V472-K476 WeakPolarHBondContact CA-O 3.34Å; V472-L477 HydrophobicContact CG2-CD2 4.01Å; V472-V712 HydrophobicContact CG2-CB 3.67Å; V472-V712 HydrophobicContact CG2-CG1 4.33Å; V472-V712 HydrophobicContact CG2-CG2 3.56Å; V472-V714 HydrophobicContact CG1-CG2 4.1Å; V472-V714 HydrophobicContact CG2-CG2 4.01Å
473	V	91.7	Very high	94.2	Very high	28 Å²	28	30.1 Å²	30.1	17%	0.17	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	134.6	173.3	-177.3	0	0	0	0	106.9	N475 K476 Y478 T519 M524	V473-N475 PolarHBondContact O-N 2.79Å; V473-N475 VanDerWaalsContact O-N 3.12Å; V473-K476 PolarHBondContact N-O 2.7Å; V473-K476 PolarHBondContact O-N 3.23Å; V473-Y478 HydrophobicContact CB-CD2 3.97Å; V473-Y478 HydrophobicContact CB-CE2 3.71Å; V473-Y478 HydrophobicContact CG2-CD2 4.3Å; V473-Y478 HydrophobicContact CG2-CE2 4.44Å; V473-T519 HydrophobicContact CG2-CG2 3.68Å; V473-M524 HydrophobicContact CG2-CG 3.64Å; V473-M524 HydrophobicContact CG2-SD 3.89Å
474	D	89.3	Confident	94.4	Very high	122 Å²	122	31.8 Å²	31.8	65%	0.652	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	46	43.3	-178.4	-52.3	-22.3	0	0	0	113.9	K476	D474-K476 PolarHBondContact O-N 2.81Å; D474-K476 VanDerWaalsContact O-N 3.16Å
475	N	91.4	Very high	94.3	Very high	56 Å²	56	29.4 Å²	29.4	30%	0.299	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	21.2	-176.3	-70.3	-31.9	0	0	0	116.3	V473 P497 V714 K715 L716	V473-N475 PolarHBondContact O-N 2.79Å; V473-N475 VanDerWaalsContact O-N 3.12Å; N475-P497 WeakPolarHBondContact O-CD 3.33Å; N475-P497 WeakPolarHBondContact O-CG 3.41Å; N475-V714 HydrophobicContact CB-CG1 3.8Å; N475-V714 WeakPolarHBondContact O-CG1 3.38Å; N475-K715 PolarHBondContact ND2-O 2.83Å; N475-K715 PolarHBondContact OD1-N 3.47Å; N475-K715 PolarHBondContact OD1-O 2.85Å; N475-L716 HydrophobicContact CB-CD2 4.22Å
476	K	94	Very high	94	Very high	63 Å²	63	37.2 Å²	37.2	27%	0.274	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	151.4	175.3	-59.8	148.9	-161.9	156.4	0	110.6	V472 V473 D474 Y478 F495 N496	V472-K476 WeakPolarHBondContact CA-O 3.34Å; V473-K476 PolarHBondContact N-O 2.7Å; V473-K476 PolarHBondContact O-N 3.23Å; D474-K476 PolarHBondContact O-N 2.81Å; D474-K476 VanDerWaalsContact O-N 3.16Å; K476-Y478 HydrophobicContact CB-CD2 4.46Å; K476-Y478 HydrophobicContact CB-CE2 3.95Å; K476-F495 WeakPolarHBondContact CA-O 3.36Å; K476-F495 WeakPolarHBondContact CB-O 3.4Å; K476-N496 HydrophobicContact CG-CB 4.26Å
477	L	96.4	Very high	93.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	116.9	179.3	-52.1	-177	0	0	0	109.8	Y431 V433 I445 V470 V472 C494 F495 V712 V714	Y431-L477 HydrophobicContact CD1-CD1 3.93Å; Y431-L477 HydrophobicContact CG-CD1 4.28Å; V433-L477 HydrophobicContact CG2-CD1 3.88Å; I445-L477 HydrophobicContact CD1-CD1 4.36Å; I445-L477 HydrophobicContact CG2-CD1 4.15Å; V470-L477 HydrophobicContact CG1-CB 4.32Å; V472-L477 HydrophobicContact CG2-CD2 4.01Å; L477-C494 CarbonylContact O-C 3.44Å; L477-C494 WeakPolarHBondContact O-CA 3.25Å; L477-F495 HydrophobicContact CB-CB 4.33Å; L477-F495 HydrophobicContact CD1-CD1 4.02Å; L477-F495 HydrophobicContact CG-CD1 4.4Å; L477-F495 PolarHBondContact N-O 3.26Å; L477-F495 PolarHBondContact O-N 2.87Å; L477-V712 HydrophobicContact CD2-CG2 3.66Å; L477-V714 HydrophobicContact CD2-CG2 3.47Å; L477-V714 VanDerWaalsContact CD2-CG2 3.47Å
478	Y	96.3	Very high	94.1	Very high	21 Å²	21	41.3 Å²	41.3	8%	0.082	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	106	176.7	-76.4	-100.4	0	0	0	110	V470 A471 V473 K476 V492 E493 C494 M505 M524	V470-Y478 VanDerWaalsContact CA-O 3.27Å; V470-Y478 WeakPolarHBondContact CA-O 3.26Å; A471-Y478 PolarHBondContact N-O 2.86Å; A471-Y478 PolarHBondContact O-N 2.88Å; V473-Y478 HydrophobicContact CB-CD2 3.97Å; V473-Y478 HydrophobicContact CB-CE2 3.71Å; V473-Y478 HydrophobicContact CG2-CD2 4.3Å; V473-Y478 HydrophobicContact CG2-CE2 4.44Å; K476-Y478 HydrophobicContact CB-CD2 4.46Å; K476-Y478 HydrophobicContact CB-CE2 3.95Å; Y478-V492 HydrophobicContact CD1-CG1 4.38Å; Y478-E493 CarbonylContact C-O 3.59Å; Y478-E493 WeakPolarHBondContact CA-O 3.32Å; Y478-C494 HydrophobicContact CD1-CB 4.01Å; Y478-C494 HydrophobicContact CE1-CB 3.74Å; Y478-C494 HydrophobicContact CE2-CB 4.48Å; Y478-M505 HydrophobicContact CD1-CG 4.18Å; Y478-M505 HydrophobicContact CE1-CE 4.05Å; Y478-M505 HydrophobicContact CE1-CG 3.85Å; Y478-M505 HydrophobicContact CE1-SD 4.03Å; Y478-M524 VanDerWaalsContact CB-SD 3.54Å; Y478-M524 HydrophobicContact CD1-CE 3.68Å; Y478-M524 HydrophobicContact CD1-SD 4.06Å; Y478-M524 HydrophobicContact CD2-SD 4.36Å; Y478-M524 HydrophobicContact CE1-CE 4.19Å; Y478-M524 HydrophobicContact CG-CE 4Å; Y478-M524 HydrophobicContact CG-SD 3.74Å
479	V	97.3	Very high	94.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	113.4	178.3	-172.1	0	0	0	0	109.3	V433 M461 F468 V470 V492 E493 W502	V433-V479 HydrophobicContact CG1-CG2 4.37Å; M461-V479 HydrophobicContact CE-CG1 3.82Å; F468-V479 HydrophobicContact CB-CG1 4.27Å; F468-V479 HydrophobicContact CD2-CG1 3.52Å; F468-V479 HydrophobicContact CE2-CG1 3.97Å; F468-V479 HydrophobicContact CG-CG1 3.96Å; V470-V479 HydrophobicContact CG2-CG2 4.27Å; V479-V492 WeakPolarHBondContact O-CA 3.48Å; V479-E493 PolarHBondContact N-O 2.86Å; V479-E493 PolarHBondContact O-N 2.95Å; V479-W502 HydrophobicContact CG2-CH2 3.85Å; V479-W502 HydrophobicContact CG2-CZ3 3.84Å
480	V	97.8	Very high	94.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	124.1	-168.9	-178.8	0	0	0	0	110.9	F468 G469 V492 M508 L515 V517 A526 W549	F468-V480 WeakPolarHBondContact CB-O 3.26Å; G469-V480 PolarHBondContact N-O 2.88Å; G469-V480 VanDerWaalsContact N-O 3.1Å; G469-V480 PolarHBondContact O-N 2.63Å; V480-V492 HydrophobicContact CG1-CG2 4.14Å; V480-V492 HydrophobicContact CG2-CG1 4.04Å; V480-V492 HydrophobicContact CG2-CG2 4.44Å; V480-M508 HydrophobicContact CG1-CE 3.75Å; V480-M508 HydrophobicContact CG1-CG 4.37Å; V480-M508 HydrophobicContact CG1-SD 3.45Å; V480-M508 WeakPolarHBondContact CG1-SD 3.43Å; V480-L515 HydrophobicContact CG1-CD1 3.97Å; V480-V517 HydrophobicContact CB-CG2 4.09Å; V480-V517 HydrophobicContact CG1-CG2 4.22Å; V480-V517 HydrophobicContact CG2-CG1 4.27Å; V480-A526 HydrophobicContact CG1-CB 4.33Å; V480-W549 HydrophobicContact CG1-CH2 4.19Å; V480-W549 HydrophobicContact CG1-CZ2 4.33Å; V480-W549 HydrophobicContact CG2-CH2 4.42Å; V480-W549 HydrophobicContact CG2-CZ2 4.47Å
481	G	97.1	Very high	94.1	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.			trans	66.6	-129.5	171.1	0	0	0	0	0	114	R465 L489 T491	R465-G481 WeakPolarHBondContact CD-O 3.38Å; R465-G481 PolarHBondContact NE-O 2.67Å; G481-L489 WeakPolarHBondContact CA-O 3.26Å; G481-T491 PolarHBondContact N-O 3.21Å
482	G	96.2	Very high	94.2	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.236	C	C	.	.			trans	82.5	-164.3	-174.5	0	0	0	0	0	113.7	L466 Q467 L489 R512	L466-G482 CarbonylContact O-C 3.54Å; L466-G482 VanDerWaalsContact O-CA 3.31Å; L466-G482 WeakPolarHBondContact O-CA 3.32Å; Q467-G482 WeakPolarHBondContact O-CA 3.39Å; G482-L489 WeakPolarHBondContact O-CB 3.4Å; G482-L489 PolarHBondContact O-N 2.8Å; G482-R512 PolarHBondContact N-O 2.83Å
483	R	94	Very high	94.3	Very high	72 Å²	72	44.5 Å²	44.5	27%	0.272	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	149.6	174.5	64.5	-178.5	-172.9	-164.5	5.1	111.8	R465 L466 Q467 K487 H513	R465-R483 CarbonylContact C-O 3.51Å; R465-R483 WeakPolarHBondContact CA-O 3.39Å; L466-R483 HydrophobicContact CB-CG 4.23Å; L466-R483 PolarHBondContact N-O 3.21Å; L466-R483 PolarHBondContact O-N 3Å; Q467-R483 VanDerWaalsContact OE1-NH1 3.17Å; R483-K487 CarbonylContact C-O 3.54Å; R483-K487 WeakPolarHBondContact CA-O 3.26Å; R483-K487 WeakPolarHBondContact CB-O 3.47Å; R483-H513 HydrophobicContact CB-CB 3.92Å; R483-H513 HydrophobicContact CG-CB 4.17Å; R483-H513 PolarHBondContact NH1-NE2 2.89Å
484	D	91.4	Very high	94.5	Very high	74 Å²	74	43.3 Å²	43.3	40%	0.396	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	121.3	160.6	-176.1	22.9	0	0	0	109.7	R464 L486 K487	R464-D484 IonicContact NH1-OD1 3.21Å; R464-D484 PolarHBondContact NH1-OD1 2.69Å; R464-D484 WeakPolarHBondContact O-CB 3.33Å; R464-D484 VanDerWaalsContact O-CG 3.32Å; D484-L486 PolarHBondContact O-N 2.81Å; D484-K487 PolarHBondContact N-O 2.82Å; D484-K487 WeakPolarHBondContact O-CB 3.42Å; D484-K487 PolarHBondContact O-N 3.36Å
485	G	86.8	Confident	94.8	Very high	38 Å²	38	37.5 Å²	37.5	39%	0.392	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	-113.7	-170.4	0	0	0	0	0	111.8
486	L	86.3	Confident	95	Very high	182 Å²	182	36.8 Å²	36.8	95%	0.953	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-11	176.6	-60.5	177.1	0	0	0	113.7	D484 T488	D484-L486 PolarHBondContact O-N 2.81Å; L486-T488 PolarHBondContact O-N 2.59Å
487	K	93.1	Very high	94.9	Very high	143 Å²	143	34 Å²	34	62%	0.622	18%	0.178	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	108.5	-176.2	-177.7	-176.6	177.5	-174.3	0	110.4	R483 D484 L489	R483-K487 CarbonylContact C-O 3.54Å; R483-K487 WeakPolarHBondContact CA-O 3.26Å; R483-K487 WeakPolarHBondContact CB-O 3.47Å; D484-K487 PolarHBondContact N-O 2.82Å; D484-K487 WeakPolarHBondContact O-CB 3.42Å; D484-K487 PolarHBondContact O-N 3.36Å; K487-L489 HydrophobicContact CD-CD2 4.08Å; K487-L489 HydrophobicContact CG-CD2 4.13Å
488	T	96.4	Very high	94.7	Very high	11 Å²	11	39 Å²	39	7%	0.067	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	146.8	163.1	-46.4	0	0	0	0	110.1	L486 H511 R512 H513 D531	L486-T488 PolarHBondContact O-N 2.59Å; T488-H511 HydrophobicContact CG2-CB 3.81Å; T488-H511 PolarHBondContact O-CD2 2.9Å; T488-R512 VanDerWaalsContact CG2-N 3.32Å; T488-H513 HydrophobicContact CG2-CB 4.06Å; T488-H513 PolarHBondContact OG1-ND1 2.85Å; T488-D531 WeakPolarHBondContact CB-O 3.3Å; T488-D531 WeakPolarHBondContact CG2-O 3.26Å; T488-D531 PolarHBondContact OG1-O 3.48Å
489	L	97.1	Very high	94.5	Very high	18 Å²	18	41.6 Å²	41.6	9%	0.094	23%	0.227	C	C	.	.			trans	-117.2	146.1	-178.9	-55.6	175.9	0	0	0	111	R465 G481 G482 K487 R512	R465-L489 HydrophobicContact CG-CD1 4.17Å; G481-L489 WeakPolarHBondContact CA-O 3.26Å; G482-L489 WeakPolarHBondContact O-CB 3.4Å; G482-L489 PolarHBondContact O-N 2.8Å; K487-L489 HydrophobicContact CD-CD2 4.08Å; K487-L489 HydrophobicContact CG-CD2 4.13Å; L489-R512 PolarHBondContact O-N 3.19Å
490	N	97.3	Very high	94.3	Very high	33 Å²	33	47.4 Å²	47.4	18%	0.176	25%	0.252	C	S	.	.			trans	-105.7	-4.7	164	68.6	-24.6	0	0	0	112.6	P507 M508 T510 H511	N490-P507 WeakPolarHBondContact O-CA 3.28Å; N490-P507 WeakPolarHBondContact O-CB 3.31Å; N490-M508 HydrophobicContact CB-CB 4.26Å; N490-M508 WeakPolarHBondContact CB-O 3.44Å; N490-M508 PolarHBondContact ND2-O 3.04Å; N490-M508 PolarHBondContact O-N 2.78Å; N490-T510 WeakPolarHBondContact CB-O 3.38Å; N490-H511 HydrophobicContact CB-CB 4.39Å; N490-H511 PolarHBondContact N-CD2 2.71Å
491	T	97.3	Very high	94.1	Very high	49 Å²	49	50.9 Å²	50.9	30%	0.301	27%	0.273	S	S	.	.			trans	-65.2	146.9	-174.9	50.9	0	0	0	0	112.6	R465 G481	R465-T491 PolarHBondContact NH2-OG1 2.92Å; G481-T491 PolarHBondContact N-O 3.21Å
492	V	97	Very high	94.1	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.006	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135.2	174.8	-176.2	0	0	0	0	108.9	Y478 V479 V480 M505 M508 W549	Y478-V492 HydrophobicContact CD1-CG1 4.38Å; V479-V492 WeakPolarHBondContact O-CA 3.48Å; V480-V492 HydrophobicContact CG1-CG2 4.14Å; V480-V492 HydrophobicContact CG2-CG1 4.04Å; V480-V492 HydrophobicContact CG2-CG2 4.44Å; V492-M505 HydrophobicContact CB-CB 3.96Å; V492-M505 HydrophobicContact CG1-CB 3.87Å; V492-M505 HydrophobicContact CG1-CG 4.35Å; V492-M505 PolarHBondContact O-N 3.01Å; V492-M508 HydrophobicContact CG2-CG 4.35Å; V492-W549 HydrophobicContact CG2-CZ2 3.86Å
493	E	96.2	Very high	94	Very high	23 Å²	23	58.8 Å²	58.8	11%	0.107	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	137.4	178.6	-73.3	173.8	104.5	0	0	110.6	S462 R465 Y478 V479 W502 L503	S462-E493 WeakPolarHBondContact CB-OE1 3.39Å; S462-E493 PolarHBondContact OG-OE1 2.77Å; R465-E493 IonicContact CZ-OE2 3.1Å; R465-E493 IonicContact NH1-OE2 3.76Å; R465-E493 PolarHBondContact NH1-OE2 2.94Å; R465-E493 IonicContact NH2-OE2 2.64Å; R465-E493 PolarHBondContact NH2-OE2 2.98Å; Y478-E493 CarbonylContact C-O 3.59Å; Y478-E493 WeakPolarHBondContact CA-O 3.32Å; V479-E493 PolarHBondContact N-O 2.86Å; V479-E493 PolarHBondContact O-N 2.95Å; E493-W502 HydrophobicContact CB-CE3 3.83Å; E493-W502 HydrophobicContact CB-CZ3 3.85Å; E493-L503 WeakPolarHBondContact CA-O 3.48Å
494	C	95.4	Very high	94.1	Very high	3 Å²	3	61.1 Å²	61.1	2%	0.02	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	120.1	179.1	170.2	0	0	0	0	109.7	L477 Y478 W502 L503 M505	L477-C494 CarbonylContact O-C 3.44Å; L477-C494 WeakPolarHBondContact O-CA 3.25Å; Y478-C494 HydrophobicContact CD1-CB 4.01Å; Y478-C494 HydrophobicContact CE1-CB 3.74Å; Y478-C494 HydrophobicContact CE2-CB 4.48Å; C494-W502 CarbonylContact O-C 3.6Å; C494-W502 WeakPolarHBondContact O-CA 3.28Å; C494-L503 HydrophobicContact CB-CB 4.38Å; C494-L503 PolarHBondContact N-O 2.61Å; C494-L503 PolarHBondContact O-N 3Å; C494-M505 HydrophobicContact CB-CG 3.75Å; C494-M505 HydrophobicContact CB-SD 4.04Å
495	F	96.3	Very high	94.3	Very high	1 Å²	1	59.4 Å²	59.4	0%	0.004	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	126.1	170.9	178	-109.8	0	0	0	110.5	I445 I458 K476 L477 P497 K500 W502	I445-F495 HydrophobicContact CD1-CD1 3.92Å; I445-F495 HydrophobicContact CD1-CE1 4.12Å; I445-F495 HydrophobicContact CD1-CG 4.22Å; I458-F495 HydrophobicContact CG2-CE1 4.28Å; K476-F495 WeakPolarHBondContact CA-O 3.36Å; K476-F495 WeakPolarHBondContact CB-O 3.4Å; L477-F495 HydrophobicContact CB-CB 4.33Å; L477-F495 HydrophobicContact CD1-CD1 4.02Å; L477-F495 HydrophobicContact CG-CD1 4.4Å; L477-F495 PolarHBondContact N-O 3.26Å; L477-F495 PolarHBondContact O-N 2.87Å; F495-P497 HydrophobicContact CD1-CB 4.36Å; F495-P497 HydrophobicContact CE1-CB 4Å; F495-P497 WeakPolarHBondContact O-CD 3.41Å; F495-K500 HydrophobicContact CE2-CB 4.34Å; F495-K500 HydrophobicContact CZ-CB 4.34Å; F495-W502 HydrophobicContact CB-CD2 3.93Å; F495-W502 HydrophobicContact CB-CE3 3.73Å; F495-W502 HydrophobicContact CB-CH2 3.67Å; F495-W502 HydrophobicContact CB-CZ2 3.84Å; F495-W502 HydrophobicContact CB-CZ3 3.63Å; F495-W502 AromaticContact CD2-CD1 3.97Å; F495-W502 AromaticContact CD2-CD2 3.9Å; F495-W502 HydrophobicContact CD2-CD2 3.9Å; F495-W502 AromaticContact CD2-CE2 3.51Å; F495-W502 HydrophobicContact CD2-CG 4.16Å; F495-W502 AromaticContact CD2-CZ2 3.87Å; F495-W502 HydrophobicContact CD2-CZ2 3.87Å; F495-W502 AromaticContact CD2-NE1 3.59Å; F495-W502 HydrophobicContact CG-CD2 4.37Å; F495-W502 HydrophobicContact CG-CH2 4.31Å; F495-W502 HydrophobicContact CG-CZ2 4Å
496	N	95	Very high	94.8	Very high	40 Å²	40	60 Å²	60	21%	0.214	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	110.9	168.9	-179.1	-8.8	0	0	0	109.4	K476 V498 T499 K500 T501	K476-N496 HydrophobicContact CG-CB 4.26Å; N496-V498 PolarHBondContact O-N 3.36Å; N496-V498 WeakPolarHBondContact OD1-CB 3.47Å; N496-V498 PolarHBondContact OD1-N 2.58Å; N496-T499 WeakPolarHBondContact CB-OG1 3.35Å; N496-T499 PolarHBondContact ND2-OG1 2.95Å; N496-K500 VanDerWaalsContact O-CA 3.23Å; N496-K500 WeakPolarHBondContact O-CA 3.3Å; N496-K500 PolarHBondContact O-N 2.99Å; N496-T501 PolarHBondContact N-O 3.27Å
497	P	92.5	Very high	95.3	Very high	5 Å²	5	54.6 Å²	54.6	3%	0.032	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-16.4	-177.8	29.6	-36.9	0	0	0	114.2	Y431 N475 F495 L716	Y431-P497 HydrophobicContact CE1-CB 3.8Å; N475-P497 WeakPolarHBondContact O-CD 3.33Å; N475-P497 WeakPolarHBondContact O-CG 3.41Å; F495-P497 HydrophobicContact CD1-CB 4.36Å; F495-P497 HydrophobicContact CE1-CB 4Å; F495-P497 WeakPolarHBondContact O-CD 3.41Å; P497-L716 HydrophobicContact CG-CD2 4.08Å
498	V	91.3	Very high	95.5	Very high	104 Å²	104	48 Å²	48	63%	0.63	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-53.3	177.5	-176.4	0	0	0	0	110.7	N496 K500 L716	N496-V498 PolarHBondContact O-N 3.36Å; N496-V498 WeakPolarHBondContact OD1-CB 3.47Å; N496-V498 PolarHBondContact OD1-N 2.58Å; V498-K500 VanDerWaalsContact C-N 3.32Å; V498-L716 HydrophobicContact CG2-CD1 4.37Å; V498-L716 HydrophobicContact CG2-CD2 3.79Å
499	T	93.2	Very high	95.6	Very high	77 Å²	77	50.8 Å²	50.8	47%	0.472	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-8.9	179.2	57	0	0	0	0	113.4	N496 T501	N496-T499 WeakPolarHBondContact CB-OG1 3.35Å; N496-T499 PolarHBondContact ND2-OG1 2.95Å; T499-T501 PolarHBondContact O-N 2.63Å; T499-T501 PolarHBondContact OG1-OG1 3.14Å
500	K	92.6	Very high	95.6	Very high	121 Å²	121	51.1 Å²	51.1	53%	0.526	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	26.3	-174.4	-57.9	-177	175.8	-172	0	114.1	I458 F495 N496 V498	I458-K500 WeakPolarHBondContact O-CD 3.23Å; I458-K500 WeakPolarHBondContact O-CE 3.35Å; F495-K500 HydrophobicContact CE2-CB 4.34Å; F495-K500 HydrophobicContact CZ-CB 4.34Å; N496-K500 VanDerWaalsContact O-CA 3.23Å; N496-K500 WeakPolarHBondContact O-CA 3.3Å; N496-K500 PolarHBondContact O-N 2.99Å; V498-K500 VanDerWaalsContact C-N 3.32Å
501	T	94.3	Very high	95.6	Very high	74 Å²	74	53.4 Å²	53.4	45%	0.454	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	148.6	-179.3	51.2	0	0	0	0	112.6	N496 T499	N496-T501 PolarHBondContact N-O 3.27Å; T499-T501 PolarHBondContact O-N 2.63Å; T499-T501 PolarHBondContact OG1-OG1 3.14Å
502	W	96.2	Very high	95.6	Very high	57 Å²	57	51.1 Å²	51.1	22%	0.216	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	145.3	173.5	-72.5	97.8	0	0	0	111.3	I445 T460 M461 V479 E493 C494 F495	I445-W502 HydrophobicContact CD1-CH2 4.05Å; I445-W502 HydrophobicContact CD1-CZ2 3.73Å; T460-W502 PolarHBondContact O-NE1 2.97Å; M461-W502 HydrophobicContact CB-CH2 4.41Å; M461-W502 HydrophobicContact CB-CZ2 4.15Å; M461-W502 HydrophobicContact CG-CH2 3.94Å; M461-W502 HydrophobicContact CG-CZ2 3.91Å; V479-W502 HydrophobicContact CG2-CH2 3.85Å; V479-W502 HydrophobicContact CG2-CZ3 3.84Å; E493-W502 HydrophobicContact CB-CE3 3.83Å; E493-W502 HydrophobicContact CB-CZ3 3.85Å; C494-W502 CarbonylContact O-C 3.6Å; C494-W502 WeakPolarHBondContact O-CA 3.28Å; F495-W502 HydrophobicContact CB-CD2 3.93Å; F495-W502 HydrophobicContact CB-CE3 3.73Å; F495-W502 HydrophobicContact CB-CH2 3.67Å; F495-W502 HydrophobicContact CB-CZ2 3.84Å; F495-W502 HydrophobicContact CB-CZ3 3.63Å; F495-W502 AromaticContact CD2-CD1 3.97Å; F495-W502 AromaticContact CD2-CD2 3.9Å; F495-W502 HydrophobicContact CD2-CD2 3.9Å; F495-W502 AromaticContact CD2-CE2 3.51Å; F495-W502 HydrophobicContact CD2-CG 4.16Å; F495-W502 AromaticContact CD2-CZ2 3.87Å; F495-W502 HydrophobicContact CD2-CZ2 3.87Å; F495-W502 AromaticContact CD2-NE1 3.59Å; F495-W502 HydrophobicContact CG-CD2 4.37Å; F495-W502 HydrophobicContact CG-CH2 4.31Å; F495-W502 HydrophobicContact CG-CZ2 4Å
503	L	95.4	Very high	95.6	Very high	108 Å²	108	52.2 Å²	52.2	57%	0.565	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.6	132.6	172.3	-65.2	173.9	0	0	0	109.4	E493 C494	E493-L503 WeakPolarHBondContact CA-O 3.48Å; C494-L503 HydrophobicContact CB-CB 4.38Å; C494-L503 PolarHBondContact N-O 2.61Å; C494-L503 PolarHBondContact O-N 3Å
504	V	95.6	Very high	95.5	Very high	121 Å²	121	51.4 Å²	51.4	73%	0.733	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	128.1	171.3	-178.3	0	0	0	0	108.7
505	M	95.4	Very high	95.7	Very high	38 Å²	38	51.8 Å²	51.8	19%	0.187	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	158.9	177.5	-62.6	-62.3	-54.9	0	0	110.3	Y478 V492 C494 W542	Y478-M505 HydrophobicContact CD1-CG 4.18Å; Y478-M505 HydrophobicContact CE1-CE 4.05Å; Y478-M505 HydrophobicContact CE1-CG 3.85Å; Y478-M505 HydrophobicContact CE1-SD 4.03Å; V492-M505 HydrophobicContact CB-CB 3.96Å; V492-M505 HydrophobicContact CG1-CB 3.87Å; V492-M505 HydrophobicContact CG1-CG 4.35Å; V492-M505 PolarHBondContact O-N 3.01Å; C494-M505 HydrophobicContact CB-CG 3.75Å; C494-M505 HydrophobicContact CB-SD 4.04Å; M505-W542 HydrophobicContact CE-CH2 4.13Å; M505-W542 HydrophobicContact CE-CZ2 3.81Å
506	P	96.4	Very high	95.7	Very high	52 Å²	52	52 Å²	52	34%	0.338	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-54.8	131.7	174.5	-27.2	37.2	0	0	0	111.7	W542 R547 W549	P506-W542 HydrophobicContact CB-CH2 4.18Å; P506-W542 HydrophobicContact CB-CZ3 4.05Å; P506-W542 HydrophobicContact CG-CH2 3.9Å; P506-W542 HydrophobicContact CG-CZ3 4.29Å; P506-R547 WeakPolarHBondContact CG-O 3.24Å; P506-W549 PolarHBondContact O-NE1 3.24Å
507	P	97.4	Very high	95.8	Very high	68 Å²	68	51 Å²	51	44%	0.442	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-76.6	161.2	-173	32.9	-37.4	0	0	0	112.1	N490 W549	N490-P507 WeakPolarHBondContact O-CA 3.28Å; N490-P507 WeakPolarHBondContact O-CB 3.31Å; P507-W549 VanDerWaalsContact C-CD1 3.47Å
508	M	97.9	Very high	96	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.015	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-64	156.3	168.2	-64.4	178.2	-62.7	0	0	111.2	V480 N490 V492 T510 R512 L515 A526 W549	V480-M508 HydrophobicContact CG1-CE 3.75Å; V480-M508 HydrophobicContact CG1-CG 4.37Å; V480-M508 HydrophobicContact CG1-SD 3.45Å; V480-M508 WeakPolarHBondContact CG1-SD 3.43Å; N490-M508 HydrophobicContact CB-CB 4.26Å; N490-M508 WeakPolarHBondContact CB-O 3.44Å; N490-M508 PolarHBondContact ND2-O 3.04Å; N490-M508 PolarHBondContact O-N 2.78Å; V492-M508 HydrophobicContact CG2-CG 4.35Å; M508-T510 WeakPolarHBondContact CB-O 3.4Å; M508-R512 HydrophobicContact CE-CB 4.04Å; M508-R512 HydrophobicContact CE-CG 4.26Å; M508-L515 HydrophobicContact CE-CD1 4.28Å; M508-L515 HydrophobicContact SD-CD1 4.31Å; M508-A526 HydrophobicContact SD-CB 3.53Å; M508-A526 VanDerWaalsContact SD-CB 3.53Å; M508-W549 HydrophobicContact CB-CG 4.48Å; M508-W549 HydrophobicContact CG-CD2 3.76Å; M508-W549 HydrophobicContact CG-CE3 4.16Å; M508-W549 HydrophobicContact CG-CG 4.08Å; M508-W549 HydrophobicContact CG-CZ2 4.21Å
509	S	96.8	Very high	96.2	Very high	71 Å²	71	48.9 Å²	48.9	50%	0.497	28%	0.277	S	S	.	.	S	Bend	trans	-69	-40.1	171.6	-63.8	0	0	0	0	111.5	E540 Y551	S509-E540 WeakPolarHBondContact CB-OE2 3.29Å; S509-E540 PolarHBondContact N-OE2 3.45Å; S509-Y551 WeakPolarHBondContact CB-OH 3.4Å
510	T	97.1	Very high	96.2	Very high	24 Å²	24	45.6 Å²	45.6	15%	0.147	26%	0.256	C	S	.	.	S	Bend	trans	-99.1	141.9	177.1	-50.2	0	0	0	0	111	N490 M508 R512 D531 L536 E540 Y551	N490-T510 WeakPolarHBondContact CB-O 3.38Å; M508-T510 WeakPolarHBondContact CB-O 3.4Å; T510-R512 HydrophobicContact CG2-CG 4.25Å; T510-D531 HydrophobicContact CG2-CB 4.31Å; T510-L536 HydrophobicContact CG2-CD1 3.76Å; T510-L536 HydrophobicContact CG2-CD2 4.32Å; T510-E540 WeakPolarHBondContact CB-OE1 3.38Å; T510-E540 PolarHBondContact N-OE1 3.28Å; T510-E540 VanDerWaalsContact N-OE1 3.11Å; T510-E540 PolarHBondContact OG1-OE1 3.04Å; T510-Y551 PolarHBondContact OG1-OH 2.84Å
511	H	98	Very high	96	Very high	82 Å²	82	44.6 Å²	44.6	38%	0.38	25%	0.253	S	S	.	.			trans	-74.7	133.3	167.8	-66.3	70.6	0	0	0	108.6	T488 N490 D531	T488-H511 HydrophobicContact CG2-CB 3.81Å; T488-H511 PolarHBondContact O-CD2 2.9Å; N490-H511 HydrophobicContact CB-CB 4.39Å; N490-H511 PolarHBondContact N-CD2 2.71Å; H511-D531 WeakPolarHBondContact O-CA 3.32Å; H511-D531 WeakPolarHBondContact O-CB 3.28Å
512	R	97.9	Very high	95.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	26%	0.255	C	S	.	.			trans	-144	119.8	-171.6	-61.5	179	-177.2	-91.3	-4	112.3	G482 T488 L489 M508 T510 L515 G528 L536 T538 E540	G482-R512 PolarHBondContact N-O 2.83Å; T488-R512 VanDerWaalsContact CG2-N 3.32Å; L489-R512 PolarHBondContact O-N 3.19Å; M508-R512 HydrophobicContact CE-CB 4.04Å; M508-R512 HydrophobicContact CE-CG 4.26Å; T510-R512 HydrophobicContact CG2-CG 4.25Å; R512-L515 HydrophobicContact CB-CB 4.19Å; R512-L515 HydrophobicContact CB-CD1 3.95Å; R512-L515 HydrophobicContact CB-CG 4.44Å; R512-G528 PolarHBondContact NH1-O 3.44Å; R512-L536 HydrophobicContact CG-CD1 3.83Å; R512-T538 PolarHBondContact NH1-O 2.86Å; R512-T538 PolarHBondContact NH1-OG1 3.49Å; R512-T538 PolarHBondContact NH2-OG1 3.4Å; R512-E540 IonicContact CZ-OE1 2.74Å; R512-E540 VanDerWaalsContact CZ-OE1 3.27Å; R512-E540 IonicContact NE-OE1 2.93Å; R512-E540 PolarHBondContact NE-OE1 3.32Å; R512-E540 IonicContact NH2-OE1 2.96Å; R512-E540 PolarHBondContact NH2-OE1 3.47Å
513	H	96.6	Very high	95.5	Very high	25 Å²	25	41.3 Å²	41.3	12%	0.116	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-119.6	150.8	163.9	73.2	-103.1	0	0	0	111.5	Q467 R483 T488 L515 G529 H530	Q467-H513 PolarHBondContact OE1-CD2 2.82Å; R483-H513 HydrophobicContact CB-CB 3.92Å; R483-H513 HydrophobicContact CG-CB 4.17Å; R483-H513 PolarHBondContact NH1-NE2 2.89Å; T488-H513 HydrophobicContact CG2-CB 4.06Å; T488-H513 PolarHBondContact OG1-ND1 2.85Å; H513-L515 PolarHBondContact O-N 3.12Å; H513-G529 CarbonylContact O-C 3.59Å; H513-G529 VanDerWaalsContact O-CA 3.29Å; H513-G529 WeakPolarHBondContact O-CA 3.44Å; H513-H530 AromaticContact CE1-ND1 3.64Å; H513-H530 PolarHBondContact N-O 2.93Å; H513-H530 PolarHBondContact ND1-O 2.89Å; H513-H530 PolarHBondContact O-N 3.09Å
514	G	95.3	Very high	95.5	Very high	6 Å²	6	36.3 Å²	36.3	6%	0.062	22%	0.223	C	C	.	.	S	Bend	trans	66.2	20.7	-171.7	0	0	0	0	0	113.5	Q467 S560 T561	Q467-G514 PolarHBondContact O-N 2.98Å; G514-S560 CarbonylContact O-C 3.56Å; G514-T561 WeakPolarHBondContact O-CA 3.24Å; G514-T561 PolarHBondContact O-N 3.14Å
515	L	97.6	Very high	95.6	Very high	10 Å²	10	30.7 Å²	30.7	5%	0.052	19%	0.189	C	C	.	.			trans	-71	155.3	171	72.9	172.8	0	0	0	111.2	V480 M508 R512 H513 V517 A526	V480-L515 HydrophobicContact CG1-CD1 3.97Å; M508-L515 HydrophobicContact CE-CD1 4.28Å; M508-L515 HydrophobicContact SD-CD1 4.31Å; R512-L515 HydrophobicContact CB-CB 4.19Å; R512-L515 HydrophobicContact CB-CD1 3.95Å; R512-L515 HydrophobicContact CB-CG 4.44Å; H513-L515 PolarHBondContact O-N 3.12Å; L515-V517 HydrophobicContact CD1-CG2 3.68Å; L515-V517 HydrophobicContact CG-CG2 3.89Å; L515-A526 HydrophobicContact CD1-CB 4.09Å
516	G	96.9	Very high	95.8	Very high	7 Å²	7	28.9 Å²	28.9	7%	0.072	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	146.9	161.6	0	0	0	0	0	110.4	V527	G516-V527 PolarHBondContact N-O 2.85Å; G516-V527 VanDerWaalsContact N-O 3.1Å; G516-V527 PolarHBondContact O-N 2.89Å
517	V	97.5	Very high	95.9	Very high	18 Å²	18	26.4 Å²	26.4	11%	0.109	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	132.9	179.7	179.1	0	0	0	0	109.8	A471 V480 L515 Y525	A471-V517 HydrophobicContact CB-CG1 3.89Å; V480-V517 HydrophobicContact CB-CG2 4.09Å; V480-V517 HydrophobicContact CG1-CG2 4.22Å; V480-V517 HydrophobicContact CG2-CG1 4.27Å; L515-V517 HydrophobicContact CD1-CG2 3.68Å; L515-V517 HydrophobicContact CG-CG2 3.89Å; V517-Y525 WeakPolarHBondContact CA-O 3.31Å
518	A	96.6	Very high	95.9	Very high	14 Å²	14	23.1 Å²	23.1	12%	0.116	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	162.9	172	0	0	0	0	0	111	Y525 V564 L571	A518-Y525 PolarHBondContact N-O 2.99Å; A518-Y525 PolarHBondContact O-N 2.79Å; A518-V564 HydrophobicContact CB-CG1 4.06Å; A518-L571 HydrophobicContact CB-CD1 3.88Å
519	T	94.9	Very high	95.9	Very high	51 Å²	51	23 Å²	23	31%	0.313	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	141.6	168.5	39.8	0	0	0	0	110.7	A471 V473 P523 M524 A566	A471-T519 HydrophobicContact CB-CG2 4.13Å; V473-T519 HydrophobicContact CG2-CG2 3.68Å; T519-P523 WeakPolarHBondContact CA-O 3.42Å; T519-M524 HydrophobicContact CG2-CG 3.75Å; T519-A566 VanDerWaalsContact O-CB 3.3Å; T519-A566 WeakPolarHBondContact O-CB 3.29Å
520	L	94.3	Very high	95.8	Very high	7 Å²	7	21 Å²	21	4%	0.037	13%	0.125	C	C	.	.	S	Bend	trans	-141.6	121.8	172.9	169.8	64	0	0	0	108.5	G522 P523 Y525 A566 L571 P591	L520-G522 PolarHBondContact O-N 2.78Å; L520-G522 VanDerWaalsContact O-N 3.09Å; L520-P523 PolarHBondContact N-O 3.1Å; L520-P523 VanDerWaalsContact O-CD 3.24Å; L520-P523 WeakPolarHBondContact O-CD 3.25Å; L520-P523 WeakPolarHBondContact O-CG 3.31Å; L520-Y525 HydrophobicContact CB-CD2 4.12Å; L520-Y525 HydrophobicContact CB-CE2 3.79Å; L520-Y525 HydrophobicContact CG-CE2 4.48Å; L520-A566 HydrophobicContact CB-CB 4.29Å; L520-A566 HydrophobicContact CD1-CB 4.21Å; L520-L571 HydrophobicContact CD2-CB 3.88Å; L520-P591 HydrophobicContact CD2-CG 3.95Å
521	E	88.6	Confident	95.8	Very high	101 Å²	101	22 Å²	22	47%	0.472	13%	0.129	S	C	.	.	S	Bend	trans	56.9	21.3	179	-62.1	174.2	149.2	0	0	114.5	P523 N569 P591 H592	E521-P523 VanDerWaalsContact C-CD 3.45Å; E521-P523 WeakPolarHBondContact O-CD 3.14Å; E521-N569 WeakPolarHBondContact OE1-CB 3.39Å; E521-N569 PolarHBondContact OE1-ND2 2.84Å; E521-P591 WeakPolarHBondContact OE2-CG 3.39Å; E521-H592 IonicContact OE1-CE1 2.73Å; E521-H592 IonicContact OE2-CE1 2.75Å
522	G	87.4	Confident	95.5	Very high	48 Å²	48	20.6 Å²	20.6	50%	0.495	14%	0.136	S	C	.	.	S	Bend	trans	119.2	-69.4	-176	0	0	0	0	0	113.2	L520	L520-G522 PolarHBondContact O-N 2.78Å; L520-G522 VanDerWaalsContact O-N 3.09Å
523	P	92.3	Very high	95.2	Very high	14 Å²	14	32 Å²	32	9%	0.091	18%	0.18	C	C	.	.	S	Bend	trans	-62.4	151.4	-176.9	24.9	-36	0	0	0	114.2	T519 L520 E521 Y525 R541 W542	T519-P523 WeakPolarHBondContact CA-O 3.42Å; L520-P523 PolarHBondContact N-O 3.1Å; L520-P523 VanDerWaalsContact O-CD 3.24Å; L520-P523 WeakPolarHBondContact O-CD 3.25Å; L520-P523 WeakPolarHBondContact O-CG 3.31Å; E521-P523 VanDerWaalsContact C-CD 3.45Å; E521-P523 WeakPolarHBondContact O-CD 3.14Å; P523-Y525 HydrophobicContact CB-CE2 4.35Å; P523-Y525 HydrophobicContact CG-CE2 3.98Å; P523-R541 HydrophobicContact CB-CG 4Å; P523-R541 HydrophobicContact CG-CG 4.5Å; P523-W542 WeakPolarHBondContact CB-O 3.25Å
524	M	95.9	Very high	95.1	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	146.5	171.3	-59.6	178.8	-74.9	0	0	110.7	A471 V473 Y478 T519 R541 W542 W549	A471-M524 HydrophobicContact CB-CG 3.79Å; A471-M524 HydrophobicContact CB-SD 3.65Å; V473-M524 HydrophobicContact CG2-CG 3.64Å; V473-M524 HydrophobicContact CG2-SD 3.89Å; Y478-M524 VanDerWaalsContact CB-SD 3.54Å; Y478-M524 HydrophobicContact CD1-CE 3.68Å; Y478-M524 HydrophobicContact CD1-SD 4.06Å; Y478-M524 HydrophobicContact CD2-SD 4.36Å; Y478-M524 HydrophobicContact CE1-CE 4.19Å; Y478-M524 HydrophobicContact CG-CE 4Å; Y478-M524 HydrophobicContact CG-SD 3.74Å; T519-M524 HydrophobicContact CG2-CG 3.75Å; M524-R541 CarbonylContact O-C 3.57Å; M524-R541 WeakPolarHBondContact O-CA 3.49Å; M524-W542 HydrophobicContact CB-CB 3.96Å; M524-W542 HydrophobicContact CE-CB 3.95Å; M524-W542 VanDerWaalsContact CE-CD1 3.47Å; M524-W542 HydrophobicContact CE-CD2 4.19Å; M524-W542 HydrophobicContact CE-CG 3.59Å; M524-W542 PolarHBondContact O-N 2.99Å; M524-W549 HydrophobicContact CB-CH2 4.22Å; M524-W549 HydrophobicContact CE-CZ2 4.38Å
525	Y	97.9	Very high	95.2	Very high	3 Å²	3	36.7 Å²	36.7	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.2	174.4	-66.8	-101.4	0	0	0	110.1	V517 A518 L520 P523 V539 E540 R541 V552 L571 F589	V517-Y525 WeakPolarHBondContact CA-O 3.31Å; A518-Y525 PolarHBondContact N-O 2.99Å; A518-Y525 PolarHBondContact O-N 2.79Å; L520-Y525 HydrophobicContact CB-CD2 4.12Å; L520-Y525 HydrophobicContact CB-CE2 3.79Å; L520-Y525 HydrophobicContact CG-CE2 4.48Å; P523-Y525 HydrophobicContact CB-CE2 4.35Å; P523-Y525 HydrophobicContact CG-CE2 3.98Å; Y525-V539 HydrophobicContact CD1-CG1 4.46Å; Y525-E540 CarbonylContact C-O 3.56Å; Y525-E540 WeakPolarHBondContact CA-O 3.47Å; Y525-R541 HydrophobicContact CD1-CB 3.95Å; Y525-R541 HydrophobicContact CD1-CG 4.26Å; Y525-R541 HydrophobicContact CE1-CB 3.81Å; Y525-R541 HydrophobicContact CE1-CG 3.8Å; Y525-R541 HydrophobicContact CE2-CG 4.45Å; Y525-V552 HydrophobicContact CD1-CG2 4.47Å; Y525-L571 HydrophobicContact CD1-CD2 4.05Å; Y525-L571 HydrophobicContact CD2-CD2 4.33Å; Y525-L571 HydrophobicContact CG-CD2 3.73Å; Y525-F589 HydrophobicContact CE1-CD1 4.45Å; Y525-F589 AromaticContact CE1-CE1 3.83Å; Y525-F589 HydrophobicContact CE1-CE1 3.83Å
526	A	98.3	Very high	95.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	108.2	173.4	0	0	0	0	0	109.1	V480 M508 L515 V539 E540 W549	V480-A526 HydrophobicContact CG1-CB 4.33Å; M508-A526 HydrophobicContact SD-CB 3.53Å; M508-A526 VanDerWaalsContact SD-CB 3.53Å; L515-A526 HydrophobicContact CD1-CB 4.09Å; A526-V539 WeakPolarHBondContact O-CA 3.45Å; A526-E540 PolarHBondContact N-O 2.83Å; A526-E540 PolarHBondContact O-N 3.48Å; A526-W549 HydrophobicContact CB-CE3 4.48Å; A526-W549 HydrophobicContact CB-CH2 4.28Å; A526-W549 HydrophobicContact CB-CZ3 3.78Å
527	V	98.4	Very high	95.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	122	-167.1	178.1	0	0	0	0	110.6	G516 V539 M555 V564 L571 A573 W596	G516-V527 PolarHBondContact N-O 2.85Å; G516-V527 VanDerWaalsContact N-O 3.1Å; G516-V527 PolarHBondContact O-N 2.89Å; V527-V539 HydrophobicContact CG1-CG2 4.18Å; V527-V539 HydrophobicContact CG2-CG1 3.85Å; V527-M555 HydrophobicContact CG1-CE 3.8Å; V527-M555 HydrophobicContact CG1-SD 3.58Å; V527-M555 VanDerWaalsContact CG1-SD 3.58Å; V527-V564 HydrophobicContact CB-CG1 4.46Å; V527-V564 HydrophobicContact CB-CG2 3.91Å; V527-V564 HydrophobicContact CG1-CG2 3.97Å; V527-V564 HydrophobicContact CG2-CG1 4.01Å; V527-V564 HydrophobicContact CG2-CG2 4.33Å; V527-L571 HydrophobicContact CG2-CD2 3.78Å; V527-A573 HydrophobicContact CG1-CB 4.19Å; V527-W596 HydrophobicContact CG1-CH2 4.25Å; V527-W596 HydrophobicContact CG1-CZ2 4.38Å
528	G	97.8	Very high	95.3	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.218	C	C	.	.			trans	60.4	-135.4	173.6	0	0	0	0	0	113.3	R512 L536 T538	R512-G528 PolarHBondContact NH1-O 3.44Å; G528-L536 WeakPolarHBondContact CA-O 3.26Å; G528-T538 PolarHBondContact N-O 3.11Å; G528-T538 VanDerWaalsContact N-O 3.11Å
529	G	97.3	Very high	95.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.213	C	C	.	.			trans	94.6	-157.5	-172.1	0	0	0	0	0	112.9	H513 L536 R559	H513-G529 CarbonylContact O-C 3.59Å; H513-G529 VanDerWaalsContact O-CA 3.29Å; H513-G529 WeakPolarHBondContact O-CA 3.44Å; G529-L536 PolarHBondContact O-N 3.05Å; G529-R559 PolarHBondContact N-O 3.45Å
530	H	96.2	Very high	95.5	Very high	30 Å²	30	37 Å²	37	14%	0.139	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-137.8	133.8	177.5	-170.8	-86.9	0	0	0	108.7	H513 G532 S534 Y535	H513-H530 AromaticContact CE1-ND1 3.64Å; H513-H530 PolarHBondContact N-O 2.93Å; H513-H530 PolarHBondContact ND1-O 2.89Å; H513-H530 PolarHBondContact O-N 3.09Å; H530-G532 VanDerWaalsContact CE1-C 3.43Å; H530-G532 PolarHBondContact ND1-N 2.96Å; H530-G532 VanDerWaalsContact ND1-N 3.1Å; H530-S534 VanDerWaalsContact CA-O 3.29Å; H530-S534 WeakPolarHBondContact CA-O 3.44Å; H530-S534 PolarHBondContact CD2-O 2.93Å; H530-S534 VanDerWaalsContact CG-O 3.3Å; H530-Y535 AromaticContact CD2-CD2 3.56Å; H530-Y535 AromaticContact CD2-CE2 3.61Å; H530-Y535 AromaticContact CD2-CG 3.81Å; H530-Y535 AromaticContact CD2-CZ 3.96Å; H530-Y535 AromaticContact NE2-CD2 3.91Å; H530-Y535 AromaticContact NE2-CE2 3.74Å
531	D	95.9	Very high	95.7	Very high	44 Å²	44	41.3 Å²	41.3	24%	0.235	21%	0.214	C	C	.	.			trans	-83.5	-23.4	-176.5	56.4	23.4	0	0	0	113.5	T488 T510 H511 W533 S534 L536	T488-D531 WeakPolarHBondContact CB-O 3.3Å; T488-D531 WeakPolarHBondContact CG2-O 3.26Å; T488-D531 PolarHBondContact OG1-O 3.48Å; T510-D531 HydrophobicContact CG2-CB 4.31Å; H511-D531 WeakPolarHBondContact O-CA 3.32Å; H511-D531 WeakPolarHBondContact O-CB 3.28Å; D531-W533 WeakPolarHBondContact OD1-CA 3.22Å; D531-W533 PolarHBondContact OD1-N 2.9Å; D531-S534 PolarHBondContact N-O 2.75Å; D531-S534 PolarHBondContact OD1-N 2.9Å; D531-S534 PolarHBondContact OD2-OG 2.98Å; D531-L536 HydrophobicContact CB-CD1 4.23Å; D531-L536 HydrophobicContact CB-CD2 4.31Å
532	G	92.9	Very high	96	Very high	52 Å²	52	37.2 Å²	37.2	54%	0.536	19%	0.194	S	C	.	.	S	Bend	trans	128.3	-16.6	-171.3	0	0	0	0	0	112.7	H530	H530-G532 VanDerWaalsContact CE1-C 3.43Å; H530-G532 PolarHBondContact ND1-N 2.96Å; H530-G532 VanDerWaalsContact ND1-N 3.1Å
533	W	91.6	Very high	96	Very high	239 Å²	239	36.5 Å²	36.5	91%	0.905	18%	0.179	S	C	*	.	S	Bend	trans	-126.8	-37.4	-179.7	-177.9	-94.2	0	0	0	112.9	D531	D531-W533 WeakPolarHBondContact OD1-CA 3.22Å; D531-W533 PolarHBondContact OD1-N 2.9Å
534	S	94.6	Very high	95.6	Very high	41 Å²	41	38.8 Å²	38.8	29%	0.287	19%	0.194	S	C	.	.	S	Bend	trans	-137.4	153.2	-171.4	80.5	0	0	0	0	113.9	H530 D531	H530-S534 VanDerWaalsContact CA-O 3.29Å; H530-S534 WeakPolarHBondContact CA-O 3.44Å; H530-S534 PolarHBondContact CD2-O 2.93Å; H530-S534 VanDerWaalsContact CG-O 3.3Å; D531-S534 PolarHBondContact N-O 2.75Å; D531-S534 PolarHBondContact OD1-N 2.9Å; D531-S534 PolarHBondContact OD2-OG 2.98Å
535	Y	96.1	Very high	95.1	Very high	90 Å²	90	45.9 Å²	45.9	35%	0.353	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-82.7	128.3	170	-68.3	-106.5	0	0	0	108.9	H530 P558 S560 R577 G579	H530-Y535 AromaticContact CD2-CD2 3.56Å; H530-Y535 AromaticContact CD2-CE2 3.61Å; H530-Y535 AromaticContact CD2-CG 3.81Å; H530-Y535 AromaticContact CD2-CZ 3.96Å; H530-Y535 AromaticContact NE2-CD2 3.91Å; H530-Y535 AromaticContact NE2-CE2 3.74Å; Y535-P558 VanDerWaalsContact O-CB 3.26Å; Y535-P558 WeakPolarHBondContact O-CB 3.35Å; Y535-S560 VanDerWaalsContact CD1-OG 3.28Å; Y535-S560 WeakPolarHBondContact CD1-OG 3.17Å; Y535-S560 WeakPolarHBondContact CE1-OG 3.44Å; Y535-R577 WeakPolarHBondContact CD1-O 3.26Å; Y535-R577 HydrophobicContact CE1-CB 4.32Å; Y535-G579 VanDerWaalsContact CE2-CA 3.42Å
536	L	97.7	Very high	94.4	Very high	13 Å²	13	47.7 Å²	47.7	7%	0.068	25%	0.252	C	S	.	.			trans	-96.4	135.3	-168.9	-59	172.8	0	0	0	111.8	T510 R512 G528 G529 D531 P558 R559	T510-L536 HydrophobicContact CG2-CD1 3.76Å; T510-L536 HydrophobicContact CG2-CD2 4.32Å; R512-L536 HydrophobicContact CG-CD1 3.83Å; G528-L536 WeakPolarHBondContact CA-O 3.26Å; G529-L536 PolarHBondContact O-N 3.05Å; D531-L536 HydrophobicContact CB-CD1 4.23Å; D531-L536 HydrophobicContact CB-CD2 4.31Å; L536-P558 WeakPolarHBondContact O-CA 3.31Å; L536-R559 PolarHBondContact O-N 3.41Å
537	N	97.8	Very high	94	Very high	58 Å²	58	56.4 Å²	56.4	31%	0.31	28%	0.284	S	S	.	.			trans	-100.8	-10.6	162.3	72.6	-33	0	0	0	112.7	S554 M555 P558	N537-S554 WeakPolarHBondContact O-CA 3.39Å; N537-S554 WeakPolarHBondContact O-CB 3.48Å; N537-M555 HydrophobicContact CB-CB 4.26Å; N537-M555 WeakPolarHBondContact CB-O 3.29Å; N537-M555 PolarHBondContact ND2-O 3.36Å; N537-M555 PolarHBondContact O-N 3.17Å; N537-P558 HydrophobicContact CB-CB 4.2Å
538	T	98.3	Very high	93.8	Very high	34 Å²	34	60.9 Å²	60.9	21%	0.209	31%	0.305	C	S	.	.			trans	-71.3	152	-177.6	64.8	0	0	0	0	111.9	R512 G528 S554	R512-T538 PolarHBondContact NH1-O 2.86Å; R512-T538 PolarHBondContact NH1-OG1 3.49Å; R512-T538 PolarHBondContact NH2-OG1 3.4Å; G528-T538 PolarHBondContact N-O 3.11Å; G528-T538 VanDerWaalsContact N-O 3.11Å; T538-S554 WeakPolarHBondContact CA-OG 3.31Å
539	V	98.4	Very high	93.8	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	133.2	-175.4	-176	0	0	0	0	109.1	Y525 A526 V527 Y551 V552 M555 W596	Y525-V539 HydrophobicContact CD1-CG1 4.46Å; A526-V539 WeakPolarHBondContact O-CA 3.45Å; V527-V539 HydrophobicContact CG1-CG2 4.18Å; V527-V539 HydrophobicContact CG2-CG1 3.85Å; V539-Y551 WeakPolarHBondContact O-CA 3.38Å; V539-V552 HydrophobicContact CB-CG2 3.7Å; V539-V552 HydrophobicContact CG1-CG2 3.54Å; V539-V552 PolarHBondContact O-N 2.77Å; V539-M555 HydrophobicContact CG2-CG 4.35Å; V539-W596 HydrophobicContact CG2-CZ2 3.84Å
540	E	98.3	Very high	93.8	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	133.2	177.1	-71.6	172.4	-111.4	0	0	109.8	S509 T510 R512 Y525 A526 W549 N550 Y551	S509-E540 WeakPolarHBondContact CB-OE2 3.29Å; S509-E540 PolarHBondContact N-OE2 3.45Å; T510-E540 WeakPolarHBondContact CB-OE1 3.38Å; T510-E540 PolarHBondContact N-OE1 3.28Å; T510-E540 VanDerWaalsContact N-OE1 3.11Å; T510-E540 PolarHBondContact OG1-OE1 3.04Å; R512-E540 IonicContact CZ-OE1 2.74Å; R512-E540 VanDerWaalsContact CZ-OE1 3.27Å; R512-E540 IonicContact NE-OE1 2.93Å; R512-E540 PolarHBondContact NE-OE1 3.32Å; R512-E540 IonicContact NH2-OE1 2.96Å; R512-E540 PolarHBondContact NH2-OE1 3.47Å; Y525-E540 CarbonylContact C-O 3.56Å; Y525-E540 WeakPolarHBondContact CA-O 3.47Å; A526-E540 PolarHBondContact N-O 2.83Å; A526-E540 PolarHBondContact O-N 3.48Å; E540-W549 HydrophobicContact CB-CE3 3.9Å; E540-N550 CarbonylContact C-O 3.56Å; E540-N550 WeakPolarHBondContact CA-O 3.39Å; E540-Y551 HydrophobicContact CG-CD1 3.57Å; E540-Y551 HydrophobicContact CG-CE1 3.5Å; E540-Y551 VanDerWaalsContact CG-CE1 3.5Å; E540-Y551 HydrophobicContact CG-CG 4.32Å
541	R	97.3	Very high	93.8	Very high	98 Å²	98	69.2 Å²	69.2	37%	0.37	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	131.5	175	174.1	-174.3	160.7	176	-4.5	109.1	P523 M524 Y525 W549 N550 V552	P523-R541 HydrophobicContact CB-CG 4Å; P523-R541 HydrophobicContact CG-CG 4.5Å; M524-R541 CarbonylContact O-C 3.57Å; M524-R541 WeakPolarHBondContact O-CA 3.49Å; Y525-R541 HydrophobicContact CD1-CB 3.95Å; Y525-R541 HydrophobicContact CD1-CG 4.26Å; Y525-R541 HydrophobicContact CE1-CB 3.81Å; Y525-R541 HydrophobicContact CE1-CG 3.8Å; Y525-R541 HydrophobicContact CE2-CG 4.45Å; R541-W549 WeakPolarHBondContact O-CA 3.39Å; R541-N550 PolarHBondContact N-O 3.25Å; R541-N550 PolarHBondContact O-N 2.99Å; R541-V552 HydrophobicContact CB-CG1 3.75Å
542	W	95.6	Very high	93.9	Very high	16 Å²	16	68.3 Å²	68.3	6%	0.061	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	124.8	166.9	177	-113.5	0	0	0	110.2	M505 P506 P523 M524 R547 W549	M505-W542 HydrophobicContact CE-CH2 4.13Å; M505-W542 HydrophobicContact CE-CZ2 3.81Å; P506-W542 HydrophobicContact CB-CH2 4.18Å; P506-W542 HydrophobicContact CB-CZ3 4.05Å; P506-W542 HydrophobicContact CG-CH2 3.9Å; P506-W542 HydrophobicContact CG-CZ3 4.29Å; P523-W542 WeakPolarHBondContact CB-O 3.25Å; M524-W542 HydrophobicContact CB-CB 3.96Å; M524-W542 HydrophobicContact CE-CB 3.95Å; M524-W542 VanDerWaalsContact CE-CD1 3.47Å; M524-W542 HydrophobicContact CE-CD2 4.19Å; M524-W542 HydrophobicContact CE-CG 3.59Å; M524-W542 PolarHBondContact O-N 2.99Å; W542-R547 VanDerWaalsContact CH2-CA 3.47Å; W542-R547 HydrophobicContact CH2-CB 4.02Å; W542-R547 WeakPolarHBondContact CH2-O 3.49Å; W542-R547 HydrophobicContact CZ2-CB 4.36Å; W542-R547 WeakPolarHBondContact CZ3-O 3.42Å; W542-W549 HydrophobicContact CB-CD2 4.28Å; W542-W549 HydrophobicContact CB-CE3 4.06Å; W542-W549 HydrophobicContact CB-CH2 3.88Å; W542-W549 HydrophobicContact CB-CZ2 4.07Å; W542-W549 HydrophobicContact CB-CZ3 3.87Å; W542-W549 AromaticContact CE3-CD1 3.66Å; W542-W549 HydrophobicContact CE3-CD2 4.06Å; W542-W549 AromaticContact CE3-CE2 3.68Å; W542-W549 HydrophobicContact CE3-CG 4.06Å; W542-W549 HydrophobicContact CE3-CZ2 4.28Å; W542-W549 AromaticContact CE3-NE1 3.42Å; W542-W549 AromaticContact CZ3-CD1 3.87Å; W542-W549 AromaticContact CZ3-NE1 3.75Å
543	D	88.1	Confident	94.2	Very high	33 Å²	33	67.1 Å²	67.1	18%	0.176	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	108.3	168.6	173.7	4.8	0	0	0	108	D545 G546 R547 Q548	D543-D545 VanDerWaalsContact C-N 3.34Å; D543-D545 PolarHBondContact OD1-N 3.16Å; D543-G546 VanDerWaalsContact CG-N 3.31Å; D543-G546 PolarHBondContact OD1-N 3.05Å; D543-G546 WeakPolarHBondContact OD2-CA 3.24Å; D543-G546 PolarHBondContact OD2-N 3.09Å; D543-R547 WeakPolarHBondContact O-CA 3.39Å; D543-R547 PolarHBondContact O-N 2.87Å; D543-Q548 HydrophobicContact CB-CG 4.03Å; D543-Q548 WeakPolarHBondContact CB-O 3.42Å; D543-Q548 PolarHBondContact N-O 2.9Å; D543-Q548 PolarHBondContact O-N 3.36Å; D543-Q548 PolarHBondContact OD2-NE2 3.12Å
544	P	83.8	Confident	94.5	Very high	62 Å²	62	58.2 Å²	58.2	40%	0.403	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-29.9	-177.3	29.5	-34.5	0	0	0	112.8	R547	P544-R547 WeakPolarHBondContact O-CG 3.44Å
545	D	83.9	Confident	94.6	Very high	151 Å²	151	56.4 Å²	56.4	81%	0.807	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-50	-177.7	-60.6	-53.2	0	0	0	110.4	D543 R547	D543-D545 VanDerWaalsContact C-N 3.34Å; D543-D545 PolarHBondContact OD1-N 3.16Å; D545-R547 PolarHBondContact O-N 3.08Å
546	G	84.4	Confident	94.7	Very high	41 Å²	41	56 Å²	56	42%	0.423	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-8.6	173.5	0	0	0	0	0	114.6	D543 Q548	D543-G546 VanDerWaalsContact CG-N 3.31Å; D543-G546 PolarHBondContact OD1-N 3.05Å; D543-G546 WeakPolarHBondContact OD2-CA 3.24Å; D543-G546 PolarHBondContact OD2-N 3.09Å; G546-Q548 VanDerWaalsContact C-N 3.31Å; G546-Q548 PolarHBondContact O-N 2.78Å
547	R	89.6	Confident	94.5	Very high	183 Å²	183	56.9 Å²	56.9	69%	0.691	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	42.4	-179.2	-61.6	-176	173.1	-162.5	-1.7	114.2	P506 W542 D543 P544 D545	P506-R547 WeakPolarHBondContact CG-O 3.24Å; W542-R547 VanDerWaalsContact CH2-CA 3.47Å; W542-R547 HydrophobicContact CH2-CB 4.02Å; W542-R547 WeakPolarHBondContact CH2-O 3.49Å; W542-R547 HydrophobicContact CZ2-CB 4.36Å; W542-R547 WeakPolarHBondContact CZ3-O 3.42Å; D543-R547 WeakPolarHBondContact O-CA 3.39Å; D543-R547 PolarHBondContact O-N 2.87Å; P544-R547 WeakPolarHBondContact O-CG 3.44Å; D545-R547 PolarHBondContact O-N 3.08Å
548	Q	94.1	Very high	94.5	Very high	93 Å²	93	56.2 Å²	56.2	44%	0.435	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	159.8	-171.3	60.2	-176.7	-12.4	0	0	112.2	D543 G546	D543-Q548 HydrophobicContact CB-CG 4.03Å; D543-Q548 WeakPolarHBondContact CB-O 3.42Å; D543-Q548 PolarHBondContact N-O 2.9Å; D543-Q548 PolarHBondContact O-N 3.36Å; D543-Q548 PolarHBondContact OD2-NE2 3.12Å; G546-Q548 VanDerWaalsContact C-N 3.31Å; G546-Q548 PolarHBondContact O-N 2.78Å
549	W	97.5	Very high	94.4	Very high	16 Å²	16	54.6 Å²	54.6	6%	0.061	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	121	172.9	-70.1	90.2	0	0	0	110.2	V480 V492 P506 P507 M508 M524 A526 E540 R541 W542	V480-W549 HydrophobicContact CG1-CH2 4.19Å; V480-W549 HydrophobicContact CG1-CZ2 4.33Å; V480-W549 HydrophobicContact CG2-CH2 4.42Å; V480-W549 HydrophobicContact CG2-CZ2 4.47Å; V492-W549 HydrophobicContact CG2-CZ2 3.86Å; P506-W549 PolarHBondContact O-NE1 3.24Å; P507-W549 VanDerWaalsContact C-CD1 3.47Å; M508-W549 HydrophobicContact CB-CG 4.48Å; M508-W549 HydrophobicContact CG-CD2 3.76Å; M508-W549 HydrophobicContact CG-CE3 4.16Å; M508-W549 HydrophobicContact CG-CG 4.08Å; M508-W549 HydrophobicContact CG-CZ2 4.21Å; M524-W549 HydrophobicContact CB-CH2 4.22Å; M524-W549 HydrophobicContact CE-CZ2 4.38Å; A526-W549 HydrophobicContact CB-CE3 4.48Å; A526-W549 HydrophobicContact CB-CH2 4.28Å; A526-W549 HydrophobicContact CB-CZ3 3.78Å; E540-W549 HydrophobicContact CB-CE3 3.9Å; R541-W549 WeakPolarHBondContact O-CA 3.39Å; W542-W549 HydrophobicContact CB-CD2 4.28Å; W542-W549 HydrophobicContact CB-CE3 4.06Å; W542-W549 HydrophobicContact CB-CH2 3.88Å; W542-W549 HydrophobicContact CB-CZ2 4.07Å; W542-W549 HydrophobicContact CB-CZ3 3.87Å; W542-W549 AromaticContact CE3-CD1 3.66Å; W542-W549 HydrophobicContact CE3-CD2 4.06Å; W542-W549 AromaticContact CE3-CE2 3.68Å; W542-W549 HydrophobicContact CE3-CG 4.06Å; W542-W549 HydrophobicContact CE3-CZ2 4.28Å; W542-W549 AromaticContact CE3-NE1 3.42Å; W542-W549 AromaticContact CZ3-CD1 3.87Å; W542-W549 AromaticContact CZ3-NE1 3.75Å
550	N	96.8	Very high	94.2	Very high	68 Å²	68	55 Å²	55	36%	0.364	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140	179.9	-75	-59.6	0	0	0	110.7	E540 R541	E540-N550 CarbonylContact C-O 3.56Å; E540-N550 WeakPolarHBondContact CA-O 3.39Å; R541-N550 PolarHBondContact N-O 3.25Å; R541-N550 PolarHBondContact O-N 2.99Å
551	Y	97.9	Very high	94	Very high	122 Å²	122	56.1 Å²	56.1	48%	0.478	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	138	173.1	-68	-76.7	0	0	0	111.6	S509 T510 V539 E540	S509-Y551 WeakPolarHBondContact CB-OH 3.4Å; T510-Y551 PolarHBondContact OG1-OH 2.84Å; V539-Y551 WeakPolarHBondContact O-CA 3.38Å; E540-Y551 HydrophobicContact CG-CD1 3.57Å; E540-Y551 HydrophobicContact CG-CE1 3.5Å; E540-Y551 VanDerWaalsContact CG-CE1 3.5Å; E540-Y551 HydrophobicContact CG-CG 4.32Å
552	V	97.6	Very high	93.9	Very high	25 Å²	25	51.9 Å²	51.9	15%	0.152	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-177.2	166.7	-60.8	0	0	0	0	109.5	Y525 V539 R541 S554 F589	Y525-V552 HydrophobicContact CD1-CG2 4.47Å; V539-V552 HydrophobicContact CB-CG2 3.7Å; V539-V552 HydrophobicContact CG1-CG2 3.54Å; V539-V552 PolarHBondContact O-N 2.77Å; R541-V552 HydrophobicContact CB-CG1 3.75Å; V552-S554 PolarHBondContact O-N 2.81Å; V552-F589 HydrophobicContact CB-CE2 4.33Å; V552-F589 HydrophobicContact CB-CZ 4Å; V552-F589 HydrophobicContact CG1-CZ 4.47Å; V552-F589 HydrophobicContact CG2-CE2 4.29Å; V552-F589 HydrophobicContact CG2-CZ 4.07Å
553	A	98	Very high	93.9	Very high	27 Å²	27	51.3 Å²	51.3	22%	0.223	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-55.2	140	176.9	0	0	0	0	0	111.8	F589 N594 W596	A553-F589 HydrophobicContact CB-CE2 4.24Å; A553-N594 WeakPolarHBondContact CB-O 3.36Å; A553-N594 WeakPolarHBondContact CB-OD1 3.48Å; A553-N594 PolarHBondContact N-OD1 3.37Å; A553-W596 VanDerWaalsContact O-CD1 3.28Å; A553-W596 PolarHBondContact O-NE1 2.58Å
554	S	98.1	Very high	94.4	Very high	52 Å²	52	50.4 Å²	50.4	36%	0.364	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-84.5	152.2	178.5	-58.3	0	0	0	0	111.2	N537 T538 V552	N537-S554 WeakPolarHBondContact O-CA 3.39Å; N537-S554 WeakPolarHBondContact O-CB 3.48Å; T538-S554 WeakPolarHBondContact CA-OG 3.31Å; V552-S554 PolarHBondContact O-N 2.81Å
555	M	98.1	Very high	95	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.015	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-63.4	156.8	172.6	-62.3	177.6	-65	0	0	110.9	V527 N537 V539 T557 R559 A573 W596	V527-M555 HydrophobicContact CG1-CE 3.8Å; V527-M555 HydrophobicContact CG1-SD 3.58Å; V527-M555 VanDerWaalsContact CG1-SD 3.58Å; N537-M555 HydrophobicContact CB-CB 4.26Å; N537-M555 WeakPolarHBondContact CB-O 3.29Å; N537-M555 PolarHBondContact ND2-O 3.36Å; N537-M555 PolarHBondContact O-N 3.17Å; V539-M555 HydrophobicContact CG2-CG 4.35Å; M555-T557 VanDerWaalsContact C-N 3.31Å; M555-T557 WeakPolarHBondContact CB-O 3.43Å; M555-R559 HydrophobicContact CE-CB 4.12Å; M555-R559 HydrophobicContact CE-CG 4.09Å; M555-R559 HydrophobicContact SD-CG 4.35Å; M555-A573 HydrophobicContact SD-CB 3.64Å; M555-W596 HydrophobicContact CB-CD2 4.48Å; M555-W596 HydrophobicContact CG-CD2 3.69Å; M555-W596 HydrophobicContact CG-CE3 4.02Å; M555-W596 HydrophobicContact CG-CG 4.25Å; M555-W596 HydrophobicContact CG-CH2 4.11Å; M555-W596 HydrophobicContact CG-CZ2 3.78Å; M555-W596 HydrophobicContact CG-CZ3 4.22Å; M555-W596 HydrophobicContact SD-CH2 4.31Å; M555-W596 HydrophobicContact SD-CZ2 4.41Å
556	S	96.7	Very high	95.6	Very high	82 Å²	82	42.4 Å²	42.4	57%	0.573	24%	0.236	S	C	*	.	S	Bend	trans	-69.4	-31.9	171.8	66	0	0	0	0	112.1	E587	S556-E587 VanDerWaalsContact CB-OE2 3.31Å; S556-E587 WeakPolarHBondContact CB-OE2 3.26Å; S556-E587 PolarHBondContact N-OE2 2.92Å; S556-E587 PolarHBondContact OG-OE1 3.23Å; S556-E587 PolarHBondContact OG-OE2 3.31Å
557	T	95.2	Very high	96.1	Very high	30 Å²	30	41.1 Å²	41.1	18%	0.184	22%	0.22	C	C	.	.	S	Bend	trans	-112	136.4	-179	-46.4	0	0	0	0	110.1	M555 L583 E587	M555-T557 VanDerWaalsContact C-N 3.31Å; M555-T557 WeakPolarHBondContact CB-O 3.43Å; T557-L583 HydrophobicContact CG2-CD1 3.77Å; T557-L583 HydrophobicContact CG2-CD2 4.17Å; T557-E587 PolarHBondContact N-OE1 2.81Å; T557-E587 PolarHBondContact OG1-OE1 3.06Å
558	P	96.6	Very high	96.2	Very high	44 Å²	44	36.8 Å²	36.8	29%	0.286	21%	0.211	S	C	.	.			trans	-73	139.6	168.5	30.5	-33.8	0	0	0	111	Y535 L536 N537	Y535-P558 VanDerWaalsContact O-CB 3.26Å; Y535-P558 WeakPolarHBondContact O-CB 3.35Å; L536-P558 WeakPolarHBondContact O-CA 3.31Å; N537-P558 HydrophobicContact CB-CB 4.2Å
559	R	96.2	Very high	96.1	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.215	C	C	.	.			trans	-144.4	120.2	-171.2	-51.5	179.9	178	-100.9	-0.8	112.3	G529 L536 M555 V562 G575 R577 L583 S585 E587	G529-R559 PolarHBondContact N-O 3.45Å; L536-R559 PolarHBondContact O-N 3.41Å; M555-R559 HydrophobicContact CE-CB 4.12Å; M555-R559 HydrophobicContact CE-CG 4.09Å; M555-R559 HydrophobicContact SD-CG 4.35Å; R559-V562 HydrophobicContact CB-CB 3.83Å; R559-V562 HydrophobicContact CB-CG1 4.32Å; R559-V562 HydrophobicContact CB-CG2 3.86Å; R559-V562 HydrophobicContact CG-CG2 4.45Å; R559-G575 PolarHBondContact NH1-O 2.93Å; R559-R577 CarbonylContact C-O 3.59Å; R559-R577 WeakPolarHBondContact CA-O 3.37Å; R559-L583 HydrophobicContact CG-CD1 3.85Å; R559-S585 PolarHBondContact NH1-O 3.2Å; R559-S585 PolarHBondContact NH2-OG 3.42Å; R559-E587 IonicContact CZ-OE1 3.84Å; R559-E587 IonicContact NE-OE1 2.66Å; R559-E587 PolarHBondContact NE-OE1 2.87Å; R559-E587 VanDerWaalsContact NE-OE1 3.14Å; R559-E587 IonicContact NH2-OE1 3.52Å; R559-E587 PolarHBondContact NH2-OE1 2.99Å
560	S	95.2	Very high	96.1	Very high	10 Å²	10	39.1 Å²	39.1	7%	0.07	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-117.7	156.5	164.9	81.9	0	0	0	0	112	G514 Y535 V562 G576 R577	G514-S560 CarbonylContact O-C 3.56Å; Y535-S560 VanDerWaalsContact CD1-OG 3.28Å; Y535-S560 WeakPolarHBondContact CD1-OG 3.17Å; Y535-S560 WeakPolarHBondContact CE1-OG 3.44Å; S560-V562 PolarHBondContact O-N 2.97Å; S560-G576 CarbonylContact O-C 3.57Å; S560-G576 WeakPolarHBondContact O-CA 3.31Å; S560-R577 PolarHBondContact N-O 2.93Å; S560-R577 PolarHBondContact O-N 3.01Å
561	T	94	Very high	96.2	Very high	22 Å²	22	35.9 Å²	35.9	14%	0.135	21%	0.207	C	C	.	.	S	Bend	trans	51.1	43.5	-164.6	54.9	0	0	0	0	112.1	G514 G576 R577 G608	G514-T561 WeakPolarHBondContact O-CA 3.24Å; G514-T561 PolarHBondContact O-N 3.14Å; T561-G576 WeakPolarHBondContact O-CA 3.49Å; T561-R577 PolarHBondContact OG1-NE 2.74Å; T561-R577 PolarHBondContact OG1-NH2 3.03Å; T561-R577 VanDerWaalsContact OG1-NH2 3.1Å; T561-G608 PolarHBondContact O-N 2.72Å
562	V	95.4	Very high	96.2	Very high	9 Å²	9	30.5 Å²	30.5	6%	0.055	19%	0.186	C	C	.	.			trans	-90.4	134	-175	60.5	0	0	0	0	111	R559 S560 V564 A573	R559-V562 HydrophobicContact CB-CB 3.83Å; R559-V562 HydrophobicContact CB-CG1 4.32Å; R559-V562 HydrophobicContact CB-CG2 3.86Å; R559-V562 HydrophobicContact CG-CG2 4.45Å; S560-V562 PolarHBondContact O-N 2.97Å; V562-V564 HydrophobicContact CG1-CG2 4.15Å; V562-V564 HydrophobicContact CG2-CG2 4.22Å; V562-A573 HydrophobicContact CG2-CB 4.29Å
563	G	95.8	Very high	96.2	Very high	4 Å²	4	29.3 Å²	29.3	4%	0.041	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	135.9	169.7	0	0	0	0	0	109.7	I574	G563-I574 PolarHBondContact N-O 2.85Å; G563-I574 VanDerWaalsContact O-CD1 3.29Å; G563-I574 WeakPolarHBondContact O-CD1 3.24Å; G563-I574 PolarHBondContact O-N 2.84Å
564	V	97.3	Very high	96.1	Very high	15 Å²	15	28 Å²	28	9%	0.091	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	132.4	-179.9	173.1	0	0	0	0	110.4	A518 V527 V562 L571 Y572 A573	A518-V564 HydrophobicContact CB-CG1 4.06Å; V527-V564 HydrophobicContact CB-CG1 4.46Å; V527-V564 HydrophobicContact CB-CG2 3.91Å; V527-V564 HydrophobicContact CG1-CG2 3.97Å; V527-V564 HydrophobicContact CG2-CG1 4.01Å; V527-V564 HydrophobicContact CG2-CG2 4.33Å; V562-V564 HydrophobicContact CG1-CG2 4.15Å; V562-V564 HydrophobicContact CG2-CG2 4.22Å; V564-L571 HydrophobicContact CG1-CD1 3.58Å; V564-L571 HydrophobicContact CG1-CG 4.15Å; V564-Y572 VanDerWaalsContact CA-O 3.29Å; V564-Y572 WeakPolarHBondContact CA-O 3.28Å; V564-A573 HydrophobicContact CG2-CB 4.41Å
565	V	96.9	Very high	96	Very high	17 Å²	17	25.6 Å²	25.6	10%	0.103	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	151.3	-179.2	71.5	0	0	0	0	111.6	Y572 I574 V611 T613 L618	V565-Y572 PolarHBondContact N-O 3.28Å; V565-Y572 VanDerWaalsContact N-O 3.17Å; V565-Y572 PolarHBondContact O-N 2.99Å; V565-I574 HydrophobicContact CG1-CD1 4.22Å; V565-V611 HydrophobicContact CB-CG2 4.23Å; V565-T613 HydrophobicContact CB-CG2 4.33Å; V565-T613 HydrophobicContact CG1-CG2 3.76Å; V565-T613 HydrophobicContact CG2-CG2 3.58Å; V565-L618 HydrophobicContact CG1-CD1 3.54Å; V565-L618 HydrophobicContact CG1-CG 3.92Å
566	A	96.3	Very high	95.8	Very high	27 Å²	27	25.4 Å²	25.4	22%	0.223	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	133.8	174.6	0	0	0	0	0	111.7	T519 L520 K570 T613	T519-A566 VanDerWaalsContact O-CB 3.3Å; T519-A566 WeakPolarHBondContact O-CB 3.29Å; L520-A566 HydrophobicContact CB-CB 4.29Å; L520-A566 HydrophobicContact CD1-CB 4.21Å; A566-K570 CarbonylContact C-O 3.55Å; A566-K570 WeakPolarHBondContact CA-O 3.4Å; A566-T613 PolarHBondContact O-OG1 3.06Å
567	L	95.1	Very high	95.6	Very high	15 Å²	15	25.1 Å²	25.1	8%	0.079	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	135	176.1	-176.9	58.3	0	0	0	109.7	N569 K570 Y572 T613 L618 P644	L567-N569 VanDerWaalsContact C-N 3.3Å; L567-N569 PolarHBondContact O-N 2.83Å; L567-K570 PolarHBondContact N-O 2.81Å; L567-K570 PolarHBondContact O-N 2.83Å; L567-K570 VanDerWaalsContact O-O 3.1Å; L567-Y572 HydrophobicContact CB-CD2 4.05Å; L567-Y572 HydrophobicContact CB-CE2 3.83Å; L567-T613 HydrophobicContact CB-CG2 3.85Å; L567-T613 HydrophobicContact CD1-CG2 4.09Å; L567-T613 HydrophobicContact CD2-CG2 4.23Å; L567-T613 HydrophobicContact CG-CG2 4.28Å; L567-L618 HydrophobicContact CD2-CB 4Å; L567-P644 HydrophobicContact CD2-CB 4.47Å; L567-P644 HydrophobicContact CD2-CG 3.92Å
568	N	91.1	Very high	95.3	Very high	92 Å²	92	25.8 Å²	25.8	49%	0.492	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.8	51.1	174.7	-55.9	-16.8	0	0	0	113.1	K570 P644	N568-K570 PolarHBondContact O-N 3.19Å; N568-P644 WeakPolarHBondContact ND2-CG 3.27Å
569	N	93.1	Very high	94.8	Very high	98 Å²	98	25.8 Å²	25.8	52%	0.524	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	23.2	-178.6	-62.2	37.7	0	0	0	115.4	E521 L567	E521-N569 WeakPolarHBondContact OE1-CB 3.39Å; E521-N569 PolarHBondContact OE1-ND2 2.84Å; L567-N569 VanDerWaalsContact C-N 3.3Å; L567-N569 PolarHBondContact O-N 2.83Å
570	K	96.7	Very high	94.2	Very high	60 Å²	60	29.9 Å²	29.9	26%	0.261	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	149.9	176.2	-70.1	171.3	170.6	-168.2	0	111	A566 L567 N568 Y572 Y588 F589	A566-K570 CarbonylContact C-O 3.55Å; A566-K570 WeakPolarHBondContact CA-O 3.4Å; L567-K570 PolarHBondContact N-O 2.81Å; L567-K570 PolarHBondContact O-N 2.83Å; L567-K570 VanDerWaalsContact O-O 3.1Å; N568-K570 PolarHBondContact O-N 3.19Å; K570-Y572 HydrophobicContact CB-CD2 4.43Å; K570-Y572 HydrophobicContact CB-CE2 3.77Å; K570-Y588 HydrophobicContact CB-CD2 4.34Å; K570-Y588 HydrophobicContact CD-CD2 3.58Å; K570-Y588 HydrophobicContact CD-CE2 3.71Å; K570-Y588 HydrophobicContact CD-CG 4.39Å; K570-Y588 HydrophobicContact CG-CD2 4.13Å; K570-Y588 PolarHBondContact NZ-OH 3.41Å; K570-F589 WeakPolarHBondContact CA-O 3.14Å
571	L	98	Very high	93.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	117	178.5	-179.8	71.1	0	0	0	109.4	A518 L520 Y525 V527 V564 Y588 F589 W596	A518-L571 HydrophobicContact CB-CD1 3.88Å; L520-L571 HydrophobicContact CD2-CB 3.88Å; Y525-L571 HydrophobicContact CD1-CD2 4.05Å; Y525-L571 HydrophobicContact CD2-CD2 4.33Å; Y525-L571 HydrophobicContact CG-CD2 3.73Å; V527-L571 HydrophobicContact CG2-CD2 3.78Å; V564-L571 HydrophobicContact CG1-CD1 3.58Å; V564-L571 HydrophobicContact CG1-CG 4.15Å; L571-Y588 CarbonylContact O-C 3.52Å; L571-Y588 WeakPolarHBondContact O-CA 3.42Å; L571-F589 HydrophobicContact CB-CB 4.24Å; L571-F589 HydrophobicContact CB-CD1 4.47Å; L571-F589 PolarHBondContact N-O 2.91Å; L571-F589 PolarHBondContact O-N 3.11Å; L571-W596 HydrophobicContact CD2-CH2 4.43Å
572	Y	98.1	Very high	93.8	Very high	9 Å²	9	29.6 Å²	29.6	4%	0.035	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	138.4	-178.4	-68.9	-101.6	0	0	0	110.6	V564 V565 L567 K570 I574 M586 E587 Y588 L618 Y642	V564-Y572 VanDerWaalsContact CA-O 3.29Å; V564-Y572 WeakPolarHBondContact CA-O 3.28Å; V565-Y572 PolarHBondContact N-O 3.28Å; V565-Y572 VanDerWaalsContact N-O 3.17Å; V565-Y572 PolarHBondContact O-N 2.99Å; L567-Y572 HydrophobicContact CB-CD2 4.05Å; L567-Y572 HydrophobicContact CB-CE2 3.83Å; K570-Y572 HydrophobicContact CB-CD2 4.43Å; K570-Y572 HydrophobicContact CB-CE2 3.77Å; Y572-I574 WeakPolarHBondContact O-CD1 3.42Å; Y572-M586 HydrophobicContact CD1-CE 4.11Å; Y572-M586 HydrophobicContact CD1-CG 4.25Å; Y572-M586 HydrophobicContact CD1-SD 3.79Å; Y572-M586 HydrophobicContact CE1-CE 4.4Å; Y572-E587 WeakPolarHBondContact CA-O 3.48Å; Y572-Y588 HydrophobicContact CE1-CG 4.38Å; Y572-L618 HydrophobicContact CD1-CD1 4.33Å; Y572-L618 HydrophobicContact CD2-CD1 4.49Å; Y572-L618 HydrophobicContact CG-CD1 3.97Å; Y572-Y642 AromaticContact CE1-CE1 3.96Å; Y572-Y642 HydrophobicContact CE1-CE1 3.96Å
573	A	97.9	Very high	93.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	116.7	173.5	0	0	0	0	0	109.5	V527 M555 V562 V564 M586 E587 W596	V527-A573 HydrophobicContact CG1-CB 4.19Å; M555-A573 HydrophobicContact SD-CB 3.64Å; V562-A573 HydrophobicContact CG2-CB 4.29Å; V564-A573 HydrophobicContact CG2-CB 4.41Å; A573-M586 WeakPolarHBondContact O-CA 3.36Å; A573-E587 PolarHBondContact N-O 3.02Å; A573-E587 PolarHBondContact O-N 3.1Å; A573-W596 HydrophobicContact CB-CH2 3.82Å; A573-W596 HydrophobicContact CB-CZ3 3.63Å
574	I	97	Very high	93.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	126.9	-162.3	-45.8	91.1	0	0	0	110.7	G563 V565 Y572 M586 M602 V611 L618 V620 W649	G563-I574 PolarHBondContact N-O 2.85Å; G563-I574 VanDerWaalsContact O-CD1 3.29Å; G563-I574 WeakPolarHBondContact O-CD1 3.24Å; G563-I574 PolarHBondContact O-N 2.84Å; V565-I574 HydrophobicContact CG1-CD1 4.22Å; Y572-I574 WeakPolarHBondContact O-CD1 3.42Å; I574-M586 HydrophobicContact CB-SD 4.45Å; I574-M586 HydrophobicContact CG1-CG 3.94Å; I574-M586 HydrophobicContact CG1-SD 3.53Å; I574-M586 VanDerWaalsContact CG1-SD 3.53Å; I574-M586 HydrophobicContact CG2-SD 4.26Å; I574-M602 HydrophobicContact CG2-CE 4.1Å; I574-M602 HydrophobicContact CG2-SD 3.73Å; I574-V611 HydrophobicContact CB-CG1 4.46Å; I574-V611 HydrophobicContact CD1-CG1 4.36Å; I574-V611 HydrophobicContact CD1-CG2 4.47Å; I574-L618 HydrophobicContact CD1-CD1 4.03Å; I574-L618 HydrophobicContact CG1-CD1 4.18Å; I574-L618 HydrophobicContact CG1-CD2 4.37Å; I574-V620 HydrophobicContact CG2-CG2 3.8Å; I574-W649 HydrophobicContact CG2-CH2 4.18Å; I574-W649 HydrophobicContact CG2-CZ2 4.49Å
575	G	95.3	Very high	93.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.196	C	C	.	.			trans	59.5	-137.2	175.8	0	0	0	0	0	112.9	R559 S585	R559-G575 PolarHBondContact NH1-O 2.93Å; G575-S585 PolarHBondContact N-O 3.03Å
576	G	93.7	Very high	93.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.191	C	C	.	.			trans	91.6	-162.4	-175.4	0	0	0	0	0	112.7	S560 T561 C582 L583 R606	S560-G576 CarbonylContact O-C 3.57Å; S560-G576 WeakPolarHBondContact O-CA 3.31Å; T561-G576 WeakPolarHBondContact O-CA 3.49Å; G576-C582 CarbonylContact O-C 3.49Å; G576-C582 WeakPolarHBondContact O-CA 3.38Å; G576-L583 PolarHBondContact O-N 2.89Å; G576-R606 PolarHBondContact N-O 3.06Å
577	R	91.9	Very high	93.7	Very high	75 Å²	75	32.3 Å²	32.3	28%	0.283	18%	0.181	S	C	.	.	B	Isolated β-bridge	trans	-129.6	140.2	178.2	-76.7	177.8	-79.1	-157.3	-10	110.9	Y535 R559 S560 T561 S581 C582 H624	Y535-R577 WeakPolarHBondContact CD1-O 3.26Å; Y535-R577 HydrophobicContact CE1-CB 4.32Å; R559-R577 CarbonylContact C-O 3.59Å; R559-R577 WeakPolarHBondContact CA-O 3.37Å; S560-R577 PolarHBondContact N-O 2.93Å; S560-R577 PolarHBondContact O-N 3.01Å; T561-R577 PolarHBondContact OG1-NE 2.74Å; T561-R577 PolarHBondContact OG1-NH2 3.03Å; T561-R577 VanDerWaalsContact OG1-NH2 3.1Å; R577-S581 WeakPolarHBondContact CA-O 3.45Å; R577-C582 HydrophobicContact CG-CB 4.5Å; R577-H624 VanDerWaalsContact CZ-CE1 3.43Å; R577-H624 PolarHBondContact NH1-NE2 3.4Å; R577-H624 VanDerWaalsContact NH1-NE2 3.16Å; R577-H624 PolarHBondContact NH2-CE1 3.04Å
578	D	90.6	Very high	93.9	Very high	45 Å²	45	34.2 Å²	34.2	24%	0.241	19%	0.187	C	C	.	.			trans	-96.9	-1.5	177.6	57.8	12.2	0	0	0	113.4	S580 S581 L583	D578-S580 WeakPolarHBondContact OD1-CA 3.16Å; D578-S580 WeakPolarHBondContact OD1-CB 3.46Å; D578-S580 PolarHBondContact OD1-N 2.94Å; D578-S581 PolarHBondContact N-O 2.76Å; D578-S581 PolarHBondContact OD1-N 2.81Å; D578-L583 HydrophobicContact CB-CD1 4.34Å; D578-L583 HydrophobicContact CB-CD2 4.19Å; D578-L583 HydrophobicContact CB-CG 4.45Å; D578-L583 WeakPolarHBondContact OD2-CD2 3.34Å
579	G	84.7	Confident	94.2	Very high	43 Å²	43	30 Å²	30	44%	0.443	16%	0.164	S	C	.	.	S	Bend	trans	96.9	-14.2	-173.2	0	0	0	0	0	114.6	Y535	Y535-G579 VanDerWaalsContact CE2-CA 3.42Å
580	S	85.1	Confident	94.4	Very high	87 Å²	87	26.5 Å²	26.5	61%	0.608	15%	0.146	S	C	*	.	S	Bend	trans	-108.6	-36.8	174.4	-63.1	0	0	0	0	112.9	D578 A628	D578-S580 WeakPolarHBondContact OD1-CA 3.16Å; D578-S580 WeakPolarHBondContact OD1-CB 3.46Å; D578-S580 PolarHBondContact OD1-N 2.94Å; S580-A628 WeakPolarHBondContact O-CB 3.4Å
581	S	88.7	Confident	94.3	Very high	26 Å²	26	25 Å²	25	18%	0.182	14%	0.142	C	C	.	.	S	Bend	trans	-155.5	164.5	-175.3	69.1	0	0	0	0	113.5	R577 D578 R605	R577-S581 WeakPolarHBondContact CA-O 3.45Å; D578-S581 PolarHBondContact N-O 2.76Å; D578-S581 PolarHBondContact OD1-N 2.81Å; S581-R605 PolarHBondContact OG-NH1 3.43Å
582	C	92.1	Very high	94.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-69.4	136.6	161.7	-70.5	0	0	0	0	110.5	G576 R577 R605 H624 A626	G576-C582 CarbonylContact O-C 3.49Å; G576-C582 WeakPolarHBondContact O-CA 3.38Å; R577-C582 HydrophobicContact CG-CB 4.5Å; C582-R605 HydrophobicContact CB-CB 4.05Å; C582-R605 WeakPolarHBondContact O-CB 3.27Å; C582-R605 VanDerWaalsContact O-CD 3.28Å; C582-R605 WeakPolarHBondContact O-CD 3.45Å; C582-R605 VanDerWaalsContact O-CG 3.27Å; C582-R605 WeakPolarHBondContact O-CG 3.34Å; C582-R605 PolarHBondContact O-NH1 2.82Å; C582-H624 PolarHBondContact SG-O 3.44Å; C582-A626 PolarHBondContact SG-N 2.74Å; C582-A626 VanDerWaalsContact SG-N 3.44Å
583	L	93.8	Very high	94	Very high	11 Å²	11	34.9 Å²	34.9	6%	0.058	19%	0.194	C	C	.	.			trans	-90	150.8	-176.4	-65.4	173	0	0	0	111.5	T557 R559 G576 D578 R605 R606	T557-L583 HydrophobicContact CG2-CD1 3.77Å; T557-L583 HydrophobicContact CG2-CD2 4.17Å; R559-L583 HydrophobicContact CG-CD1 3.85Å; G576-L583 PolarHBondContact O-N 2.89Å; D578-L583 HydrophobicContact CB-CD1 4.34Å; D578-L583 HydrophobicContact CB-CD2 4.19Å; D578-L583 HydrophobicContact CB-CG 4.45Å; D578-L583 WeakPolarHBondContact OD2-CD2 3.34Å; L583-R605 WeakPolarHBondContact O-CA 3.33Å; L583-R606 PolarHBondContact O-N 2.79Å
584	K	94.8	Very high	94	Very high	87 Å²	87	38.6 Å²	38.6	38%	0.378	21%	0.214	S	C	.	.			trans	-115.6	-6.8	166.6	72	172.5	-158.4	154.3	0	113.9	P601 M602 K604 R605	K584-P601 HydrophobicContact CD-CB 4.32Å; K584-P601 HydrophobicContact CG-CB 4.05Å; K584-P601 CarbonylContact O-C 3.55Å; K584-P601 VanDerWaalsContact O-CA 3.25Å; K584-P601 WeakPolarHBondContact O-CA 3.23Å; K584-P601 VanDerWaalsContact O-CB 3.31Å; K584-P601 WeakPolarHBondContact O-CB 3.33Å; K584-M602 HydrophobicContact CB-CB 4.46Å; K584-M602 PolarHBondContact O-N 3.02Å; K584-K604 VanDerWaalsContact CB-O 3.32Å; K584-K604 WeakPolarHBondContact CB-O 3.42Å; K584-R605 HydrophobicContact CB-CG 4.03Å; K584-R605 HydrophobicContact CG-CG 4.41Å
585	S	96.2	Very high	94	Very high	29 Å²	29	44.8 Å²	44.8	20%	0.203	24%	0.241	C	C	.	.			trans	-73.8	148.4	177.6	54.3	0	0	0	0	110.9	R559 G575	R559-S585 PolarHBondContact NH1-O 3.2Å; R559-S585 PolarHBondContact NH2-OG 3.42Å; G575-S585 PolarHBondContact N-O 3.03Å
586	M	96.9	Very high	94.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	142.3	169.9	177.3	165.7	69.8	0	0	108.7	Y572 A573 I574 C599 L618 Y642 W649	Y572-M586 HydrophobicContact CD1-CE 4.11Å; Y572-M586 HydrophobicContact CD1-CG 4.25Å; Y572-M586 HydrophobicContact CD1-SD 3.79Å; Y572-M586 HydrophobicContact CE1-CE 4.4Å; A573-M586 WeakPolarHBondContact O-CA 3.36Å; I574-M586 HydrophobicContact CB-SD 4.45Å; I574-M586 HydrophobicContact CG1-CG 3.94Å; I574-M586 HydrophobicContact CG1-SD 3.53Å; I574-M586 VanDerWaalsContact CG1-SD 3.53Å; I574-M586 HydrophobicContact CG2-SD 4.26Å; M586-C599 HydrophobicContact CB-CB 4.18Å; M586-C599 HydrophobicContact CE-CB 3.49Å; M586-C599 VanDerWaalsContact CE-CB 3.49Å; M586-C599 HydrophobicContact CG-CB 4.17Å; M586-C599 PolarHBondContact O-N 2.95Å; M586-L618 HydrophobicContact SD-CD1 4.23Å; M586-Y642 HydrophobicContact CE-CD1 3.75Å; M586-Y642 HydrophobicContact CE-CD2 3.65Å; M586-Y642 HydrophobicContact CE-CE1 3.65Å; M586-Y642 HydrophobicContact CE-CE2 3.54Å; M586-Y642 HydrophobicContact CE-CG 3.75Å; M586-W649 HydrophobicContact CE-CH2 4.4Å; M586-W649 HydrophobicContact CE-CZ2 3.57Å; M586-W649 HydrophobicContact SD-CH2 4.19Å; M586-W649 HydrophobicContact SD-CZ2 3.73Å
587	E	97.8	Very high	94.4	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.009	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	148.6	172	-65.9	168.8	-101.8	0	0	108.7	S556 T557 R559 Y572 A573 W596 S597 L598	S556-E587 VanDerWaalsContact CB-OE2 3.31Å; S556-E587 WeakPolarHBondContact CB-OE2 3.26Å; S556-E587 PolarHBondContact N-OE2 2.92Å; S556-E587 PolarHBondContact OG-OE1 3.23Å; S556-E587 PolarHBondContact OG-OE2 3.31Å; T557-E587 PolarHBondContact N-OE1 2.81Å; T557-E587 PolarHBondContact OG1-OE1 3.06Å; R559-E587 IonicContact CZ-OE1 3.84Å; R559-E587 IonicContact NE-OE1 2.66Å; R559-E587 PolarHBondContact NE-OE1 2.87Å; R559-E587 VanDerWaalsContact NE-OE1 3.14Å; R559-E587 IonicContact NH2-OE1 3.52Å; R559-E587 PolarHBondContact NH2-OE1 2.99Å; Y572-E587 WeakPolarHBondContact CA-O 3.48Å; A573-E587 PolarHBondContact N-O 3.02Å; A573-E587 PolarHBondContact O-N 3.1Å; E587-W596 HydrophobicContact CB-CE3 3.7Å; E587-W596 HydrophobicContact CB-CZ3 4.25Å; E587-S597 CarbonylContact C-O 3.51Å; E587-S597 VanDerWaalsContact CA-O 3.23Å; E587-S597 WeakPolarHBondContact CA-O 3.46Å; E587-L598 HydrophobicContact CG-CD2 3.68Å; E587-L598 HydrophobicContact CG-CG 4.36Å
588	Y	97.8	Very high	94.6	Very high	54 Å²	54	50.5 Å²	50.5	21%	0.212	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	146.1	169.5	77.1	-94.3	0	0	0	111	K570 L571 Y572 W596 S597 C599	K570-Y588 HydrophobicContact CB-CD2 4.34Å; K570-Y588 HydrophobicContact CD-CD2 3.58Å; K570-Y588 HydrophobicContact CD-CE2 3.71Å; K570-Y588 HydrophobicContact CD-CG 4.39Å; K570-Y588 HydrophobicContact CG-CD2 4.13Å; K570-Y588 PolarHBondContact NZ-OH 3.41Å; L571-Y588 CarbonylContact O-C 3.52Å; L571-Y588 WeakPolarHBondContact O-CA 3.42Å; Y572-Y588 HydrophobicContact CE1-CG 4.38Å; Y588-W596 CarbonylContact O-C 3.59Å; Y588-W596 VanDerWaalsContact O-CA 3.24Å; Y588-W596 WeakPolarHBondContact O-CA 3.47Å; Y588-S597 PolarHBondContact N-O 3.2Å; Y588-S597 PolarHBondContact O-N 2.75Å; Y588-C599 VanDerWaalsContact CD1-SG 3.6Å
589	F	98.3	Very high	94.9	Very high	3 Å²	3	49.1 Å²	49.1	1%	0.013	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	132.7	172	176.8	-105	0	0	0	110	Y525 V552 A553 K570 L571 P591 N594 K595 W596	Y525-F589 HydrophobicContact CE1-CD1 4.45Å; Y525-F589 AromaticContact CE1-CE1 3.83Å; Y525-F589 HydrophobicContact CE1-CE1 3.83Å; V552-F589 HydrophobicContact CB-CE2 4.33Å; V552-F589 HydrophobicContact CB-CZ 4Å; V552-F589 HydrophobicContact CG1-CZ 4.47Å; V552-F589 HydrophobicContact CG2-CE2 4.29Å; V552-F589 HydrophobicContact CG2-CZ 4.07Å; A553-F589 HydrophobicContact CB-CE2 4.24Å; K570-F589 WeakPolarHBondContact CA-O 3.14Å; L571-F589 HydrophobicContact CB-CB 4.24Å; L571-F589 HydrophobicContact CB-CD1 4.47Å; L571-F589 PolarHBondContact N-O 2.91Å; L571-F589 PolarHBondContact O-N 3.11Å; F589-P591 HydrophobicContact CE1-CB 3.96Å; F589-N594 WeakPolarHBondContact CE2-OD1 3.08Å; F589-K595 WeakPolarHBondContact CA-O 3.44Å; F589-W596 HydrophobicContact CB-CD2 3.72Å; F589-W596 HydrophobicContact CB-CE3 3.79Å; F589-W596 HydrophobicContact CB-CG 4.41Å; F589-W596 HydrophobicContact CB-CH2 3.71Å; F589-W596 HydrophobicContact CB-CZ2 3.61Å; F589-W596 HydrophobicContact CB-CZ3 3.8Å; F589-W596 AromaticContact CD2-CD1 3.9Å; F589-W596 HydrophobicContact CD2-CD2 4.31Å; F589-W596 AromaticContact CD2-CE2 3.92Å; F589-W596 HydrophobicContact CD2-CG 4.3Å; F589-W596 HydrophobicContact CD2-CZ2 4.44Å; F589-W596 AromaticContact CD2-NE1 3.64Å; F589-W596 HydrophobicContact CG-CD2 4.49Å; F589-W596 HydrophobicContact CG-CZ2 4.2Å
590	D	96.9	Very high	95.5	Very high	26 Å²	26	48.1 Å²	48.1	14%	0.139	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	119.1	166.5	164.8	37.2	0	0	0	109.5	H592 T593 N594 K595	D590-H592 VanDerWaalsContact C-N 3.25Å; D590-H592 PolarHBondContact O-N 2.86Å; D590-H592 WeakPolarHBondContact OD1-CB 3.36Å; D590-H592 IonicContact OD1-CG 3.34Å; D590-H592 PolarHBondContact OD1-N 2.89Å; D590-H592 IonicContact OD1-ND1 3.18Å; D590-H592 PolarHBondContact OD1-ND1 3.47Å; D590-T593 VanDerWaalsContact OD2-CB 3.28Å; D590-T593 WeakPolarHBondContact OD2-CB 3.11Å; D590-T593 VanDerWaalsContact OD2-CG2 3.25Å; D590-T593 WeakPolarHBondContact OD2-CG2 3.48Å; D590-T593 PolarHBondContact OD2-N 3.31Å; D590-T593 PolarHBondContact OD2-OG1 3.02Å; D590-N594 WeakPolarHBondContact O-CA 3.16Å; D590-N594 PolarHBondContact O-N 3.13Å; D590-K595 PolarHBondContact N-O 2.69Å; D590-K595 VanDerWaalsContact N-O 3.08Å; D590-K595 PolarHBondContact O-N 3.34Å
591	P	95.1	Very high	96	Very high	27 Å²	27	47 Å²	47	18%	0.175	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-24	179.7	28.8	-35.1	0	0	0	113.1	L520 E521 F589	L520-P591 HydrophobicContact CD2-CG 3.95Å; E521-P591 WeakPolarHBondContact OE2-CG 3.39Å; F589-P591 HydrophobicContact CE1-CB 3.96Å
592	H	94.3	Very high	96.3	Very high	138 Å²	138	45.8 Å²	45.8	64%	0.639	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-42.3	-177.9	-57	83.5	0	0	0	112	E521 D590	E521-H592 IonicContact OE1-CE1 2.73Å; E521-H592 IonicContact OE2-CE1 2.75Å; D590-H592 VanDerWaalsContact C-N 3.25Å; D590-H592 PolarHBondContact O-N 2.86Å; D590-H592 WeakPolarHBondContact OD1-CB 3.36Å; D590-H592 IonicContact OD1-CG 3.34Å; D590-H592 PolarHBondContact OD1-N 2.89Å; D590-H592 IonicContact OD1-ND1 3.18Å; D590-H592 PolarHBondContact OD1-ND1 3.47Å
593	T	96.3	Very high	96.3	Very high	80 Å²	80	49.3 Å²	49.3	49%	0.491	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-7.4	175.9	59.5	0	0	0	0	114	D590 K595	D590-T593 VanDerWaalsContact OD2-CB 3.28Å; D590-T593 WeakPolarHBondContact OD2-CB 3.11Å; D590-T593 VanDerWaalsContact OD2-CG2 3.25Å; D590-T593 WeakPolarHBondContact OD2-CG2 3.48Å; D590-T593 PolarHBondContact OD2-N 3.31Å; D590-T593 PolarHBondContact OD2-OG1 3.02Å; T593-K595 WeakPolarHBondContact O-CG 3.45Å; T593-K595 PolarHBondContact O-N 2.9Å
594	N	96.7	Very high	96	Very high	78 Å²	78	53.2 Å²	53.2	42%	0.417	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	53.1	-174.3	-173.8	22.8	0	0	0	111.7	A553 F589 D590	A553-N594 WeakPolarHBondContact CB-O 3.36Å; A553-N594 WeakPolarHBondContact CB-OD1 3.48Å; A553-N594 PolarHBondContact N-OD1 3.37Å; F589-N594 WeakPolarHBondContact CE2-OD1 3.08Å; D590-N594 WeakPolarHBondContact O-CA 3.16Å; D590-N594 PolarHBondContact O-N 3.13Å
595	K	97.8	Very high	95.8	Very high	130 Å²	130	54.1 Å²	54.1	57%	0.565	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.1	144.6	-176.3	-76.2	172.4	-172.3	175.6	0	111.9	F589 D590 T593	F589-K595 WeakPolarHBondContact CA-O 3.44Å; D590-K595 PolarHBondContact N-O 2.69Å; D590-K595 VanDerWaalsContact N-O 3.08Å; D590-K595 PolarHBondContact O-N 3.34Å; T593-K595 WeakPolarHBondContact O-CG 3.45Å; T593-K595 PolarHBondContact O-N 2.9Å
596	W	98.3	Very high	95.5	Very high	28 Å²	28	52.9 Å²	52.9	11%	0.106	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	151.4	163.8	-70.3	89.3	0	0	0	111	V527 V539 A553 M555 L571 A573 E587 Y588 F589	V527-W596 HydrophobicContact CG1-CH2 4.25Å; V527-W596 HydrophobicContact CG1-CZ2 4.38Å; V539-W596 HydrophobicContact CG2-CZ2 3.84Å; A553-W596 VanDerWaalsContact O-CD1 3.28Å; A553-W596 PolarHBondContact O-NE1 2.58Å; M555-W596 HydrophobicContact CB-CD2 4.48Å; M555-W596 HydrophobicContact CG-CD2 3.69Å; M555-W596 HydrophobicContact CG-CE3 4.02Å; M555-W596 HydrophobicContact CG-CG 4.25Å; M555-W596 HydrophobicContact CG-CH2 4.11Å; M555-W596 HydrophobicContact CG-CZ2 3.78Å; M555-W596 HydrophobicContact CG-CZ3 4.22Å; M555-W596 HydrophobicContact SD-CH2 4.31Å; M555-W596 HydrophobicContact SD-CZ2 4.41Å; L571-W596 HydrophobicContact CD2-CH2 4.43Å; A573-W596 HydrophobicContact CB-CH2 3.82Å; A573-W596 HydrophobicContact CB-CZ3 3.63Å; E587-W596 HydrophobicContact CB-CE3 3.7Å; E587-W596 HydrophobicContact CB-CZ3 4.25Å; Y588-W596 CarbonylContact O-C 3.59Å; Y588-W596 VanDerWaalsContact O-CA 3.24Å; Y588-W596 WeakPolarHBondContact O-CA 3.47Å; F589-W596 HydrophobicContact CB-CD2 3.72Å; F589-W596 HydrophobicContact CB-CE3 3.79Å; F589-W596 HydrophobicContact CB-CG 4.41Å; F589-W596 HydrophobicContact CB-CH2 3.71Å; F589-W596 HydrophobicContact CB-CZ2 3.61Å; F589-W596 HydrophobicContact CB-CZ3 3.8Å; F589-W596 AromaticContact CD2-CD1 3.9Å; F589-W596 HydrophobicContact CD2-CD2 4.31Å; F589-W596 AromaticContact CD2-CE2 3.92Å; F589-W596 HydrophobicContact CD2-CG 4.3Å; F589-W596 HydrophobicContact CD2-CZ2 4.44Å; F589-W596 AromaticContact CD2-NE1 3.64Å; F589-W596 HydrophobicContact CG-CD2 4.49Å; F589-W596 HydrophobicContact CG-CZ2 4.2Å
597	S	97.8	Very high	95	Very high	51 Å²	51	52.9 Å²	52.9	36%	0.357	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	146.8	175	-72.1	0	0	0	0	110.3	E587 Y588	E587-S597 CarbonylContact C-O 3.51Å; E587-S597 VanDerWaalsContact CA-O 3.23Å; E587-S597 WeakPolarHBondContact CA-O 3.46Å; Y588-S597 PolarHBondContact N-O 3.2Å; Y588-S597 PolarHBondContact O-N 2.75Å
598	L	97.3	Very high	94.5	Very high	116 Å²	116	53.3 Å²	53.3	61%	0.607	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	146.1	179.6	-73.4	160	0	0	0	111.4	E587	E587-L598 HydrophobicContact CG-CD2 3.68Å; E587-L598 HydrophobicContact CG-CG 4.36Å
599	C	96.5	Very high	94.1	Very high	15 Å²	15	51.4 Å²	51.4	10%	0.101	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	171.7	165.7	-84.3	0	0	0	0	110.5	M586 Y588 Y642	M586-C599 HydrophobicContact CB-CB 4.18Å; M586-C599 HydrophobicContact CE-CB 3.49Å; M586-C599 VanDerWaalsContact CE-CB 3.49Å; M586-C599 HydrophobicContact CG-CB 4.17Å; M586-C599 PolarHBondContact O-N 2.95Å; Y588-C599 VanDerWaalsContact CD1-SG 3.6Å; C599-Y642 PolarHBondContact SG-OH 2.9Å
600	A	96.9	Very high	93.9	Very high	22 Å²	22	51.3 Å²	51.3	18%	0.182	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-51.8	134.5	166.5	0	0	0	0	0	111.5	D647 W649	A600-D647 WeakPolarHBondContact CB-O 3.47Å; A600-D647 WeakPolarHBondContact CB-OD1 3.49Å; A600-D647 PolarHBondContact N-OD1 3.24Å; A600-D647 PolarHBondContact N-OD2 2.78Å; A600-W649 PolarHBondContact O-NE1 2.82Å
601	P	96.7	Very high	93.9	Very high	64 Å²	64	51.1 Å²	51.1	42%	0.416	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-76.1	151.6	179.1	31.2	-34.8	0	0	0	111.9	K584 W649	K584-P601 HydrophobicContact CD-CB 4.32Å; K584-P601 HydrophobicContact CG-CB 4.05Å; K584-P601 CarbonylContact O-C 3.55Å; K584-P601 VanDerWaalsContact O-CA 3.25Å; K584-P601 WeakPolarHBondContact O-CA 3.23Å; K584-P601 VanDerWaalsContact O-CB 3.31Å; K584-P601 WeakPolarHBondContact O-CB 3.33Å; P601-W649 VanDerWaalsContact O-CD1 3.24Å
602	M	95.1	Very high	94	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-58	158.6	168.7	-63.2	179.7	-63.4	0	0	111.1	I574 K584 K604 R606 V620 W649	I574-M602 HydrophobicContact CG2-CE 4.1Å; I574-M602 HydrophobicContact CG2-SD 3.73Å; K584-M602 HydrophobicContact CB-CB 4.46Å; K584-M602 PolarHBondContact O-N 3.02Å; M602-K604 VanDerWaalsContact C-N 3.34Å; M602-K604 WeakPolarHBondContact CB-O 3.4Å; M602-R606 HydrophobicContact CE-CB 4.25Å; M602-R606 HydrophobicContact CE-CG 4.34Å; M602-V620 HydrophobicContact SD-CB 4.29Å; M602-V620 HydrophobicContact SD-CG1 3.88Å; M602-V620 HydrophobicContact SD-CG2 4Å; M602-W649 HydrophobicContact CG-CD2 4.1Å; M602-W649 HydrophobicContact CG-CE3 4.3Å; M602-W649 HydrophobicContact CG-CH2 3.72Å; M602-W649 HydrophobicContact CG-CZ2 3.48Å; M602-W649 VanDerWaalsContact CG-CZ2 3.48Å; M602-W649 HydrophobicContact CG-CZ3 4.12Å; M602-W649 HydrophobicContact SD-CH2 4.21Å; M602-W649 HydrophobicContact SD-CZ2 4.46Å
603	S	91.6	Very high	94	Very high	75 Å²	75	45 Å²	45	52%	0.524	25%	0.246	S	C	.	.	S	Bend	trans	-67.1	-37.1	174.7	67.9	0	0	0	0	111.8	E640	S603-E640 VanDerWaalsContact CB-OE2 3.26Å; S603-E640 WeakPolarHBondContact CB-OE2 3.37Å; S603-E640 PolarHBondContact N-OE2 3.16Å; S603-E640 PolarHBondContact OG-OE2 3.19Å
604	K	87.4	Confident	93.8	Very high	92 Å²	92	41.8 Å²	41.8	40%	0.4	23%	0.225	S	C	.	.	S	Bend	trans	-112.1	155	-179	-66.5	173.1	-177.2	171.5	0	112	K584 M602 R606 C638	K584-K604 VanDerWaalsContact CB-O 3.32Å; K584-K604 WeakPolarHBondContact CB-O 3.42Å; M602-K604 VanDerWaalsContact C-N 3.34Å; M602-K604 WeakPolarHBondContact CB-O 3.4Å; K604-R606 HydrophobicContact CB-CG 4.49Å; K604-C638 HydrophobicContact CD-CB 4.37Å; K604-C638 VanDerWaalsContact NZ-CB 3.27Å; K604-C638 PolarHBondContact NZ-SG 3.1Å
605	R	89.6	Confident	93.3	Very high	107 Å²	107	41.7 Å²	41.7	40%	0.404	23%	0.225	S	C	.	.			trans	-81.8	136.8	169.2	-72.7	172.6	175.5	-90.6	6.6	109	S581 C582 L583 K584 D625	S581-R605 PolarHBondContact OG-NH1 3.43Å; C582-R605 HydrophobicContact CB-CB 4.05Å; C582-R605 WeakPolarHBondContact O-CB 3.27Å; C582-R605 VanDerWaalsContact O-CD 3.28Å; C582-R605 WeakPolarHBondContact O-CD 3.45Å; C582-R605 VanDerWaalsContact O-CG 3.27Å; C582-R605 WeakPolarHBondContact O-CG 3.34Å; C582-R605 PolarHBondContact O-NH1 2.82Å; L583-R605 WeakPolarHBondContact O-CA 3.33Å; K584-R605 HydrophobicContact CB-CG 4.03Å; K584-R605 HydrophobicContact CG-CG 4.41Å; R605-D625 WeakPolarHBondContact CB-OD1 3.47Å
606	R	89.6	Confident	92.9	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.008	22%	0.216	C	C	.	.			trans	-149	123.1	-175.1	-52.2	174.1	177.6	-109.6	10.9	112.3	G576 L583 M602 K604 V609 G622 H624 C638 E640	G576-R606 PolarHBondContact N-O 3.06Å; L583-R606 PolarHBondContact O-N 2.79Å; M602-R606 HydrophobicContact CE-CB 4.25Å; M602-R606 HydrophobicContact CE-CG 4.34Å; K604-R606 HydrophobicContact CB-CG 4.49Å; R606-V609 HydrophobicContact CB-CG1 3.26Å; R606-V609 HydrophobicContact CG-CG1 4.16Å; R606-G622 PolarHBondContact NH1-O 2.9Å; R606-H624 WeakPolarHBondContact CA-O 3.35Å; R606-C638 VanDerWaalsContact CZ-O 3.28Å; R606-C638 PolarHBondContact NH1-O 3.18Å; R606-C638 PolarHBondContact NH2-O 2.85Å; R606-E640 IonicContact CZ-OE1 3.65Å; R606-E640 VanDerWaalsContact CZ-OE1 3.23Å; R606-E640 IonicContact NE-OE1 3.55Å; R606-E640 PolarHBondContact NE-OE1 2.87Å; R606-E640 IonicContact NH2-OE1 3.97Å; R606-E640 PolarHBondContact NH2-OE1 3.44Å
607	G	88.1	Confident	92.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-102	163.2	160.7	0	0	0	0	0	110.7	V609 G623 H624	G607-V609 PolarHBondContact O-N 2.88Å; G607-G623 VanDerWaalsContact O-CA 3.24Å; G607-G623 WeakPolarHBondContact O-CA 3.46Å; G607-H624 VanDerWaalsContact C-CE1 3.5Å; G607-H624 PolarHBondContact N-O 2.96Å; G607-H624 PolarHBondContact O-N 2.75Å; G607-H624 PolarHBondContact O-ND1 3.2Å; G607-H624 VanDerWaalsContact O-ND1 3.1Å
608	G	86	Confident	92.6	Very high	11 Å²	11	36.9 Å²	36.9	11%	0.113	21%	0.207	C	C	.	.	S	Bend	trans	60.9	31.2	174.1	0	0	0	0	0	114	T561 A661	T561-G608 PolarHBondContact O-N 2.72Å; G608-A661 VanDerWaalsContact O-CA 3.31Å; G608-A661 WeakPolarHBondContact O-CA 3.37Å; G608-A661 PolarHBondContact O-N 2.86Å
609	V	90.3	Very high	92.6	Very high	14 Å²	14	31.6 Å²	31.6	9%	0.085	18%	0.179	C	C	.	.			trans	-72.6	142.1	-176.1	-73.2	0	0	0	0	112.4	R606 G607 V611 V620	R606-V609 HydrophobicContact CB-CG1 3.26Å; R606-V609 HydrophobicContact CG-CG1 4.16Å; G607-V609 PolarHBondContact O-N 2.88Å; V609-V611 HydrophobicContact CB-CG1 4.27Å; V609-V611 HydrophobicContact CG2-CG1 3.9Å; V609-V620 HydrophobicContact CB-CG1 3.96Å; V609-V620 HydrophobicContact CG1-CG1 3.71Å
610	G	94.6	Very high	92.6	Very high	2 Å²	2	30.9 Å²	30.9	2%	0.021	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	134	158.6	0	0	0	0	0	110.1	V621 V662	G610-V621 PolarHBondContact N-O 2.91Å; G610-V621 VanDerWaalsContact N-O 3.09Å; G610-V621 PolarHBondContact O-N 2.86Å; G610-V662 WeakPolarHBondContact CA-O 3.47Å
611	V	96.1	Very high	92.5	Very high	21 Å²	21	29.8 Å²	29.8	13%	0.127	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	144.5	177.1	-58.6	0	0	0	0	111.9	V565 I574 V609 Y619 V620	V565-V611 HydrophobicContact CB-CG2 4.23Å; I574-V611 HydrophobicContact CB-CG1 4.46Å; I574-V611 HydrophobicContact CD1-CG1 4.36Å; I574-V611 HydrophobicContact CD1-CG2 4.47Å; V609-V611 HydrophobicContact CB-CG1 4.27Å; V609-V611 HydrophobicContact CG2-CG1 3.9Å; V611-Y619 VanDerWaalsContact CA-O 3.32Å; V611-Y619 WeakPolarHBondContact CA-O 3.41Å; V611-V620 HydrophobicContact CG1-CG1 4.44Å; V611-V620 HydrophobicContact CG1-CG2 4.09Å
612	A	96.6	Very high	92.4	Very high	3 Å²	3	26.8 Å²	26.8	3%	0.025	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	165.1	179.6	0	0	0	0	0	111.1	Y619 V664 L671	A612-Y619 PolarHBondContact N-O 2.88Å; A612-Y619 VanDerWaalsContact N-O 3.12Å; A612-Y619 PolarHBondContact O-N 2.86Å; A612-V664 HydrophobicContact CB-CB 4.29Å; A612-V664 HydrophobicContact CB-CG1 3.69Å; A612-L671 HydrophobicContact CB-CD2 3.47Å; A612-L671 VanDerWaalsContact CB-CD2 3.47Å
613	T	94.8	Very high	92.2	Very high	35 Å²	35	26.8 Å²	26.8	22%	0.215	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	134.7	175.7	44.8	0	0	0	0	110.7	V565 A566 L567 Y617 L618 P666	V565-T613 HydrophobicContact CB-CG2 4.33Å; V565-T613 HydrophobicContact CG1-CG2 3.76Å; V565-T613 HydrophobicContact CG2-CG2 3.58Å; A566-T613 PolarHBondContact O-OG1 3.06Å; L567-T613 HydrophobicContact CB-CG2 3.85Å; L567-T613 HydrophobicContact CD1-CG2 4.09Å; L567-T613 HydrophobicContact CD2-CG2 4.23Å; L567-T613 HydrophobicContact CG-CG2 4.28Å; T613-Y617 WeakPolarHBondContact CA-O 3.44Å; T613-L618 HydrophobicContact CG2-CB 4.3Å; T613-L618 HydrophobicContact CG2-CG 4.49Å; T613-P666 WeakPolarHBondContact O-CG 3.41Å
614	H	91.9	Very high	92	Very high	11 Å²	11	23.3 Å²	23.3	5%	0.051	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	134.7	-174.3	-178.6	74.9	0	0	0	110.5	G616 Y617 Y619 D669 L671	H614-G616 PolarHBondContact O-N 3.1Å; H614-Y617 PolarHBondContact N-O 2.86Å; H614-Y617 PolarHBondContact O-N 3.31Å; H614-Y619 HydrophobicContact CB-CD2 4.22Å; H614-Y619 HydrophobicContact CB-CE2 3.96Å; H614-D669 PolarHBondContact CE1-O 2.82Å; H614-D669 PolarHBondContact NE2-O 2.79Å; H614-L671 HydrophobicContact CB-CD1 4.03Å; H614-L671 HydrophobicContact CB-CD2 3.85Å; H614-L671 HydrophobicContact CB-CG 3.83Å
615	N	86.8	Confident	91.9	Very high	77 Å²	77	21.5 Å²	21.5	41%	0.412	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	29.6	-178.5	-64.5	-15.5	0	0	0	115.9	Y617	N615-Y617 WeakPolarHBondContact O-CD2 3.38Å
616	G	88.6	Confident	91.1	Very high	38 Å²	38	17.6 Å²	17.6	39%	0.392	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.4	-0.1	-179.7	0	0	0	0	0	115.3	H614	H614-G616 PolarHBondContact O-N 3.1Å
617	Y	93.9	Very high	89.9	Confident	70 Å²	70	20.5 Å²	20.5	28%	0.275	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	159.7	175.6	-56.6	-88.3	0	0	0	111.3	T613 H614 N615 R641 D643	T613-Y617 WeakPolarHBondContact CA-O 3.44Å; H614-Y617 PolarHBondContact N-O 2.86Å; H614-Y617 PolarHBondContact O-N 3.31Å; N615-Y617 WeakPolarHBondContact O-CD2 3.38Å; Y617-R641 HydrophobicContact CD1-CG 4.16Å; Y617-R641 HydrophobicContact CG-CG 4.06Å; Y617-D643 HydrophobicContact CD1-CB 3.92Å; Y617-D643 HydrophobicContact CE1-CB 3.82Å
618	L	96.6	Very high	88.3	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	137.1	169.5	-178.6	158.7	0	0	0	108.9	V565 L567 Y572 I574 M586 T613 V620 R641 Y642 W649	V565-L618 HydrophobicContact CG1-CD1 3.54Å; V565-L618 HydrophobicContact CG1-CG 3.92Å; L567-L618 HydrophobicContact CD2-CB 4Å; Y572-L618 HydrophobicContact CD1-CD1 4.33Å; Y572-L618 HydrophobicContact CD2-CD1 4.49Å; Y572-L618 HydrophobicContact CG-CD1 3.97Å; I574-L618 HydrophobicContact CD1-CD1 4.03Å; I574-L618 HydrophobicContact CG1-CD1 4.18Å; I574-L618 HydrophobicContact CG1-CD2 4.37Å; M586-L618 HydrophobicContact SD-CD1 4.23Å; T613-L618 HydrophobicContact CG2-CB 4.3Å; T613-L618 HydrophobicContact CG2-CG 4.49Å; L618-V620 HydrophobicContact CD2-CG2 3.73Å; L618-R641 CarbonylContact O-C 3.59Å; L618-R641 VanDerWaalsContact O-CA 3.31Å; L618-R641 WeakPolarHBondContact O-CA 3.41Å; L618-Y642 HydrophobicContact CB-CD1 4.24Å; L618-Y642 PolarHBondContact N-O 3.15Å; L618-Y642 VanDerWaalsContact N-O 3.15Å; L618-Y642 PolarHBondContact O-N 3.1Å; L618-W649 HydrophobicContact CD2-CH2 3.77Å; L618-W649 HydrophobicContact CD2-CZ3 4.15Å
619	Y	97.2	Very high	86.7	Confident	4 Å²	4	28.9 Å²	28.9	2%	0.016	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	137.9	177.6	-71.2	-104.5	0	0	0	110.5	V611 A612 H614 V639 R641 V652 L671 Y689	V611-Y619 VanDerWaalsContact CA-O 3.32Å; V611-Y619 WeakPolarHBondContact CA-O 3.41Å; A612-Y619 PolarHBondContact N-O 2.88Å; A612-Y619 VanDerWaalsContact N-O 3.12Å; A612-Y619 PolarHBondContact O-N 2.86Å; H614-Y619 HydrophobicContact CB-CD2 4.22Å; H614-Y619 HydrophobicContact CB-CE2 3.96Å; Y619-V639 HydrophobicContact CD1-CG1 4.41Å; Y619-R641 HydrophobicContact CD1-CB 4.02Å; Y619-R641 HydrophobicContact CD1-CG 4.19Å; Y619-R641 HydrophobicContact CD2-CG 4.33Å; Y619-R641 HydrophobicContact CE1-CB 3.91Å; Y619-R641 HydrophobicContact CE1-CG 3.83Å; Y619-R641 HydrophobicContact CE2-CG 4Å; Y619-R641 HydrophobicContact CG-CG 4.43Å; Y619-R641 WeakPolarHBondContact OH-CD 3.43Å; Y619-V652 HydrophobicContact CD1-CG2 4.41Å; Y619-V652 HydrophobicContact CE1-CG2 4.35Å; Y619-L671 HydrophobicContact CD1-CD1 3.79Å; Y619-L671 HydrophobicContact CD2-CD1 3.6Å; Y619-L671 HydrophobicContact CE1-CD1 4.19Å; Y619-L671 HydrophobicContact CE2-CD1 4.01Å; Y619-L671 HydrophobicContact CG-CD1 3.47Å; Y619-L671 VanDerWaalsContact CG-CD1 3.47Å; Y619-Y689 HydrophobicContact CE1-CD1 4.37Å; Y619-Y689 AromaticContact CE1-CE1 3.63Å; Y619-Y689 HydrophobicContact CE1-CE1 3.63Å
620	V	96.2	Very high	84.7	Confident	0 Å²	0	33 Å²	33	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	123	173.3	-178.1	0	0	0	0	108.8	I574 M602 V609 V611 L618 V639 E640 W649	I574-V620 HydrophobicContact CG2-CG2 3.8Å; M602-V620 HydrophobicContact SD-CB 4.29Å; M602-V620 HydrophobicContact SD-CG1 3.88Å; M602-V620 HydrophobicContact SD-CG2 4Å; V609-V620 HydrophobicContact CB-CG1 3.96Å; V609-V620 HydrophobicContact CG1-CG1 3.71Å; V611-V620 HydrophobicContact CG1-CG1 4.44Å; V611-V620 HydrophobicContact CG1-CG2 4.09Å; L618-V620 HydrophobicContact CD2-CG2 3.73Å; V620-V639 WeakPolarHBondContact O-CA 3.4Å; V620-V639 WeakPolarHBondContact O-CG1 3.33Å; V620-E640 PolarHBondContact N-O 2.78Å; V620-E640 PolarHBondContact O-N 3.4Å; V620-W649 HydrophobicContact CB-CZ3 4.26Å; V620-W649 HydrophobicContact CG2-CH2 3.47Å; V620-W649 VanDerWaalsContact CG2-CH2 3.47Å; V620-W649 HydrophobicContact CG2-CZ3 3.54Å
621	V	95.6	Very high	82.6	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	133	-174.6	-179.4	0	0	0	0	110	G610 G623 V639 L655 V662 V664 V673 W696	G610-V621 PolarHBondContact N-O 2.91Å; G610-V621 VanDerWaalsContact N-O 3.09Å; G610-V621 PolarHBondContact O-N 2.86Å; V621-G623 PolarHBondContact O-N 3.49Å; V621-V639 HydrophobicContact CG1-CG2 4.25Å; V621-V639 HydrophobicContact CG2-CG1 4.01Å; V621-V639 HydrophobicContact CG2-CG2 4.39Å; V621-L655 HydrophobicContact CG1-CD1 3.65Å; V621-L655 HydrophobicContact CG1-CD2 3.93Å; V621-L655 HydrophobicContact CG1-CG 4Å; V621-V662 HydrophobicContact CG1-CG1 4.2Å; V621-V664 HydrophobicContact CB-CG2 3.9Å; V621-V664 HydrophobicContact CG1-CG2 4.38Å; V621-V664 HydrophobicContact CG2-CG1 4.18Å; V621-V664 HydrophobicContact CG2-CG2 4Å; V621-V673 HydrophobicContact CG1-CG2 3.87Å; V621-V673 HydrophobicContact CG2-CG2 4.34Å; V621-W696 HydrophobicContact CG2-CH2 4.42Å
622	G	93.2	Very high	80.6	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	28%	0.278	C	S	.	.			trans	52.2	-133.9	169.5	0	0	0	0	0	114.5	R606 S636	R606-G622 PolarHBondContact NH1-O 2.9Å; G622-S636 VanDerWaalsContact CA-O 3.28Å; G622-S636 WeakPolarHBondContact CA-O 3.33Å
623	G	91.1	Very high	79.2	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	30%	0.296	C	S	.	.			trans	78.7	-170.9	-168.6	0	0	0	0	0	111.4	G607 V621 S636 R659	G607-G623 VanDerWaalsContact O-CA 3.24Å; G607-G623 WeakPolarHBondContact O-CA 3.46Å; V621-G623 PolarHBondContact O-N 3.49Å; G623-S636 WeakPolarHBondContact O-CB 3.21Å; G623-S636 PolarHBondContact O-N 2.82Å; G623-R659 PolarHBondContact N-O 3.4Å
624	H	88.3	Confident	78.5	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.009	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	150.1	-175	69.1	-70.1	0	0	0	113.3	R577 C582 R606 G607 S633 R634 L635 D660	R577-H624 VanDerWaalsContact CZ-CE1 3.43Å; R577-H624 PolarHBondContact NH1-NE2 3.4Å; R577-H624 VanDerWaalsContact NH1-NE2 3.16Å; R577-H624 PolarHBondContact NH2-CE1 3.04Å; C582-H624 PolarHBondContact SG-O 3.44Å; R606-H624 WeakPolarHBondContact CA-O 3.35Å; G607-H624 VanDerWaalsContact C-CE1 3.5Å; G607-H624 PolarHBondContact N-O 2.96Å; G607-H624 PolarHBondContact O-N 2.75Å; G607-H624 PolarHBondContact O-ND1 3.2Å; G607-H624 VanDerWaalsContact O-ND1 3.1Å; H624-S633 WeakPolarHBondContact CB-OG 3.16Å; H624-S633 PolarHBondContact CD2-OG 2.81Å; H624-R634 WeakPolarHBondContact CA-O 3.45Å; H624-L635 HydrophobicContact CB-CD2 4.14Å; H624-D660 HydrophobicContact CB-CB 3.96Å; H624-D660 IonicContact CG-OD2 2.86Å; H624-D660 IonicContact ND1-OD2 3.27Å
625	D	86	Confident	78.2	Confident	54 Å²	54	57.9 Å²	57.9	29%	0.289	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	129.1	164.3	-162.6	3.8	0	0	0	110.1	R605 R634	R605-D625 WeakPolarHBondContact CB-OD1 3.47Å; D625-R634 PolarHBondContact N-O 2.85Å; D625-R634 PolarHBondContact O-N 3.06Å
626	A	72.6	Confident	78.1	Confident	25 Å²	25	54.9 Å²	54.9	21%	0.207	31%	0.313	C	S	.	.			trans	-133.8	100.8	177.6	0	0	0	0	0	108.5	C582	C582-A626 PolarHBondContact SG-N 2.74Å; C582-A626 VanDerWaalsContact SG-N 3.44Å
627	P	64.6	Low	78.1	Confident	63 Å²	63	56.2 Å²	56.2	41%	0.409	31%	0.311	S	S	.	.			trans	-81.2	149.7	176.5	32.9	-33.7	0	0	0	111.3	P629 N630	P627-P629 VanDerWaalsContact C-N 3.34Å; P627-P629 WeakPolarHBondContact O-CD 3.22Å; P627-N630 HydrophobicContact CG-CB 4.24Å; P627-N630 PolarHBondContact O-N 3.11Å; P627-N630 VanDerWaalsContact O-N 3.15Å
628	A	53.9	Low	78	Confident	87 Å²	87	53.3 Å²	53.3	72%	0.719	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-29.2	-166	0	0	0	0	0	118.7	S580	S580-A628 WeakPolarHBondContact O-CB 3.4Å
629	P	51.4	Low	78	Confident	101 Å²	101	53.3 Å²	53.3	66%	0.656	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	-10.5	179.3	38.1	-32.5	0	0	0	115.5	P627	P627-P629 VanDerWaalsContact C-N 3.34Å; P627-P629 WeakPolarHBondContact O-CD 3.22Å
630	N	49.4	Very low	77.9	Confident	100 Å²	100	53.2 Å²	53.2	54%	0.535	30%	0.3	S	S	.	.			trans	-112.9	116.9	-171.1	-69.7	0.5	0	0	0	111.6	P627 C632	P627-N630 HydrophobicContact CG-CB 4.24Å; P627-N630 PolarHBondContact O-N 3.11Å; P627-N630 VanDerWaalsContact O-N 3.15Å; N630-C632 PolarHBondContact O-N 3.32Å; N630-C632 VanDerWaalsContact O-N 3.17Å
631	H	50.5	Low	77.9	Confident	195 Å²	195	56.5 Å²	56.5	90%	0.903	31%	0.313	S	S	*	.			trans	-69.7	-6.3	177.3	-60.5	-60.4	0	0	0	114.9	S633	H631-S633 VanDerWaalsContact C-N 3.3Å; H631-S633 PolarHBondContact O-N 3.49Å
632	C	53.5	Low	78	Confident	109 Å²	109	56.7 Å²	56.7	74%	0.736	31%	0.313	S	S	*	.			trans	-72.4	82.8	173.6	-58.6	0	0	0	0	110.7	N630 R634	N630-C632 PolarHBondContact O-N 3.32Å; N630-C632 VanDerWaalsContact O-N 3.17Å; C632-R634 PolarHBondContact O-N 2.66Å; C632-R634 VanDerWaalsContact O-N 3.13Å
633	S	66.8	Low	78.1	Confident	55 Å²	55	58.4 Å²	58.4	39%	0.385	32%	0.322	S	S	.	.			trans	-56.9	112.2	170.3	-168.2	0	0	0	0	109.6	H624 H631 L635	H624-S633 WeakPolarHBondContact CB-OG 3.16Å; H624-S633 PolarHBondContact CD2-OG 2.81Å; H631-S633 VanDerWaalsContact C-N 3.3Å; H631-S633 PolarHBondContact O-N 3.49Å; S633-L635 PolarHBondContact O-N 3.36Å
634	R	79.6	Confident	78.3	Confident	202 Å²	202	59.8 Å²	59.8	76%	0.762	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	100.6	177.8	-172.9	173.6	-176.8	164.2	3.3	109.1	H624 D625 C632	H624-R634 WeakPolarHBondContact CA-O 3.45Å; D625-R634 PolarHBondContact N-O 2.85Å; D625-R634 PolarHBondContact O-N 3.06Å; C632-R634 PolarHBondContact O-N 2.66Å; C632-R634 VanDerWaalsContact O-N 3.13Å
635	L	86.2	Confident	78.4	Confident	34 Å²	34	67.7 Å²	67.7	18%	0.178	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	150.5	171.4	-51.7	176.4	0	0	0	110.8	H624 S633 P658 D660 D678 G679	H624-L635 HydrophobicContact CB-CD2 4.14Å; S633-L635 PolarHBondContact O-N 3.36Å; L635-P658 HydrophobicContact CB-CB 4.08Å; L635-D660 HydrophobicContact CD2-CB 3.67Å; L635-D678 WeakPolarHBondContact CD1-O 3.4Å; L635-G679 VanDerWaalsContact CD1-N 3.34Å
636	S	85.1	Confident	78.9	Confident	14 Å²	14	68.4 Å²	68.4	10%	0.098	38%	0.375	C	S	.	.			trans	-119.3	138.7	-178.9	-166.3	0	0	0	0	112.2	G622 G623 C638 P658 R659	G622-S636 VanDerWaalsContact CA-O 3.28Å; G622-S636 WeakPolarHBondContact CA-O 3.33Å; G623-S636 WeakPolarHBondContact O-CB 3.21Å; G623-S636 PolarHBondContact O-N 2.82Å; S636-C638 WeakPolarHBondContact OG-CB 3.29Å; S636-C638 PolarHBondContact OG-N 2.76Å; S636-P658 WeakPolarHBondContact O-CA 3.34Å; S636-R659 PolarHBondContact O-N 2.92Å
637	D	88.9	Confident	80	Confident	65 Å²	65	70.7 Å²	70.7	35%	0.348	38%	0.384	S	S	.	.			trans	-88.1	-37.3	165.2	50.3	-5.7	0	0	0	111.9	P654 L655 P658	D637-P654 HydrophobicContact CB-CB 4.11Å; D637-L655 PolarHBondContact O-N 2.85Å; D637-P658 HydrophobicContact CB-CB 4.27Å; D637-P658 HydrophobicContact CB-CG 4.04Å
638	C	91.5	Very high	81.5	Confident	9 Å²	9	70 Å²	70	6%	0.061	38%	0.381	C	S	.	.			trans	-56	133.6	-170.8	-170.6	0	0	0	0	112.9	K604 R606 S636	K604-C638 HydrophobicContact CD-CB 4.37Å; K604-C638 VanDerWaalsContact NZ-CB 3.27Å; K604-C638 PolarHBondContact NZ-SG 3.1Å; R606-C638 VanDerWaalsContact CZ-O 3.28Å; R606-C638 PolarHBondContact NH1-O 3.18Å; R606-C638 PolarHBondContact NH2-O 2.85Å; S636-C638 WeakPolarHBondContact OG-CB 3.29Å; S636-C638 PolarHBondContact OG-N 2.76Å
639	V	95.7	Very high	83.6	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	137.2	174.5	-175.2	0	0	0	0	109	Y619 V620 V621 V652 A653 L655 W696	Y619-V639 HydrophobicContact CD1-CG1 4.41Å; V620-V639 WeakPolarHBondContact O-CA 3.4Å; V620-V639 WeakPolarHBondContact O-CG1 3.33Å; V621-V639 HydrophobicContact CG1-CG2 4.25Å; V621-V639 HydrophobicContact CG2-CG1 4.01Å; V621-V639 HydrophobicContact CG2-CG2 4.39Å; V639-V652 HydrophobicContact CB-CG2 3.66Å; V639-V652 HydrophobicContact CG1-CG2 3.42Å; V639-V652 VanDerWaalsContact CG1-CG2 3.42Å; V639-V652 PolarHBondContact O-N 2.83Å; V639-V652 VanDerWaalsContact O-N 3.13Å; V639-A653 WeakPolarHBondContact CG2-O 3.35Å; V639-L655 HydrophobicContact CG2-CD2 4.47Å; V639-L655 HydrophobicContact CG2-CG 4.34Å; V639-W696 HydrophobicContact CG1-CZ2 4.42Å; V639-W696 HydrophobicContact CG2-CZ2 3.91Å
640	E	96.2	Very high	85.7	Confident	2 Å²	2	65.1 Å²	65.1	1%	0.009	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130	179.6	-72.9	174.9	-93.9	0	0	109.9	S603 R606 V620 W649	S603-E640 VanDerWaalsContact CB-OE2 3.26Å; S603-E640 WeakPolarHBondContact CB-OE2 3.37Å; S603-E640 PolarHBondContact N-OE2 3.16Å; S603-E640 PolarHBondContact OG-OE2 3.19Å; R606-E640 IonicContact CZ-OE1 3.65Å; R606-E640 VanDerWaalsContact CZ-OE1 3.23Å; R606-E640 IonicContact NE-OE1 3.55Å; R606-E640 PolarHBondContact NE-OE1 2.87Å; R606-E640 IonicContact NH2-OE1 3.97Å; R606-E640 PolarHBondContact NH2-OE1 3.44Å; V620-E640 PolarHBondContact N-O 2.78Å; V620-E640 PolarHBondContact O-N 3.4Å; E640-W649 HydrophobicContact CB-CE3 3.75Å; E640-W649 HydrophobicContact CB-CZ3 4.1Å
641	R	96.6	Very high	88	Confident	69 Å²	69	64.8 Å²	64.8	26%	0.26	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	134.1	176.8	-178.4	-169.4	65.2	-169.7	-7.9	109.8	Y617 L618 Y619 W649 S650 V652	Y617-R641 HydrophobicContact CD1-CG 4.16Å; Y617-R641 HydrophobicContact CG-CG 4.06Å; L618-R641 CarbonylContact O-C 3.59Å; L618-R641 VanDerWaalsContact O-CA 3.31Å; L618-R641 WeakPolarHBondContact O-CA 3.41Å; Y619-R641 HydrophobicContact CD1-CB 4.02Å; Y619-R641 HydrophobicContact CD1-CG 4.19Å; Y619-R641 HydrophobicContact CD2-CG 4.33Å; Y619-R641 HydrophobicContact CE1-CB 3.91Å; Y619-R641 HydrophobicContact CE1-CG 3.83Å; Y619-R641 HydrophobicContact CE2-CG 4Å; Y619-R641 HydrophobicContact CG-CG 4.43Å; Y619-R641 WeakPolarHBondContact OH-CD 3.43Å; R641-W649 CarbonylContact O-C 3.53Å; R641-W649 WeakPolarHBondContact O-CA 3.49Å; R641-S650 PolarHBondContact N-O 2.99Å; R641-S650 PolarHBondContact NE-OG 2.82Å; R641-S650 PolarHBondContact NH2-OG 3.17Å; R641-S650 PolarHBondContact O-N 3.05Å; R641-S650 PolarHBondContact O-OG 3.06Å; R641-V652 HydrophobicContact CB-CG1 3.9Å
642	Y	97.5	Very high	90.1	Very high	5 Å²	5	56 Å²	56	2%	0.02	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	132.6	177.4	170.6	-101.7	0	0	0	111.4	Y572 M586 C599 L618 P644 D647 S648 W649	Y572-Y642 AromaticContact CE1-CE1 3.96Å; Y572-Y642 HydrophobicContact CE1-CE1 3.96Å; M586-Y642 HydrophobicContact CE-CD1 3.75Å; M586-Y642 HydrophobicContact CE-CD2 3.65Å; M586-Y642 HydrophobicContact CE-CE1 3.65Å; M586-Y642 HydrophobicContact CE-CE2 3.54Å; M586-Y642 HydrophobicContact CE-CG 3.75Å; C599-Y642 PolarHBondContact SG-OH 2.9Å; L618-Y642 HydrophobicContact CB-CD1 4.24Å; L618-Y642 PolarHBondContact N-O 3.15Å; L618-Y642 VanDerWaalsContact N-O 3.15Å; L618-Y642 PolarHBondContact O-N 3.1Å; Y642-P644 HydrophobicContact CD1-CB 4.49Å; Y642-P644 VanDerWaalsContact CE1-CA 3.49Å; Y642-P644 HydrophobicContact CE1-CB 3.79Å; Y642-D647 WeakPolarHBondContact CE2-OD1 3.41Å; Y642-D647 PolarHBondContact OH-OD1 3.14Å; Y642-S648 WeakPolarHBondContact CA-O 3.46Å; Y642-W649 HydrophobicContact CD2-CD2 4.12Å; Y642-W649 AromaticContact CD2-CE2 3.79Å; Y642-W649 HydrophobicContact CD2-CG 4.34Å; Y642-W649 HydrophobicContact CD2-CZ2 4.2Å; Y642-W649 AromaticContact CD2-NE1 3.76Å; Y642-W649 HydrophobicContact CG-CD2 4.43Å; Y642-W649 HydrophobicContact CG-CH2 4.49Å; Y642-W649 HydrophobicContact CG-CZ2 4.25Å
643	D	95.4	Very high	92.2	Very high	35 Å²	35	51.6 Å²	51.6	19%	0.187	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	115.7	168.9	-170.9	-20.6	0	0	0	110.4	Y617 K645 D647 S648	Y617-D643 HydrophobicContact CD1-CB 3.92Å; Y617-D643 HydrophobicContact CE1-CB 3.82Å; D643-K645 PolarHBondContact O-N 3.39Å; D643-K645 VanDerWaalsContact OD1-CB 3.27Å; D643-K645 WeakPolarHBondContact OD1-CB 3.19Å; D643-K645 PolarHBondContact OD1-N 3.26Å; D643-D647 PolarHBondContact O-N 2.89Å; D643-D647 VanDerWaalsContact O-N 3.11Å; D643-S648 PolarHBondContact N-O 2.85Å; D643-S648 PolarHBondContact O-N 2.89Å
644	P	93.9	Very high	93.6	Very high	29 Å²	29	52.5 Å²	52.5	19%	0.188	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-8.8	178	31.7	-37.7	0	0	0	114.6	L567 N568 Y642	L567-P644 HydrophobicContact CD2-CB 4.47Å; L567-P644 HydrophobicContact CD2-CG 3.92Å; N568-P644 WeakPolarHBondContact ND2-CG 3.27Å; Y642-P644 HydrophobicContact CD1-CB 4.49Å; Y642-P644 VanDerWaalsContact CE1-CA 3.49Å; Y642-P644 HydrophobicContact CE1-CB 3.79Å
645	K	92	Very high	94.3	Very high	168 Å²	168	43.2 Å²	43.2	73%	0.73	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-30.9	178.4	-61.9	173.7	179.8	173.4	0	112.6	D643	D643-K645 PolarHBondContact O-N 3.39Å; D643-K645 VanDerWaalsContact OD1-CB 3.27Å; D643-K645 WeakPolarHBondContact OD1-CB 3.19Å; D643-K645 PolarHBondContact OD1-N 3.26Å
646	S	94.8	Very high	94.6	Very high	69 Å²	69	45.8 Å²	45.8	48%	0.483	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-0.7	-179.8	52.1	0	0	0	0	114.1	S648	S646-S648 VanDerWaalsContact C-N 3.34Å; S646-S648 PolarHBondContact O-N 3.43Å; S646-S648 PolarHBondContact OG-OG 2.92Å
647	D	96.3	Very high	94.9	Very high	73 Å²	73	47.5 Å²	47.5	39%	0.39	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	53.2	-174.9	-168.6	29.6	0	0	0	111.5	A600 Y642 D643	A600-D647 WeakPolarHBondContact CB-O 3.47Å; A600-D647 WeakPolarHBondContact CB-OD1 3.49Å; A600-D647 PolarHBondContact N-OD1 3.24Å; A600-D647 PolarHBondContact N-OD2 2.78Å; Y642-D647 WeakPolarHBondContact CE2-OD1 3.41Å; Y642-D647 PolarHBondContact OH-OD1 3.14Å; D643-D647 PolarHBondContact O-N 2.89Å; D643-D647 VanDerWaalsContact O-N 3.11Å
648	S	97.1	Very high	95	Very high	50 Å²	50	47 Å²	47	35%	0.35	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	142.2	-169.6	66.6	0	0	0	0	113.4	Y642 D643 S646	Y642-S648 WeakPolarHBondContact CA-O 3.46Å; D643-S648 PolarHBondContact N-O 2.85Å; D643-S648 PolarHBondContact O-N 2.89Å; S646-S648 VanDerWaalsContact C-N 3.34Å; S646-S648 PolarHBondContact O-N 3.43Å; S646-S648 PolarHBondContact OG-OG 2.92Å
649	W	97.4	Very high	95	Very high	45 Å²	45	46.5 Å²	46.5	17%	0.17	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	139.7	175.6	-65.7	90	0	0	0	112.1	I574 M586 A600 P601 M602 L618 V620 E640 R641 Y642	I574-W649 HydrophobicContact CG2-CH2 4.18Å; I574-W649 HydrophobicContact CG2-CZ2 4.49Å; M586-W649 HydrophobicContact CE-CH2 4.4Å; M586-W649 HydrophobicContact CE-CZ2 3.57Å; M586-W649 HydrophobicContact SD-CH2 4.19Å; M586-W649 HydrophobicContact SD-CZ2 3.73Å; A600-W649 PolarHBondContact O-NE1 2.82Å; P601-W649 VanDerWaalsContact O-CD1 3.24Å; M602-W649 HydrophobicContact CG-CD2 4.1Å; M602-W649 HydrophobicContact CG-CE3 4.3Å; M602-W649 HydrophobicContact CG-CH2 3.72Å; M602-W649 HydrophobicContact CG-CZ2 3.48Å; M602-W649 VanDerWaalsContact CG-CZ2 3.48Å; M602-W649 HydrophobicContact CG-CZ3 4.12Å; M602-W649 HydrophobicContact SD-CH2 4.21Å; M602-W649 HydrophobicContact SD-CZ2 4.46Å; L618-W649 HydrophobicContact CD2-CH2 3.77Å; L618-W649 HydrophobicContact CD2-CZ3 4.15Å; V620-W649 HydrophobicContact CB-CZ3 4.26Å; V620-W649 HydrophobicContact CG2-CH2 3.47Å; V620-W649 VanDerWaalsContact CG2-CH2 3.47Å; V620-W649 HydrophobicContact CG2-CZ3 3.54Å; E640-W649 HydrophobicContact CB-CE3 3.75Å; E640-W649 HydrophobicContact CB-CZ3 4.1Å; R641-W649 CarbonylContact O-C 3.53Å; R641-W649 WeakPolarHBondContact O-CA 3.49Å; Y642-W649 HydrophobicContact CD2-CD2 4.12Å; Y642-W649 AromaticContact CD2-CE2 3.79Å; Y642-W649 HydrophobicContact CD2-CG 4.34Å; Y642-W649 HydrophobicContact CD2-CZ2 4.2Å; Y642-W649 AromaticContact CD2-NE1 3.76Å; Y642-W649 HydrophobicContact CG-CD2 4.43Å; Y642-W649 HydrophobicContact CG-CH2 4.49Å; Y642-W649 HydrophobicContact CG-CZ2 4.25Å
650	S	96.3	Very high	94.7	Very high	40 Å²	40	47.9 Å²	47.9	28%	0.28	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	129.8	169.8	62.6	0	0	0	0	109.9	R641	R641-S650 PolarHBondContact N-O 2.99Å; R641-S650 PolarHBondContact NE-OG 2.82Å; R641-S650 PolarHBondContact NH2-OG 3.17Å; R641-S650 PolarHBondContact O-N 3.05Å; R641-S650 PolarHBondContact O-OG 3.06Å
651	T	95.8	Very high	94.4	Very high	93 Å²	93	49.2 Å²	49.2	57%	0.571	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.4	143.6	167.6	-49.8	0	0	0	0	110
652	V	96.4	Very high	94.2	Very high	9 Å²	9	46.3 Å²	46.3	6%	0.055	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	179.8	171.7	-59.3	0	0	0	0	108.5	Y619 V639 R641 D694	Y619-V652 HydrophobicContact CD1-CG2 4.41Å; Y619-V652 HydrophobicContact CE1-CG2 4.35Å; V639-V652 HydrophobicContact CB-CG2 3.66Å; V639-V652 HydrophobicContact CG1-CG2 3.42Å; V639-V652 VanDerWaalsContact CG1-CG2 3.42Å; V639-V652 PolarHBondContact O-N 2.83Å; V639-V652 VanDerWaalsContact O-N 3.13Å; R641-V652 HydrophobicContact CB-CG1 3.9Å; V652-D694 WeakPolarHBondContact CB-OD1 3.33Å
653	A	96.4	Very high	94	Very high	18 Å²	18	46.4 Å²	46.4	15%	0.149	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-51.9	135.3	-175.1	0	0	0	0	0	113	V639 Y689 D694 W696	V639-A653 WeakPolarHBondContact CG2-O 3.35Å; A653-Y689 HydrophobicContact CB-CE2 4.45Å; A653-D694 WeakPolarHBondContact CB-O 3.18Å; A653-D694 VanDerWaalsContact CB-OD1 3.28Å; A653-D694 WeakPolarHBondContact CB-OD1 3.39Å; A653-D694 PolarHBondContact N-OD1 2.64Å; A653-W696 PolarHBondContact O-NE1 2.84Å
654	P	95.8	Very high	94	Very high	73 Å²	73	45.3 Å²	45.3	47%	0.474	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-74.2	158.2	178.1	32.6	-35.5	0	0	0	111.6	D637	D637-P654 HydrophobicContact CB-CB 4.11Å
655	L	94.6	Very high	94.1	Very high	8 Å²	8	44.7 Å²	44.7	4%	0.042	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-63	155.8	167.5	-60.3	179.9	0	0	0	111.8	V621 D637 V639 V657 R659 V673 W696	V621-L655 HydrophobicContact CG1-CD1 3.65Å; V621-L655 HydrophobicContact CG1-CD2 3.93Å; V621-L655 HydrophobicContact CG1-CG 4Å; D637-L655 PolarHBondContact O-N 2.85Å; V639-L655 HydrophobicContact CG2-CD2 4.47Å; V639-L655 HydrophobicContact CG2-CG 4.34Å; L655-V657 VanDerWaalsContact C-N 3.26Å; L655-V657 PolarHBondContact O-N 3.11Å; L655-R659 HydrophobicContact CD1-CG 3.63Å; L655-V673 HydrophobicContact CD2-CG1 4.31Å; L655-V673 HydrophobicContact CD2-CG2 4.1Å; L655-W696 HydrophobicContact CD2-CD2 3.92Å; L655-W696 HydrophobicContact CD2-CE3 4.09Å; L655-W696 HydrophobicContact CD2-CH2 3.97Å; L655-W696 HydrophobicContact CD2-CZ2 3.8Å; L655-W696 HydrophobicContact CD2-CZ3 4.1Å
656	S	93.1	Very high	94.2	Very high	88 Å²	88	38.9 Å²	38.9	62%	0.615	25%	0.248	S	C	*	.	S	Bend	trans	-60.6	-32	171.2	58.2	0	0	0	0	113.8	E687	S656-E687 VanDerWaalsContact CB-OE2 3.26Å; S656-E687 WeakPolarHBondContact CB-OE2 3.38Å; S656-E687 PolarHBondContact N-OE2 2.84Å; S656-E687 PolarHBondContact OG-OE2 3.32Å
657	V	90.7	Very high	94.1	Very high	50 Å²	50	35.8 Å²	35.8	30%	0.303	23%	0.226	S	C	.	.	S	Bend	trans	-134.9	124.2	-176.8	-177.6	0	0	0	0	110.3	L655 R659 D678 L683	L655-V657 VanDerWaalsContact C-N 3.26Å; L655-V657 PolarHBondContact O-N 3.11Å; V657-R659 WeakPolarHBondContact O-CG 3.4Å; V657-R659 PolarHBondContact O-N 2.9Å; V657-R659 PolarHBondContact O-NE 2.83Å; V657-R659 VanDerWaalsContact O-NE 3.11Å; V657-D678 HydrophobicContact CG1-CB 3.94Å; V657-L683 HydrophobicContact CG1-CD1 4.32Å
658	P	91.5	Very high	93.7	Very high	53 Å²	53	33.8 Å²	33.8	34%	0.344	22%	0.223	S	C	.	.			trans	-60	131.4	172.9	-16.7	26.6	0	0	0	111.7	L635 S636 D637	L635-P658 HydrophobicContact CB-CB 4.08Å; S636-P658 WeakPolarHBondContact O-CA 3.34Å; D637-P658 HydrophobicContact CB-CB 4.27Å; D637-P658 HydrophobicContact CB-CG 4.04Å
659	R	91.8	Very high	93.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	22%	0.222	C	C	.	.			trans	-155.1	146.2	-171.7	56.1	-178.8	83.9	-177.9	10.3	114	G623 S636 L655 V657 V662 G675 Y677 L683 T685 E687	G623-R659 PolarHBondContact N-O 3.4Å; S636-R659 PolarHBondContact O-N 2.92Å; L655-R659 HydrophobicContact CD1-CG 3.63Å; V657-R659 WeakPolarHBondContact O-CG 3.4Å; V657-R659 PolarHBondContact O-N 2.9Å; V657-R659 PolarHBondContact O-NE 2.83Å; V657-R659 VanDerWaalsContact O-NE 3.11Å; R659-V662 HydrophobicContact CB-CG2 4.44Å; R659-V662 HydrophobicContact CG-CG2 3.78Å; R659-V662 VanDerWaalsContact O-CG2 3.3Å; R659-V662 WeakPolarHBondContact O-CG2 3.43Å; R659-G675 VanDerWaalsContact CD-O 3.22Å; R659-G675 WeakPolarHBondContact CD-O 3.49Å; R659-G675 PolarHBondContact NH1-O 2.89Å; R659-Y677 VanDerWaalsContact CA-O 3.25Å; R659-Y677 WeakPolarHBondContact CA-O 3.46Å; R659-L683 HydrophobicContact CB-CD1 4.06Å; R659-L683 VanDerWaalsContact CZ-CD1 3.41Å; R659-T685 PolarHBondContact NH1-OG1 3Å; R659-T685 PolarHBondContact NH2-OG1 2.88Å; R659-E687 IonicContact CZ-OE1 3.14Å; R659-E687 IonicContact NE-OE1 3.72Å; R659-E687 IonicContact NH1-OE1 2.72Å; R659-E687 IonicContact NH2-OE1 3.36Å; R659-E687 PolarHBondContact NH2-OE1 3.24Å
660	D	90.1	Very high	93	Very high	29 Å²	29	34.2 Å²	34.2	16%	0.155	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-108.3	173.6	171.2	87.6	-15.8	0	0	0	113.6	H624 L635 V662 G676 Y677	H624-D660 HydrophobicContact CB-CB 3.96Å; H624-D660 IonicContact CG-OD2 2.86Å; H624-D660 IonicContact ND1-OD2 3.27Å; L635-D660 HydrophobicContact CD2-CB 3.67Å; D660-V662 PolarHBondContact O-N 2.78Å; D660-G676 VanDerWaalsContact O-CA 3.26Å; D660-G676 WeakPolarHBondContact O-CA 3.38Å; D660-Y677 PolarHBondContact N-O 2.79Å; D660-Y677 PolarHBondContact O-N 3.4Å
661	A	89.8	Confident	92.9	Very high	29 Å²	29	32.3 Å²	32.3	24%	0.24	21%	0.209	C	C	.	.	S	Bend	trans	50.5	43.9	-177.4	0	0	0	0	0	112.6	G608 A707 G708	G608-A661 VanDerWaalsContact O-CA 3.31Å; G608-A661 WeakPolarHBondContact O-CA 3.37Å; G608-A661 PolarHBondContact O-N 2.86Å; A661-A707 HydrophobicContact CB-CB 4.27Å; A661-G708 WeakPolarHBondContact O-CA 3.49Å; A661-G708 PolarHBondContact O-N 2.97Å
662	V	91.1	Very high	93	Very high	9 Å²	9	28.3 Å²	28.3	6%	0.055	18%	0.184	C	C	.	.			trans	-79.5	133.5	-169.4	-164.4	0	0	0	0	110.8	G610 V621 R659 D660 V664 V673	G610-V662 WeakPolarHBondContact CA-O 3.47Å; V621-V662 HydrophobicContact CG1-CG1 4.2Å; R659-V662 HydrophobicContact CB-CG2 4.44Å; R659-V662 HydrophobicContact CG-CG2 3.78Å; R659-V662 VanDerWaalsContact O-CG2 3.3Å; R659-V662 WeakPolarHBondContact O-CG2 3.43Å; D660-V662 PolarHBondContact O-N 2.78Å; V662-V664 HydrophobicContact CG1-CG2 4.03Å; V662-V673 HydrophobicContact CG1-CG1 3.66Å
663	A	93.4	Very high	93	Very high	6 Å²	6	27.9 Å²	27.9	5%	0.05	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	133.1	171.9	0	0	0	0	0	110.4	V673 V674 A709 V711	A663-V673 WeakPolarHBondContact O-CA 3.42Å; A663-V674 PolarHBondContact O-N 2.98Å; A663-A709 WeakPolarHBondContact CB-O 3.42Å; A663-V711 HydrophobicContact CB-CB 3.82Å; A663-V711 HydrophobicContact CB-CG2 3.4Å; A663-V711 VanDerWaalsContact CB-CG2 3.4Å
664	V	95.6	Very high	93	Very high	12 Å²	12	27 Å²	27	7%	0.073	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	137.9	-173.9	-168.7	0	0	0	0	110.3	A612 V621 V662 Y672 V673	A612-V664 HydrophobicContact CB-CB 4.29Å; A612-V664 HydrophobicContact CB-CG1 3.69Å; V621-V664 HydrophobicContact CB-CG2 3.9Å; V621-V664 HydrophobicContact CG1-CG2 4.38Å; V621-V664 HydrophobicContact CG2-CG1 4.18Å; V621-V664 HydrophobicContact CG2-CG2 4Å; V662-V664 HydrophobicContact CG1-CG2 4.03Å; V664-Y672 CarbonylContact C-O 3.59Å; V664-Y672 VanDerWaalsContact CA-O 3.26Å; V664-Y672 WeakPolarHBondContact CA-O 3.48Å; V664-V673 HydrophobicContact CG1-CG2 4.3Å; V664-V673 HydrophobicContact CG2-CG2 4.07Å
665	C	95.4	Very high	92.9	Very high	17 Å²	17	23.6 Å²	23.6	12%	0.115	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	145.2	177.3	-146.4	0	0	0	0	111.9	L430 Y672 V711 V712	L430-C665 HydrophobicContact CD1-CB 3.7Å; C665-Y672 PolarHBondContact N-O 2.84Å; C665-Y672 PolarHBondContact O-N 2.96Å; C665-V711 HydrophobicContact CB-CG1 3.89Å; C665-V712 VanDerWaalsContact SG-CA 3.59Å
666	P	94.3	Very high	92.9	Very high	46 Å²	46	23.2 Å²	23.2	30%	0.299	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	130.7	169.1	31.4	-33.4	0	0	0	110.9	T613 K670 L671 V713	T613-P666 WeakPolarHBondContact O-CG 3.41Å; P666-K670 WeakPolarHBondContact CA-O 3.45Å; P666-L671 HydrophobicContact CB-CD2 4Å; P666-V713 VanDerWaalsContact O-CG2 3.28Å; P666-V713 WeakPolarHBondContact O-CG2 3.34Å
667	L	93.1	Very high	92.8	Very high	3 Å²	3	22.4 Å²	22.4	2%	0.016	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	119.6	171.3	-179.7	74	0	0	0	108.6	V427 L430 Y448 L450 D669 K670 Y672 V713	V427-L667 HydrophobicContact CB-CD1 4.41Å; V427-L667 HydrophobicContact CG2-CD1 3.93Å; V427-L667 HydrophobicContact CG2-CG 4.25Å; L430-L667 HydrophobicContact CB-CD2 4.22Å; Y448-L667 HydrophobicContact CD1-CD2 4.06Å; Y448-L667 HydrophobicContact CE1-CD2 4.04Å; L450-L667 HydrophobicContact CB-CD2 4.36Å; L450-L667 HydrophobicContact CD1-CD2 4.49Å; L450-L667 HydrophobicContact CD2-CD2 4.5Å; L667-D669 PolarHBondContact O-N 2.87Å; L667-K670 PolarHBondContact N-O 2.84Å; L667-K670 PolarHBondContact O-N 3.17Å; L667-Y672 HydrophobicContact CB-CD2 3.68Å; L667-Y672 HydrophobicContact CB-CE2 3.83Å; L667-Y672 HydrophobicContact CD2-CD2 4.34Å; L667-Y672 HydrophobicContact CD2-CE2 4.03Å; L667-Y672 HydrophobicContact CG-CE2 4.36Å; L667-V713 HydrophobicContact CB-CG2 4.15Å; L667-V713 HydrophobicContact CD1-CG1 3.94Å; L667-V713 HydrophobicContact CD1-CG2 3.73Å
668	G	88.4	Confident	92.9	Very high	32 Å²	32	21.9 Å²	21.9	33%	0.33	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	-123.9	-173.4	0	0	0	0	0	112.1	V427	V427-G668 VanDerWaalsContact CG1-CA 3.48Å
669	D	86.2	Confident	92.6	Very high	63 Å²	63	20.8 Å²	20.8	34%	0.337	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	7.4	-179.7	62.8	-44.3	0	0	0	114.4	K421 H614 L667	K421-D669 WeakPolarHBondContact CD-OD2 3.39Å; K421-D669 VanDerWaalsContact CE-CG 3.47Å; K421-D669 WeakPolarHBondContact CE-OD1 3.45Å; K421-D669 WeakPolarHBondContact CE-OD2 3.26Å; K421-D669 IonicContact NZ-OD1 2.92Å; K421-D669 PolarHBondContact NZ-OD1 3.34Å; K421-D669 IonicContact NZ-OD2 3.23Å; K421-D669 PolarHBondContact NZ-OD2 2.78Å; H614-D669 PolarHBondContact CE1-O 2.82Å; H614-D669 PolarHBondContact NE2-O 2.79Å; L667-D669 PolarHBondContact O-N 2.87Å
670	K	92.6	Very high	92.5	Very high	40 Å²	40	28.7 Å²	28.7	17%	0.174	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	162.6	176.9	-62.6	-167.8	-174.4	-179.9	0	113.1	P666 L667 Y672 S688 Y689 E699	P666-K670 WeakPolarHBondContact CA-O 3.45Å; L667-K670 PolarHBondContact N-O 2.84Å; L667-K670 PolarHBondContact O-N 3.17Å; K670-Y672 HydrophobicContact CB-CD2 4.27Å; K670-Y672 HydrophobicContact CB-CE2 3.83Å; K670-Y672 HydrophobicContact CD-CE2 4.49Å; K670-S688 VanDerWaalsContact CD-CB 3.48Å; K670-S688 WeakPolarHBondContact CD-OG 3.34Å; K670-S688 PolarHBondContact NZ-OG 2.89Å; K670-Y689 WeakPolarHBondContact CB-O 3.39Å; K670-E699 IonicContact NZ-OE1 3.55Å; K670-E699 PolarHBondContact NZ-OE1 2.91Å
671	L	95.6	Very high	92.6	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	134.7	159.6	-75.3	170.8	0	0	0	109.5	A612 H614 Y619 P666 S688 Y689	A612-L671 HydrophobicContact CB-CD2 3.47Å; A612-L671 VanDerWaalsContact CB-CD2 3.47Å; H614-L671 HydrophobicContact CB-CD1 4.03Å; H614-L671 HydrophobicContact CB-CD2 3.85Å; H614-L671 HydrophobicContact CB-CG 3.83Å; Y619-L671 HydrophobicContact CD1-CD1 3.79Å; Y619-L671 HydrophobicContact CD2-CD1 3.6Å; Y619-L671 HydrophobicContact CE1-CD1 4.19Å; Y619-L671 HydrophobicContact CE2-CD1 4.01Å; Y619-L671 HydrophobicContact CG-CD1 3.47Å; Y619-L671 VanDerWaalsContact CG-CD1 3.47Å; P666-L671 HydrophobicContact CB-CD2 4Å; L671-S688 CarbonylContact O-C 3.53Å; L671-S688 VanDerWaalsContact O-CA 3.26Å; L671-S688 WeakPolarHBondContact O-CA 3.33Å; L671-Y689 HydrophobicContact CD1-CD1 4.31Å; L671-Y689 PolarHBondContact N-O 2.96Å; L671-Y689 PolarHBondContact O-N 2.74Å
672	Y	96.8	Very high	92.7	Very high	8 Å²	8	32.7 Å²	32.7	3%	0.031	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	133.8	175	-76.7	-103	0	0	0	110.6	L430 Y448 L450 V664 C665 L667 K670 V686 E687 E699	L430-Y672 HydrophobicContact CD2-CG 4.38Å; Y448-Y672 HydrophobicContact CE1-CE1 4.25Å; L450-Y672 WeakPolarHBondContact CD1-OH 3.2Å; V664-Y672 CarbonylContact C-O 3.59Å; V664-Y672 VanDerWaalsContact CA-O 3.26Å; V664-Y672 WeakPolarHBondContact CA-O 3.48Å; C665-Y672 PolarHBondContact N-O 2.84Å; C665-Y672 PolarHBondContact O-N 2.96Å; L667-Y672 HydrophobicContact CB-CD2 3.68Å; L667-Y672 HydrophobicContact CB-CE2 3.83Å; L667-Y672 HydrophobicContact CD2-CD2 4.34Å; L667-Y672 HydrophobicContact CD2-CE2 4.03Å; L667-Y672 HydrophobicContact CG-CE2 4.36Å; K670-Y672 HydrophobicContact CB-CD2 4.27Å; K670-Y672 HydrophobicContact CB-CE2 3.83Å; K670-Y672 HydrophobicContact CD-CE2 4.49Å; Y672-V686 HydrophobicContact CD1-CG1 3.99Å; Y672-E687 WeakPolarHBondContact CA-O 3.29Å; Y672-E699 HydrophobicContact CD1-CG 4.48Å; Y672-E699 HydrophobicContact CE1-CB 4.45Å; Y672-E699 HydrophobicContact CE1-CG 3.89Å
673	V	96.4	Very high	92.9	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	130.5	172.2	165.8	0	0	0	0	107.9	V621 L655 V662 A663 V664 V686 E687 W696	V621-V673 HydrophobicContact CG1-CG2 3.87Å; V621-V673 HydrophobicContact CG2-CG2 4.34Å; L655-V673 HydrophobicContact CD2-CG1 4.31Å; L655-V673 HydrophobicContact CD2-CG2 4.1Å; V662-V673 HydrophobicContact CG1-CG1 3.66Å; A663-V673 WeakPolarHBondContact O-CA 3.42Å; V664-V673 HydrophobicContact CG1-CG2 4.3Å; V664-V673 HydrophobicContact CG2-CG2 4.07Å; V673-V686 CarbonylContact O-C 3.52Å; V673-V686 VanDerWaalsContact O-CA 3.26Å; V673-V686 WeakPolarHBondContact O-CA 3.3Å; V673-V686 WeakPolarHBondContact O-CG1 3.5Å; V673-E687 HydrophobicContact CB-CB 4.38Å; V673-E687 PolarHBondContact N-O 3.18Å; V673-E687 PolarHBondContact O-N 3.06Å; V673-W696 HydrophobicContact CB-CH2 4.42Å; V673-W696 HydrophobicContact CB-CZ3 3.98Å; V673-W696 HydrophobicContact CG2-CE3 4.47Å; V673-W696 HydrophobicContact CG2-CH2 3.34Å; V673-W696 HydrophobicContact CG2-CZ2 4.44Å; V673-W696 HydrophobicContact CG2-CZ3 3.35Å
674	V	96	Very high	93	Very high	1 Å²	1	36 Å²	36	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	120.9	-176.7	-178.9	0	0	0	0	110	L430 W455 A663 V686 V702 V711	L430-V674 HydrophobicContact CD2-CG2 4.14Å; W455-V674 HydrophobicContact CH2-CG1 4.17Å; W455-V674 HydrophobicContact CH2-CG2 4.07Å; W455-V674 HydrophobicContact CZ2-CG1 4.23Å; W455-V674 HydrophobicContact CZ2-CG2 4.08Å; A663-V674 PolarHBondContact O-N 2.98Å; V674-V686 HydrophobicContact CG1-CG2 4.25Å; V674-V686 HydrophobicContact CG2-CG1 4.28Å; V674-V686 HydrophobicContact CG2-CG2 4.33Å; V674-V702 HydrophobicContact CG1-CB 4.37Å; V674-V702 HydrophobicContact CG1-CG1 4.14Å; V674-V711 HydrophobicContact CB-CG2 3.96Å; V674-V711 HydrophobicContact CG1-CG2 4.26Å; V674-V711 HydrophobicContact CG2-CG1 4.27Å; V674-V711 HydrophobicContact CG2-CG2 4.12Å
675	G	94.6	Very high	93	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.201	C	C	.	.			trans	60.6	-136.8	174.4	0	0	0	0	0	113.7	R659 L683 T685	R659-G675 VanDerWaalsContact CD-O 3.22Å; R659-G675 WeakPolarHBondContact CD-O 3.49Å; R659-G675 PolarHBondContact NH1-O 2.89Å; G675-L683 WeakPolarHBondContact CA-O 3.31Å; G675-T685 PolarHBondContact N-O 3.45Å
676	G	94	Very high	93.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.196	C	C	.	.			trans	106.9	-173.3	-167.8	0	0	0	0	0	112	D660 L683 R706	D660-G676 VanDerWaalsContact O-CA 3.26Å; D660-G676 WeakPolarHBondContact O-CA 3.38Å; G676-L683 PolarHBondContact O-N 2.76Å; G676-R706 PolarHBondContact N-O 3.27Å
677	Y	92.3	Very high	93.2	Very high	71 Å²	71	34.2 Å²	34.2	28%	0.278	18%	0.184	S	C	.	.	B	Isolated β-bridge	trans	-128	129.5	176.2	176	-109.1	0	0	0	110.5	R659 D660 G679 T681 Y682	R659-Y677 VanDerWaalsContact CA-O 3.25Å; R659-Y677 WeakPolarHBondContact CA-O 3.46Å; D660-Y677 PolarHBondContact N-O 2.79Å; D660-Y677 PolarHBondContact O-N 3.4Å; Y677-G679 VanDerWaalsContact CE1-CA 3.45Å; Y677-G679 VanDerWaalsContact CZ-C 3.45Å; Y677-G679 VanDerWaalsContact OH-C 3.32Å; Y677-G679 PolarHBondContact OH-O 2.87Å; Y677-G679 VanDerWaalsContact OH-O 3.14Å; Y677-T681 WeakPolarHBondContact CD2-O 3.41Å; Y677-Y682 AromaticContact CD2-CD1 3.99Å; Y677-Y682 HydrophobicContact CD2-CD1 3.99Å; Y677-Y682 HydrophobicContact CD2-CE1 4.02Å; Y677-Y682 HydrophobicContact CD2-CG 4.42Å
678	D	91.1	Very high	93.3	Very high	39 Å²	39	34.1 Å²	34.1	21%	0.209	18%	0.183	C	C	.	.			trans	-94.4	4.1	-174	67.7	6.2	0	0	0	114	L635 V657 H680 T681 L683	L635-D678 WeakPolarHBondContact CD1-O 3.4Å; V657-D678 HydrophobicContact CG1-CB 3.94Å; D678-H680 WeakPolarHBondContact OD1-CA 3.15Å; D678-H680 WeakPolarHBondContact OD1-CB 3.42Å; D678-H680 PolarHBondContact OD1-N 3.44Å; D678-T681 PolarHBondContact N-O 2.87Å; D678-T681 PolarHBondContact OD1-N 2.77Å; D678-T681 PolarHBondContact OD2-OG1 2.9Å; D678-L683 HydrophobicContact CB-CD1 4.22Å; D678-L683 HydrophobicContact CB-CD2 4.12Å; D678-L683 HydrophobicContact CB-CG 4.27Å
679	G	87.3	Confident	93.8	Very high	30 Å²	30	32.7 Å²	32.7	31%	0.309	17%	0.168	S	C	.	.	S	Bend	trans	96.3	-7.5	-174.4	0	0	0	0	0	114.3	L635 Y677	L635-G679 VanDerWaalsContact CD1-N 3.34Å; Y677-G679 VanDerWaalsContact CE1-CA 3.45Å; Y677-G679 VanDerWaalsContact CZ-C 3.45Å; Y677-G679 VanDerWaalsContact OH-C 3.32Å; Y677-G679 PolarHBondContact OH-O 2.87Å; Y677-G679 VanDerWaalsContact OH-O 3.14Å
680	H	88.4	Confident	94.1	Very high	166 Å²	166	31.2 Å²	31.2	77%	0.769	16%	0.16	S	C	*	.	S	Bend	trans	-133.5	-43.9	-179	-59.5	-58	0	0	0	112.4	D678	D678-H680 WeakPolarHBondContact OD1-CA 3.15Å; D678-H680 WeakPolarHBondContact OD1-CB 3.42Å; D678-H680 PolarHBondContact OD1-N 3.44Å
681	T	91.9	Very high	93.9	Very high	71 Å²	71	30.7 Å²	30.7	44%	0.436	16%	0.162	S	C	.	.	S	Bend	trans	-133.7	151.3	-170.1	76.3	0	0	0	0	112.5	Y677 D678 L683	Y677-T681 WeakPolarHBondContact CD2-O 3.41Å; D678-T681 PolarHBondContact N-O 2.87Å; D678-T681 PolarHBondContact OD1-N 2.77Å; D678-T681 PolarHBondContact OD2-OG1 2.9Å; T681-L683 PolarHBondContact O-N 3.41Å
682	Y	93.5	Very high	93.5	Very high	72 Å²	72	38.3 Å²	38.3	28%	0.282	20%	0.198	S	C	.	.	B	Isolated β-bridge	trans	-83.8	109	170.3	-59.2	-80.3	0	0	0	108.2	M436 D437 Y677 G705 A707	M436-Y682 HydrophobicContact CB-CD1 4.48Å; M436-Y682 HydrophobicContact CB-CE1 3.98Å; M436-Y682 HydrophobicContact CG-CD1 4.46Å; M436-Y682 HydrophobicContact CG-CE1 3.63Å; M436-Y682 WeakPolarHBondContact O-CD1 3.41Å; M436-Y682 HydrophobicContact SD-CE1 4.02Å; M436-Y682 PolarHBondContact SD-OH 3.49Å; M436-Y682 VanDerWaalsContact SD-OH 3.41Å; D437-Y682 VanDerWaalsContact O-CE2 3.29Å; D437-Y682 WeakPolarHBondContact O-CE2 3.33Å; Y677-Y682 AromaticContact CD2-CD1 3.99Å; Y677-Y682 HydrophobicContact CD2-CD1 3.99Å; Y677-Y682 HydrophobicContact CD2-CE1 4.02Å; Y677-Y682 HydrophobicContact CD2-CG 4.42Å; Y682-G705 WeakPolarHBondContact O-CA 3.4Å; Y682-A707 HydrophobicContact CD1-CB 3.74Å; Y682-A707 HydrophobicContact CE1-CB 4.28Å
683	L	94.4	Very high	93.2	Very high	14 Å²	14	43.9 Å²	43.9	7%	0.073	22%	0.223	C	C	.	.			trans	-68.1	139.9	-171.7	-62.7	178.1	0	0	0	111.3	V657 R659 G675 G676 D678 T681 G705 R706	V657-L683 HydrophobicContact CG1-CD1 4.32Å; R659-L683 HydrophobicContact CB-CD1 4.06Å; R659-L683 VanDerWaalsContact CZ-CD1 3.41Å; G675-L683 WeakPolarHBondContact CA-O 3.31Å; G676-L683 PolarHBondContact O-N 2.76Å; D678-L683 HydrophobicContact CB-CD1 4.22Å; D678-L683 HydrophobicContact CB-CD2 4.12Å; D678-L683 HydrophobicContact CB-CG 4.27Å; T681-L683 PolarHBondContact O-N 3.41Å; L683-G705 CarbonylContact O-C 3.6Å; L683-G705 VanDerWaalsContact O-CA 3.26Å; L683-G705 WeakPolarHBondContact O-CA 3.5Å; L683-R706 PolarHBondContact O-N 2.81Å
684	N	95.2	Very high	93.1	Very high	70 Å²	70	47.4 Å²	47.4	37%	0.374	24%	0.241	S	C	.	.			trans	-105.5	-2.9	166.6	72.2	-34.6	0	0	0	112.8	P701 V702	N684-P701 CarbonylContact O-C 3.51Å; N684-P701 VanDerWaalsContact O-CA 3.26Å; N684-P701 WeakPolarHBondContact O-CA 3.28Å; N684-P701 WeakPolarHBondContact O-CB 3.11Å; N684-V702 HydrophobicContact CB-CG1 4.11Å; N684-V702 WeakPolarHBondContact CB-O 3.17Å; N684-V702 WeakPolarHBondContact O-CG1 3.34Å; N684-V702 PolarHBondContact O-N 3.36Å
685	T	95.9	Very high	93.1	Very high	30 Å²	30	52 Å²	52	18%	0.184	26%	0.263	C	S	.	.			trans	-62.3	144.9	178.3	56.2	0	0	0	0	111.3	R659 G675	R659-T685 PolarHBondContact NH1-OG1 3Å; R659-T685 PolarHBondContact NH2-OG1 2.88Å; G675-T685 PolarHBondContact N-O 3.45Å
686	V	96.8	Very high	93.2	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.012	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	132.3	173.4	-179.9	0	0	0	0	107.2	W455 Y672 V673 V674 E699	W455-V686 HydrophobicContact CZ2-CG2 3.9Å; Y672-V686 HydrophobicContact CD1-CG1 3.99Å; V673-V686 CarbonylContact O-C 3.52Å; V673-V686 VanDerWaalsContact O-CA 3.26Å; V673-V686 WeakPolarHBondContact O-CA 3.3Å; V673-V686 WeakPolarHBondContact O-CG1 3.5Å; V674-V686 HydrophobicContact CG1-CG2 4.25Å; V674-V686 HydrophobicContact CG2-CG1 4.28Å; V674-V686 HydrophobicContact CG2-CG2 4.33Å; V686-E699 HydrophobicContact CB-CB 4.22Å; V686-E699 HydrophobicContact CG1-CB 3.95Å; V686-E699 PolarHBondContact O-N 3.18Å
687	E	96.7	Very high	93.3	Very high	6 Å²	6	56.7 Å²	56.7	3%	0.028	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	140.1	177	-69.4	166.5	-83.2	0	0	109.4	S656 R659 Y672 V673 W696 N697	S656-E687 VanDerWaalsContact CB-OE2 3.26Å; S656-E687 WeakPolarHBondContact CB-OE2 3.38Å; S656-E687 PolarHBondContact N-OE2 2.84Å; S656-E687 PolarHBondContact OG-OE2 3.32Å; R659-E687 IonicContact CZ-OE1 3.14Å; R659-E687 IonicContact NE-OE1 3.72Å; R659-E687 IonicContact NH1-OE1 2.72Å; R659-E687 IonicContact NH2-OE1 3.36Å; R659-E687 PolarHBondContact NH2-OE1 3.24Å; Y672-E687 WeakPolarHBondContact CA-O 3.29Å; V673-E687 HydrophobicContact CB-CB 4.38Å; V673-E687 PolarHBondContact N-O 3.18Å; V673-E687 PolarHBondContact O-N 3.06Å; E687-W696 HydrophobicContact CB-CE3 3.72Å; E687-W696 HydrophobicContact CB-CZ3 4.26Å; E687-N697 CarbonylContact C-O 3.5Å; E687-N697 VanDerWaalsContact CA-O 3.25Å; E687-N697 WeakPolarHBondContact CA-O 3.4Å
688	S	96.4	Very high	93.5	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	136.6	172.8	74.8	0	0	0	0	112.7	K670 L671 W696 N697 E699	K670-S688 VanDerWaalsContact CD-CB 3.48Å; K670-S688 WeakPolarHBondContact CD-OG 3.34Å; K670-S688 PolarHBondContact NZ-OG 2.89Å; L671-S688 CarbonylContact O-C 3.53Å; L671-S688 VanDerWaalsContact O-CA 3.26Å; L671-S688 WeakPolarHBondContact O-CA 3.33Å; S688-W696 CarbonylContact O-C 3.57Å; S688-W696 WeakPolarHBondContact O-CA 3.42Å; S688-N697 PolarHBondContact N-O 2.79Å; S688-N697 PolarHBondContact O-N 2.6Å; S688-E699 WeakPolarHBondContact CB-OE1 3.5Å; S688-E699 WeakPolarHBondContact OG-CG 3.3Å; S688-E699 PolarHBondContact OG-OE1 3.14Å
689	Y	96.9	Very high	93.7	Very high	3 Å²	3	60.4 Å²	60.4	1%	0.012	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	125.5	-177.4	175.7	-106	0	0	0	111.4	Y619 A653 K670 L671 A691 D694 E695 W696	Y619-Y689 HydrophobicContact CE1-CD1 4.37Å; Y619-Y689 AromaticContact CE1-CE1 3.63Å; Y619-Y689 HydrophobicContact CE1-CE1 3.63Å; A653-Y689 HydrophobicContact CB-CE2 4.45Å; K670-Y689 WeakPolarHBondContact CB-O 3.39Å; L671-Y689 HydrophobicContact CD1-CD1 4.31Å; L671-Y689 PolarHBondContact N-O 2.96Å; L671-Y689 PolarHBondContact O-N 2.74Å; Y689-A691 HydrophobicContact CD1-CB 4.08Å; Y689-A691 VanDerWaalsContact CE1-CA 3.48Å; Y689-A691 HydrophobicContact CE1-CB 3.6Å; Y689-D694 VanDerWaalsContact CE2-OD1 3.28Å; Y689-D694 WeakPolarHBondContact CE2-OD1 3.41Å; Y689-D694 PolarHBondContact OH-OD1 3.11Å; Y689-E695 WeakPolarHBondContact CA-O 3.32Å; Y689-W696 HydrophobicContact CD2-CD2 4.06Å; Y689-W696 AromaticContact CD2-CE2 3.67Å; Y689-W696 HydrophobicContact CD2-CG 4.29Å; Y689-W696 HydrophobicContact CD2-CZ2 4.02Å; Y689-W696 AromaticContact CD2-NE1 3.69Å; Y689-W696 HydrophobicContact CG-CD2 4.4Å; Y689-W696 HydrophobicContact CG-CH2 4.33Å; Y689-W696 HydrophobicContact CG-CZ2 4.04Å
690	D	92.8	Very high	94.1	Very high	32 Å²	32	61.4 Å²	61.4	17%	0.171	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	104.7	169.7	-174.7	-29.9	0	0	0	109.3	Q692 K693 D694 E695	D690-Q692 PolarHBondContact O-N 2.9Å; D690-Q692 WeakPolarHBondContact OD1-CA 3.46Å; D690-Q692 WeakPolarHBondContact OD1-CB 3.22Å; D690-Q692 PolarHBondContact OD1-N 3.5Å; D690-K693 HydrophobicContact CB-CB 4.3Å; D690-K693 HydrophobicContact CB-CD 4.46Å; D690-K693 HydrophobicContact CB-CG 4.43Å; D690-K693 PolarHBondContact O-N 3.3Å; D690-K693 PolarHBondContact OD1-N 2.93Å; D690-K693 WeakPolarHBondContact OD2-CD 3.48Å; D690-K693 WeakPolarHBondContact OD2-CE 3.37Å; D690-K693 IonicContact OD2-NZ 3.14Å; D690-D694 PolarHBondContact O-N 2.88Å; D690-E695 PolarHBondContact N-O 2.74Å; D690-E695 PolarHBondContact O-N 2.88Å
691	A	89.4	Confident	94.5	Very high	28 Å²	28	56.2 Å²	56.2	23%	0.231	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-4.4	-177.8	0	0	0	0	0	114.6	Y689	Y689-A691 HydrophobicContact CD1-CB 4.08Å; Y689-A691 VanDerWaalsContact CE1-CA 3.48Å; Y689-A691 HydrophobicContact CE1-CB 3.6Å
692	Q	87.4	Confident	94.7	Very high	161 Å²	161	52.9 Å²	52.9	75%	0.752	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-32.5	172.4	-56.5	-171.7	10.9	0	0	111.7	D690	D690-Q692 PolarHBondContact O-N 2.9Å; D690-Q692 WeakPolarHBondContact OD1-CA 3.46Å; D690-Q692 WeakPolarHBondContact OD1-CB 3.22Å; D690-Q692 PolarHBondContact OD1-N 3.5Å
693	K	90.7	Very high	94.6	Very high	126 Å²	126	54.7 Å²	54.7	55%	0.548	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-23.1	179.5	-58.4	-177.4	-166.9	169.7	0	114.5	D690 E695	D690-K693 HydrophobicContact CB-CB 4.3Å; D690-K693 HydrophobicContact CB-CD 4.46Å; D690-K693 HydrophobicContact CB-CG 4.43Å; D690-K693 PolarHBondContact O-N 3.3Å; D690-K693 PolarHBondContact OD1-N 2.93Å; D690-K693 WeakPolarHBondContact OD2-CD 3.48Å; D690-K693 WeakPolarHBondContact OD2-CE 3.37Å; D690-K693 IonicContact OD2-NZ 3.14Å; K693-E695 HydrophobicContact CB-CB 4.07Å; K693-E695 HydrophobicContact CB-CG 3.83Å; K693-E695 WeakPolarHBondContact CD-OE2 3.4Å
694	D	94.1	Very high	94.5	Very high	74 Å²	74	56.6 Å²	56.6	40%	0.396	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	49.9	-165.5	-160.8	13.2	0	0	0	111.4	V652 A653 Y689 D690	V652-D694 WeakPolarHBondContact CB-OD1 3.33Å; A653-D694 WeakPolarHBondContact CB-O 3.18Å; A653-D694 VanDerWaalsContact CB-OD1 3.28Å; A653-D694 WeakPolarHBondContact CB-OD1 3.39Å; A653-D694 PolarHBondContact N-OD1 2.64Å; Y689-D694 VanDerWaalsContact CE2-OD1 3.28Å; Y689-D694 WeakPolarHBondContact CE2-OD1 3.41Å; Y689-D694 PolarHBondContact OH-OD1 3.11Å; D690-D694 PolarHBondContact O-N 2.88Å
695	E	96.2	Very high	94.4	Very high	97 Å²	97	54 Å²	54	45%	0.453	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	139	-176.1	-69.5	-179.1	153.6	0	0	112	Y689 D690 K693	Y689-E695 WeakPolarHBondContact CA-O 3.32Å; D690-E695 PolarHBondContact N-O 2.74Å; D690-E695 PolarHBondContact O-N 2.88Å; K693-E695 HydrophobicContact CB-CB 4.07Å; K693-E695 HydrophobicContact CB-CG 3.83Å; K693-E695 WeakPolarHBondContact CD-OE2 3.4Å
696	W	96.4	Very high	94.2	Very high	40 Å²	40	52.6 Å²	52.6	15%	0.152	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	139.6	168.3	-69.4	94.7	0	0	0	110.7	V621 V639 A653 L655 V673 E687 S688 Y689	V621-W696 HydrophobicContact CG2-CH2 4.42Å; V639-W696 HydrophobicContact CG1-CZ2 4.42Å; V639-W696 HydrophobicContact CG2-CZ2 3.91Å; A653-W696 PolarHBondContact O-NE1 2.84Å; L655-W696 HydrophobicContact CD2-CD2 3.92Å; L655-W696 HydrophobicContact CD2-CE3 4.09Å; L655-W696 HydrophobicContact CD2-CH2 3.97Å; L655-W696 HydrophobicContact CD2-CZ2 3.8Å; L655-W696 HydrophobicContact CD2-CZ3 4.1Å; V673-W696 HydrophobicContact CB-CH2 4.42Å; V673-W696 HydrophobicContact CB-CZ3 3.98Å; V673-W696 HydrophobicContact CG2-CE3 4.47Å; V673-W696 HydrophobicContact CG2-CH2 3.34Å; V673-W696 HydrophobicContact CG2-CZ2 4.44Å; V673-W696 HydrophobicContact CG2-CZ3 3.35Å; E687-W696 HydrophobicContact CB-CE3 3.72Å; E687-W696 HydrophobicContact CB-CZ3 4.26Å; S688-W696 CarbonylContact O-C 3.57Å; S688-W696 WeakPolarHBondContact O-CA 3.42Å; Y689-W696 HydrophobicContact CD2-CD2 4.06Å; Y689-W696 AromaticContact CD2-CE2 3.67Å; Y689-W696 HydrophobicContact CD2-CG 4.29Å; Y689-W696 HydrophobicContact CD2-CZ2 4.02Å; Y689-W696 AromaticContact CD2-NE1 3.69Å; Y689-W696 HydrophobicContact CG-CD2 4.4Å; Y689-W696 HydrophobicContact CG-CH2 4.33Å; Y689-W696 HydrophobicContact CG-CZ2 4.04Å
697	N	96.4	Very high	94	Very high	59 Å²	59	52.9 Å²	52.9	32%	0.316	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	139	178.7	-60.4	-106	0	0	0	108.5	E687 S688	E687-N697 CarbonylContact C-O 3.5Å; E687-N697 VanDerWaalsContact CA-O 3.25Å; E687-N697 WeakPolarHBondContact CA-O 3.4Å; S688-N697 PolarHBondContact N-O 2.79Å; S688-N697 PolarHBondContact O-N 2.6Å
698	E	95.9	Very high	93.7	Very high	153 Å²	153	53.8 Å²	53.8	72%	0.715	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	136	170.7	-171.6	168.3	-156.3	0	0	110
699	E	96	Very high	93.4	Very high	35 Å²	35	54.2 Å²	54.2	16%	0.164	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	172	-178.7	-63	-80.7	-174.2	0	0	109.6	K670 Y672 V686 S688	K670-E699 IonicContact NZ-OE1 3.55Å; K670-E699 PolarHBondContact NZ-OE1 2.91Å; Y672-E699 HydrophobicContact CD1-CG 4.48Å; Y672-E699 HydrophobicContact CE1-CB 4.45Å; Y672-E699 HydrophobicContact CE1-CG 3.89Å; V686-E699 HydrophobicContact CB-CB 4.22Å; V686-E699 HydrophobicContact CG1-CB 3.95Å; V686-E699 PolarHBondContact O-N 3.18Å; S688-E699 WeakPolarHBondContact CB-OE1 3.5Å; S688-E699 WeakPolarHBondContact OG-CG 3.3Å; S688-E699 PolarHBondContact OG-OE1 3.14Å
700	V	95.7	Very high	93.2	Very high	50 Å²	50	55.1 Å²	55.1	30%	0.303	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-58.1	123.1	-176	178.3	0	0	0	0	111	N453 W455	N453-V700 WeakPolarHBondContact OD1-CG2 3.42Å; W455-V700 PolarHBondContact NE1-O 3.13Å
701	P	96.1	Very high	93.4	Very high	58 Å²	58	54.2 Å²	54.2	38%	0.377	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-67.4	150.6	-174.8	26.8	-35.2	0	0	0	112.1	N684	N684-P701 CarbonylContact O-C 3.51Å; N684-P701 VanDerWaalsContact O-CA 3.26Å; N684-P701 WeakPolarHBondContact O-CA 3.28Å; N684-P701 WeakPolarHBondContact O-CB 3.11Å
702	V	94.7	Very high	93.7	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.006	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-68.4	148.2	173	63	0	0	0	0	109.9	A432 E446 W455 V674 N684 I704 R706	A432-V702 HydrophobicContact CB-CG2 4.49Å; E446-V702 HydrophobicContact CB-CG2 4.36Å; E446-V702 VanDerWaalsContact CD-CG2 3.41Å; E446-V702 HydrophobicContact CG-CG2 4.41Å; E446-V702 WeakPolarHBondContact OE1-CG2 3.39Å; E446-V702 VanDerWaalsContact OE2-CG2 3.29Å; E446-V702 WeakPolarHBondContact OE2-CG2 3.49Å; W455-V702 HydrophobicContact CD2-CB 3.98Å; W455-V702 HydrophobicContact CD2-CG2 3.91Å; W455-V702 HydrophobicContact CE3-CB 4.44Å; W455-V702 HydrophobicContact CE3-CG2 3.92Å; W455-V702 HydrophobicContact CG-CB 4.35Å; W455-V702 HydrophobicContact CG-CG2 4.42Å; W455-V702 HydrophobicContact CZ2-CB 4.22Å; W455-V702 HydrophobicContact CZ3-CG2 4.27Å; V674-V702 HydrophobicContact CG1-CB 4.37Å; V674-V702 HydrophobicContact CG1-CG1 4.14Å; N684-V702 HydrophobicContact CB-CG1 4.11Å; N684-V702 WeakPolarHBondContact CB-O 3.17Å; N684-V702 WeakPolarHBondContact O-CG1 3.34Å; N684-V702 PolarHBondContact O-N 3.36Å; V702-I704 VanDerWaalsContact C-N 3.28Å; V702-I704 WeakPolarHBondContact CG1-O 3.2Å; V702-I704 PolarHBondContact O-N 2.93Å; V702-R706 HydrophobicContact CG1-CG 4.37Å
703	N	93.4	Very high	94.1	Very high	109 Å²	109	47.6 Å²	47.6	58%	0.583	26%	0.256	S	S	*	.	S	Bend	trans	-66.6	-32.1	-172.6	-63.3	-82.3	0	0	0	112.2	E446 W455	E446-N703 VanDerWaalsContact OE2-CB 3.24Å; E446-N703 WeakPolarHBondContact OE2-CB 3.28Å; E446-N703 PolarHBondContact OE2-N 3.35Å; E446-N703 PolarHBondContact OE2-ND2 3.04Å; W455-N703 VanDerWaalsContact CB-ND2 3.31Å; W455-N703 WeakPolarHBondContact CB-ND2 3.25Å; W455-N703 PolarHBondContact O-ND2 2.88Å
704	I	91.1	Very high	94.2	Very high	55 Å²	55	41.6 Å²	41.6	28%	0.282	23%	0.23	S	C	.	.	S	Bend	trans	-118.9	120.4	177.8	-57.3	176.6	0	0	0	110.6	D437 T444 E446 V702 R706	D437-I704 HydrophobicContact CB-CG2 4.11Å; T444-I704 HydrophobicContact CG2-CD1 3.67Å; E446-I704 PolarHBondContact OE1-N 3.38Å; E446-I704 VanDerWaalsContact OE1-N 3.11Å; V702-I704 VanDerWaalsContact C-N 3.28Å; V702-I704 WeakPolarHBondContact CG1-O 3.2Å; V702-I704 PolarHBondContact O-N 2.93Å; I704-R706 WeakPolarHBondContact O-CG 3.45Å; I704-R706 PolarHBondContact O-NE 3.45Å
705	G	92.3	Very high	93.8	Very high	16 Å²	16	43.1 Å²	43.1	17%	0.165	23%	0.233	C	C	.	.			trans	-62.9	129.1	174.5	0	0	0	0	0	112.4	D437 Y682 L683	D437-G705 WeakPolarHBondContact CB-O 3.48Å; Y682-G705 WeakPolarHBondContact O-CA 3.4Å; L683-G705 CarbonylContact O-C 3.6Å; L683-G705 VanDerWaalsContact O-CA 3.26Å; L683-G705 WeakPolarHBondContact O-CA 3.5Å
706	R	93.1	Very high	92.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.228	C	C	.	.			trans	-150.6	134.2	-161.1	58.1	-178.2	68.6	-141.5	10.1	113	G434 M436 T444 E446 G676 L683 V702 I704 A709	G434-R706 PolarHBondContact O-NH1 3.01Å; M436-R706 CarbonylContact O-C 3.54Å; M436-R706 WeakPolarHBondContact O-CA 3.38Å; T444-R706 PolarHBondContact O-NH1 3.13Å; T444-R706 PolarHBondContact OG1-NH2 3.1Å; E446-R706 IonicContact OE1-CZ 2.89Å; E446-R706 IonicContact OE1-NH2 3.84Å; E446-R706 PolarHBondContact OE1-NH2 3.37Å; G676-R706 PolarHBondContact N-O 3.27Å; L683-R706 PolarHBondContact O-N 2.81Å; V702-R706 HydrophobicContact CG1-CG 4.37Å; I704-R706 WeakPolarHBondContact O-CG 3.45Å; I704-R706 PolarHBondContact O-NE 3.45Å; R706-A709 HydrophobicContact CB-CB 4.34Å; R706-A709 HydrophobicContact CG-CB 4.05Å
707	A	92.5	Very high	90.4	Very high	7 Å²	7	48.6 Å²	48.6	6%	0.058	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-121	142.6	172.4	0	0	0	0	0	111.3	M436 A661 Y682 A709	M436-A707 PolarHBondContact N-O 3.33Å; M436-A707 PolarHBondContact O-N 3.04Å; A661-A707 HydrophobicContact CB-CB 4.27Å; Y682-A707 HydrophobicContact CD1-CB 3.74Å; Y682-A707 HydrophobicContact CE1-CB 4.28Å; A707-A709 PolarHBondContact O-N 2.91Å
708	G	89.7	Confident	90.1	Very high	25 Å²	25	48.1 Å²	48.1	26%	0.258	26%	0.26	S	S	.	.	S	Bend	trans	64.8	25	-175.4	0	0	0	0	0	113.4	A661	A661-G708 WeakPolarHBondContact O-CA 3.49Å; A661-G708 PolarHBondContact O-N 2.97Å
709	A	90.9	Very high	89.8	Confident	10 Å²	10	42.6 Å²	42.6	8%	0.083	24%	0.236	C	C	.	.			trans	-69.6	155.1	165.1	0	0	0	0	0	109.9	G434 A663 R706 A707	G434-A709 WeakPolarHBondContact O-CB 3.29Å; A663-A709 WeakPolarHBondContact CB-O 3.42Å; R706-A709 HydrophobicContact CB-CB 4.34Å; R706-A709 HydrophobicContact CG-CB 4.05Å; A707-A709 PolarHBondContact O-N 2.91Å
710	C	93.3	Very high	89.4	Confident	21 Å²	21	43 Å²	43	14%	0.142	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	137	164.8	-66	0	0	0	0	109.4	V433 F468 V470	V433-C710 HydrophobicContact CB-CB 4.47Å; V433-C710 PolarHBondContact N-O 2.97Å; V433-C710 PolarHBondContact O-N 2.79Å; V433-C710 VanDerWaalsContact O-N 3.11Å; F468-C710 HydrophobicContact CE2-CB 4.15Å; F468-C710 PolarHBondContact O-SG 3.4Å; V470-C710 HydrophobicContact CB-CB 3.68Å; V470-C710 HydrophobicContact CG2-CB 3.43Å; V470-C710 VanDerWaalsContact CG2-CB 3.43Å
711	V	95.5	Very high	89.1	Confident	13 Å²	13	42.6 Å²	42.6	8%	0.079	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	127.2	174.7	175.2	0	0	0	0	109.8	L430 Y431 A432 A663 C665 V674	L430-V711 HydrophobicContact CD1-CG1 3.33Å; L430-V711 HydrophobicContact CD2-CG1 4.16Å; L430-V711 HydrophobicContact CG-CG1 3.63Å; Y431-V711 VanDerWaalsContact O-CA 3.31Å; Y431-V711 WeakPolarHBondContact O-CA 3.2Å; A432-V711 HydrophobicContact CB-CG2 4.04Å; A663-V711 HydrophobicContact CB-CB 3.82Å; A663-V711 HydrophobicContact CB-CG2 3.4Å; A663-V711 VanDerWaalsContact CB-CG2 3.4Å; C665-V711 HydrophobicContact CB-CG1 3.89Å; V674-V711 HydrophobicContact CB-CG2 3.96Å; V674-V711 HydrophobicContact CG1-CG2 4.26Å; V674-V711 HydrophobicContact CG2-CG1 4.27Å; V674-V711 HydrophobicContact CG2-CG2 4.12Å
712	V	95.9	Very high	88.6	Confident	18 Å²	18	41.6 Å²	41.6	11%	0.109	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	153.9	-176.7	-64.3	0	0	0	0	110.7	Y431 V470 V472 L477 C665	Y431-V712 PolarHBondContact N-O 2.74Å; Y431-V712 PolarHBondContact O-N 2.71Å; V470-V712 HydrophobicContact CB-CG1 4.29Å; V470-V712 HydrophobicContact CG1-CG1 4.07Å; V470-V712 HydrophobicContact CG1-CG2 4Å; V472-V712 HydrophobicContact CG2-CB 3.67Å; V472-V712 HydrophobicContact CG2-CG1 4.33Å; V472-V712 HydrophobicContact CG2-CG2 3.56Å; L477-V712 HydrophobicContact CD2-CG2 3.66Å; C665-V712 VanDerWaalsContact SG-CA 3.59Å
713	V	95.2	Very high	88.2	Confident	32 Å²	32	44.3 Å²	44.3	19%	0.194	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	134	172.5	172.9	0	0	0	0	110.8	A429 L430 P666 L667	A429-V713 CarbonylContact O-C 3.55Å; A429-V713 VanDerWaalsContact O-CA 3.31Å; A429-V713 WeakPolarHBondContact O-CA 3.44Å; L430-V713 HydrophobicContact CB-CG2 4.47Å; L430-V713 HydrophobicContact CD1-CG2 3.62Å; P666-V713 VanDerWaalsContact O-CG2 3.28Å; P666-V713 WeakPolarHBondContact O-CG2 3.34Å; L667-V713 HydrophobicContact CB-CG2 4.15Å; L667-V713 HydrophobicContact CD1-CG1 3.94Å; L667-V713 HydrophobicContact CD1-CG2 3.73Å
714	V	92.9	Very high	87.8	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.9	173	-176.2	0	0	0	0	109.2	G428 A429 Y431 V472 N475 L477 L716	G428-V714 CarbonylContact C-O 3.45Å; G428-V714 WeakPolarHBondContact CA-O 3.38Å; A429-V714 PolarHBondContact N-O 2.89Å; A429-V714 PolarHBondContact O-N 2.76Å; Y431-V714 HydrophobicContact CD2-CB 3.95Å; Y431-V714 HydrophobicContact CD2-CG2 3.67Å; Y431-V714 HydrophobicContact CE2-CB 3.69Å; Y431-V714 HydrophobicContact CE2-CG2 3.84Å; Y431-V714 HydrophobicContact CG-CG2 4.32Å; V472-V714 HydrophobicContact CG1-CG2 4.1Å; V472-V714 HydrophobicContact CG2-CG2 4.01Å; N475-V714 HydrophobicContact CB-CG1 3.8Å; N475-V714 WeakPolarHBondContact O-CG1 3.38Å; L477-V714 HydrophobicContact CD2-CG2 3.47Å; L477-V714 VanDerWaalsContact CD2-CG2 3.47Å; V714-L716 HydrophobicContact CG1-CD2 3.69Å; V714-L716 HydrophobicContact CG1-CG 4.05Å; V714-L716 PolarHBondContact O-N 3.21Å
715	K	85.7	Confident	87.6	Confident	105 Å²	105	38.5 Å²	38.5	46%	0.457	21%	0.212	S	C	.	.			trans	-96.2	79.8	175.1	-68.2	-167.9	176.3	-166.2	0	110.2	V427 N475 H717	V427-K715 WeakPolarHBondContact O-CE 3.08Å; N475-K715 PolarHBondContact ND2-O 2.83Å; N475-K715 PolarHBondContact OD1-N 3.47Å; N475-K715 PolarHBondContact OD1-O 2.85Å; K715-H717 PolarHBondContact O-N 3.06Å
716	L	66.5	Low	87.2	Confident	67 Å²	67	40.4 Å²	40.4	35%	0.351	22%	0.216	S	C	.	.			trans	-64.7	130.3	167.6	-58.9	-175.9	0	0	0	108.8	Y431 N475 P497 V498 V714	Y431-L716 WeakPolarHBondContact OH-CD1 3.47Å; N475-L716 HydrophobicContact CB-CD2 4.22Å; P497-L716 HydrophobicContact CG-CD2 4.08Å; V498-L716 HydrophobicContact CG2-CD1 4.37Å; V498-L716 HydrophobicContact CG2-CD2 3.79Å; V714-L716 HydrophobicContact CG1-CD2 3.69Å; V714-L716 HydrophobicContact CG1-CG 4.05Å; V714-L716 PolarHBondContact O-N 3.21Å
717	H	55	Low	86.6	Confident	186 Å²	186	44.1 Å²	44.1	86%	0.861	24%	0.236	S	C	*	.			trans	-112.1	0	177	-69	-60.2	0	0	0	109.1	K715	K715-H717 PolarHBondContact O-N 3.06Å

Retrieved 717 of 717 residues in 343.4 ms (Link to these results)

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