A0A096MIW3_RAT Loading...

SUN domain containing ossification factor

AlphaFold DB , UniProt , Accession A0A096MIW3, Species RAT (Rattus norvegicus, Rat), Gene Suco, Length 882 aa.

						>A0A096MIW3_RAT|A0A096MIW3|Suco
MKKYRRALALVSCLSLCSLVWLPSWHVCCKESSSASTSYYSQDDNCAVGSEDIQFQKKNMETAKLSLPVVEALPTVDSHEESSSVVVGSENIENSSSSSTSETTPISKLDEIENSGTLSVAKPGDTEQPEADCDAGEAADADASVEQPAFVSAPESLVGQHIENVSSSHGKEKVTKSEFESKVSVSEQDGGDPKSALNASDTLKNESSDYTKPRETDPTSVTSPKDPEDIPTFDEWKKKVMEVEKEKSQSLHPSSNGGPHATKKVQKNRNNYASVECGAKILAANPEAKSTSAILIENMDLYMLNPCSTKIWFVIELCEPIQVKQFDIANYELFSSTPKDFLVSISDRYPTNKWIKLGTFHGRDERTVQSFPLDEQMYAKYVKMFIKYIKVELLSHFGSEHFCPLSLIRVFGTSMVEEYEEIADSQYQSERQELFDEDYDYPLDYNTVEDKSSKNLLGSATNAILNMVNIAANILGAKTEDLTEGNKSISENATATTEPKMPESTGVSTPVPSPEYIIKEVHTHDTEPPTSDPPKESPIVQLVQEEEEEASPSTVTLLGSGEQEDESSSWYRKQMEEMQKAFNKTIVKLQNTSRIAEEQDQRQTEAIHLLQAQLTNMTQIVSNLSATVAELKREVSDRQSYLVMSLVLCVVLGLMLCMQRCRNTSQFDGDYTSKLPKSNQYPSPKRCFSSYDDMNLKRRTSFPLIRSKSLQFTGKEVDPNDLYIVEPLKFSPEKKKKRCKYKTEKIETIKPADPLHPIANGDIKGRKPFTNQRDFSSMGEVYHSSYKGPPSEGSSETSSQSEESYFCGISACTSLCNGQTQKTKTEKRALKRRRSKVQDQGKLIKALIQTKSGSLPSLHDIIKGNKEITVGAFGVTAVSGHI
					

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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	47.5	Very low	60.8	Low	195 Å²	195	147.3 Å²	147.3	96%	0.961	70%	0.698	S	S	*	*				0	-58.2	0	-70.4	-161.2	-101.5	0	0	116.7	K3 Y4	M1-K3 VanDerWaalsContact C-N 3.28Å; M1-K3 PolarHBondContact O-N 3.48Å; M1-Y4 PolarHBondContact O-N 3.34Å
2	K	43.5	Very low	62	Low	191 Å²	191	140.4 Å²	140.4	83%	0.83	68%	0.678	S	S	*	*	H	α-helix	trans	-49.2	-33.1	-167.3	-74.2	-179.1	178.8	174.3	0	117
3	K	49.8	Very low	62.1	Low	192 Å²	192	134.9 Å²	134.9	84%	0.835	66%	0.662	S	S	*	*	H	α-helix	trans	-65.2	-41.6	175.7	-67.6	-176.7	179.8	178.4	0	113.1	M1 R6 A7	M1-K3 VanDerWaalsContact C-N 3.28Å; M1-K3 PolarHBondContact O-N 3.48Å; K3-R6 PolarHBondContact O-N 2.87Å; K3-A7 PolarHBondContact O-N 3.26Å; K3-A7 VanDerWaalsContact O-N 3.16Å
4	Y	52.2	Low	62.5	Low	194 Å²	194	133.8 Å²	133.8	76%	0.761	66%	0.659	S	S	*	*	H	α-helix	trans	-65	-41.9	-178.8	-112.9	-90	0	0	0	112.4	M1 R6 A7 L8	M1-Y4 PolarHBondContact O-N 3.34Å; Y4-R6 VanDerWaalsContact C-N 3.26Å; Y4-R6 PolarHBondContact O-N 3.18Å; Y4-A7 PolarHBondContact O-N 3.26Å; Y4-A7 VanDerWaalsContact O-N 3.16Å; Y4-L8 PolarHBondContact O-N 3.45Å
5	R	64.2	Low	62.6	Low	192 Å²	192	129.5 Å²	129.5	73%	0.725	65%	0.648	S	S	*	*	H	α-helix	trans	-60.6	-33.8	176.1	-68	-169.4	-177.9	-177.9	1	112.5	A9	R5-A9 WeakPolarHBondContact O-CB 3.44Å; R5-A9 PolarHBondContact O-N 2.92Å; R5-A9 VanDerWaalsContact O-N 3.09Å
6	R	59.9	Low	62.9	Low	197 Å²	197	127.8 Å²	127.8	74%	0.743	64%	0.64	S	S	*	*	H	α-helix	trans	-71.2	-40.4	174.1	-71.7	-175.2	175	178.6	-1.9	112.6	K3 Y4 A9 L10	K3-R6 PolarHBondContact O-N 2.87Å; Y4-R6 VanDerWaalsContact C-N 3.26Å; Y4-R6 PolarHBondContact O-N 3.18Å; R6-A9 PolarHBondContact O-N 3.43Å; R6-L10 WeakPolarHBondContact O-CG 3.4Å; R6-L10 PolarHBondContact O-N 2.85Å
7	A	65.1	Low	62.6	Low	53 Å²	53	124.5 Å²	124.5	44%	0.438	63%	0.631	S	S	.	*	H	α-helix	trans	-62.3	-46.2	174.9	0	0	0	0	0	111.6	K3 Y4 A9 L10 V11	K3-A7 PolarHBondContact O-N 3.26Å; K3-A7 VanDerWaalsContact O-N 3.16Å; Y4-A7 PolarHBondContact O-N 3.26Å; Y4-A7 VanDerWaalsContact O-N 3.16Å; A7-A9 PolarHBondContact O-N 3.06Å; A7-L10 PolarHBondContact O-N 3.5Å; A7-V11 WeakPolarHBondContact O-CG2 3.48Å; A7-V11 PolarHBondContact O-N 3.38Å
8	L	69.4	Low	62.2	Low	130 Å²	130	122.3 Å²	122.3	68%	0.681	63%	0.63	S	S	*	*	H	α-helix	trans	-63.1	-41.5	178.8	-149.6	78.6	0	0	0	112.2	Y4 V11 S12	Y4-L8 PolarHBondContact O-N 3.45Å; L8-V11 PolarHBondContact O-N 2.91Å; L8-S12 WeakPolarHBondContact O-CB 3.44Å; L8-S12 PolarHBondContact O-N 3.25Å
9	A	70.4	Confident	61.9	Low	60 Å²	60	121.9 Å²	121.9	50%	0.496	63%	0.628	S	S	.	*	H	α-helix	trans	-63.5	-39	175	0	0	0	0	0	112.7	R5 R6 A7 C13	R5-A9 WeakPolarHBondContact O-CB 3.44Å; R5-A9 PolarHBondContact O-N 2.92Å; R5-A9 VanDerWaalsContact O-N 3.09Å; R6-A9 PolarHBondContact O-N 3.43Å; A7-A9 PolarHBondContact O-N 3.06Å; A9-C13 VanDerWaalsContact O-CB 3.23Å; A9-C13 WeakPolarHBondContact O-CB 3.36Å; A9-C13 PolarHBondContact O-N 2.85Å
10	L	70.6	Confident	61.5	Low	116 Å²	116	121.8 Å²	121.8	61%	0.607	63%	0.632	S	S	*	*	H	α-helix	trans	-68	-41.8	176	-72.9	168.9	0	0	0	112.1	R6 A7 C13 L14	R6-L10 WeakPolarHBondContact O-CG 3.4Å; R6-L10 PolarHBondContact O-N 2.85Å; A7-L10 PolarHBondContact O-N 3.5Å; L10-C13 PolarHBondContact O-N 3.46Å; L10-L14 WeakPolarHBondContact O-CB 3.32Å; L10-L14 VanDerWaalsContact O-CG 3.29Å; L10-L14 WeakPolarHBondContact O-CG 3.34Å; L10-L14 PolarHBondContact O-N 3.48Å
11	V	76.1	Confident	60.7	Low	100 Å²	100	126.8 Å²	126.8	61%	0.606	64%	0.643	S	S	*	*	H	α-helix	trans	-63.8	-43.5	175	172.6	0	0	0	0	111	A7 L8 C13 L14 S15	A7-V11 WeakPolarHBondContact O-CG2 3.48Å; A7-V11 PolarHBondContact O-N 3.38Å; L8-V11 PolarHBondContact O-N 2.91Å; V11-C13 PolarHBondContact O-N 3.27Å; V11-L14 PolarHBondContact O-N 2.89Å; V11-S15 WeakPolarHBondContact O-CB 3.5Å; V11-S15 PolarHBondContact O-N 3.39Å
12	S	75.2	Confident	60.4	Low	65 Å²	65	123.9 Å²	123.9	46%	0.455	63%	0.631	S	S	.	*	H	α-helix	trans	-61.3	-43.1	174.3	-170.6	0	0	0	0	112	L8 S15 L16	L8-S12 WeakPolarHBondContact O-CB 3.44Å; L8-S12 PolarHBondContact O-N 3.25Å; S12-S15 PolarHBondContact O-N 2.61Å; S12-L16 WeakPolarHBondContact O-CG 3.48Å; S12-L16 PolarHBondContact O-N 3.48Å
13	C	63.3	Low	60.2	Low	69 Å²	69	120.4 Å²	120.4	47%	0.466	63%	0.628	S	S	.	*	H	α-helix	trans	-66.5	-41.3	178.9	-173.9	0	0	0	0	112	A9 L10 V11 S15 L16 C17	A9-C13 VanDerWaalsContact O-CB 3.23Å; A9-C13 WeakPolarHBondContact O-CB 3.36Å; A9-C13 PolarHBondContact O-N 2.85Å; L10-C13 PolarHBondContact O-N 3.46Å; V11-C13 PolarHBondContact O-N 3.27Å; C13-S15 VanDerWaalsContact C-N 3.35Å; C13-S15 PolarHBondContact O-N 3.17Å; C13-L16 PolarHBondContact O-N 3.47Å; C13-C17 WeakPolarHBondContact O-CB 3.49Å; C13-C17 PolarHBondContact O-N 3.28Å; C13-C17 PolarHBondContact O-SG 3.47Å
14	L	67.3	Low	59.6	Low	119 Å²	119	116.6 Å²	116.6	62%	0.623	63%	0.625	S	S	*	*	H	α-helix	trans	-64.5	-37.3	174.5	-72	167.6	0	0	0	112.4	L10 V11 S18	L10-L14 WeakPolarHBondContact O-CB 3.32Å; L10-L14 VanDerWaalsContact O-CG 3.29Å; L10-L14 WeakPolarHBondContact O-CG 3.34Å; L10-L14 PolarHBondContact O-N 3.48Å; V11-L14 PolarHBondContact O-N 2.89Å; L14-S18 PolarHBondContact O-N 2.86Å; L14-S18 VanDerWaalsContact O-N 3.07Å; L14-S18 PolarHBondContact O-OG 2.9Å
15	S	64.8	Low	58.7	Low	70 Å²	70	119.7 Å²	119.7	49%	0.49	64%	0.636	S	S	.	*	H	α-helix	trans	-63	-49.5	173.4	-173.8	0	0	0	0	111.6	V11 S12 C13 C17 S18 L19	V11-S15 WeakPolarHBondContact O-CB 3.5Å; V11-S15 PolarHBondContact O-N 3.39Å; S12-S15 PolarHBondContact O-N 2.61Å; C13-S15 VanDerWaalsContact C-N 3.35Å; C13-S15 PolarHBondContact O-N 3.17Å; S15-C17 PolarHBondContact O-N 3.4Å; S15-S18 WeakPolarHBondContact O-CB 3.4Å; S15-S18 PolarHBondContact O-N 2.83Å; S15-S18 VanDerWaalsContact O-N 3.1Å; S15-L19 PolarHBondContact O-N 3.2Å
16	L	67.6	Low	57.2	Low	101 Å²	101	118.4 Å²	118.4	53%	0.529	64%	0.638	S	S	.	*	H	α-helix	trans	-63.1	-41.8	177.7	-69.2	168.6	0	0	0	112.4	S12 C13 S18 L19 V20	S12-L16 WeakPolarHBondContact O-CG 3.48Å; S12-L16 PolarHBondContact O-N 3.48Å; C13-L16 PolarHBondContact O-N 3.47Å; L16-S18 PolarHBondContact O-N 2.92Å; L16-L19 PolarHBondContact O-N 3.41Å; L16-V20 WeakPolarHBondContact O-CG2 3.3Å; L16-V20 PolarHBondContact O-N 3.39Å; L16-V20 VanDerWaalsContact O-N 3.09Å
17	C	56.8	Low	56	Low	72 Å²	72	116 Å²	116	49%	0.486	65%	0.645	S	S	.	*	H	α-helix	trans	-61.4	-31.8	173.7	-73.4	0	0	0	0	112.8	C13 S15 V20 W21	C13-C17 WeakPolarHBondContact O-CB 3.49Å; C13-C17 PolarHBondContact O-N 3.28Å; C13-C17 PolarHBondContact O-SG 3.47Å; S15-C17 PolarHBondContact O-N 3.4Å; C17-V20 PolarHBondContact O-N 2.86Å; C17-W21 PolarHBondContact O-N 3.34Å
18	S	56	Low	54.3	Low	86 Å²	86	118 Å²	118	60%	0.601	66%	0.655	S	S	*	*	H	α-helix	trans	-70.2	-34.9	176.2	-56.5	0	0	0	0	112.2	L14 S15 L16 W21	L14-S18 PolarHBondContact O-N 2.86Å; L14-S18 VanDerWaalsContact O-N 3.07Å; L14-S18 PolarHBondContact O-OG 2.9Å; S15-S18 WeakPolarHBondContact O-CB 3.4Å; S15-S18 PolarHBondContact O-N 2.83Å; S15-S18 VanDerWaalsContact O-N 3.1Å; L16-S18 PolarHBondContact O-N 2.92Å; S18-W21 PolarHBondContact O-N 2.88Å
19	L	56.2	Low	52.3	Low	115 Å²	115	117.8 Å²	117.8	60%	0.602	66%	0.662	S	S	*	*	H	α-helix	trans	-72.7	-31.5	175.3	-67.7	169.6	0	0	0	112.7	S15 L16 W21	S15-L19 PolarHBondContact O-N 3.2Å; L16-L19 PolarHBondContact O-N 3.41Å; L19-W21 PolarHBondContact O-N 3.23Å
20	V	54.7	Low	50.3	Low	118 Å²	118	123.9 Å²	123.9	72%	0.715	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-12	176.7	173.4	0	0	0	0	112.8	L16 C17	L16-V20 WeakPolarHBondContact O-CG2 3.3Å; L16-V20 PolarHBondContact O-N 3.39Å; L16-V20 VanDerWaalsContact O-N 3.09Å; C17-V20 PolarHBondContact O-N 2.86Å
21	W	44	Very low	48.3	Very low	228 Å²	228	126 Å²	126	86%	0.864	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	18.2	179.8	-100.4	48.5	0	0	0	115.2	C17 S18 L19 P23	C17-W21 PolarHBondContact O-N 3.34Å; S18-W21 PolarHBondContact O-N 2.88Å; L19-W21 PolarHBondContact O-N 3.23Å; W21-P23 VanDerWaalsContact O-CD 3.27Å; W21-P23 WeakPolarHBondContact O-CD 3.17Å
22	L	40.6	Very low	46	Very low	134 Å²	134	127.1 Å²	127.1	70%	0.702	70%	0.697	S	S	*	*	S	Bend	trans	-87.9	106.1	165.5	-71.3	170.1	0	0	0	110	S24	L22-S24 PolarHBondContact O-N 3.36Å
23	P	39.3	Very low	43.8	Very low	118 Å²	118	129.6 Å²	129.6	77%	0.766	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-69.5	126.7	179.9	28.2	-34.3	0	0	0	111.1	W21 W25	W21-P23 VanDerWaalsContact O-CD 3.27Å; W21-P23 WeakPolarHBondContact O-CD 3.17Å; P23-W25 PolarHBondContact O-N 2.91Å
24	S	37.7	Very low	42.1	Very low	111 Å²	111	132.4 Å²	132.4	78%	0.776	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-61	131.5	-175.1	-44.7	0	0	0	0	113.1	L22	L22-S24 PolarHBondContact O-N 3.36Å
25	W	32.8	Very low	40.3	Very low	260 Å²	260	131.1 Å²	131.1	99%	0.985	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-101.5	116.6	155	-85.3	37.8	0	0	0	107.7	P23	P23-W25 PolarHBondContact O-N 2.91Å
26	H	34.1	Very low	38.5	Very low	165 Å²	165	133.1 Å²	133.1	76%	0.764	76%	0.755	S	S	*	*			trans	-136.2	109.3	-174.8	-162.4	-77.6	0	0	0	110.9
27	V	34.3	Very low	36.5	Very low	146 Å²	146	134.1 Å²	134.1	89%	0.885	77%	0.765	S	S	*	*			trans	-132.8	88.9	171.3	-177	0	0	0	0	105.7
28	C	29.7	Very low	35	Very low	96 Å²	96	135 Å²	135	65%	0.649	77%	0.772	S	S	*	*				83.1	79	73.6	-166.2	0	0	0	0	113.5
29	C	27.6	Very low	33.5	Very low	125 Å²	125	140.9 Å²	140.9	85%	0.845	78%	0.783	S	S	*	*			trans	-137.8	118.4	146.9	-69.8	0	0	0	0	103.4
30	K	27	Very low	32	Very low	187 Å²	187	144.8 Å²	144.8	81%	0.813	79%	0.791	S	S	*	*			cis	68.2	125.7	45.9	-162.7	165.8	-174.7	173.6	0	113.1
31	E	30.4	Very low	30.6	Very low	161 Å²	161	143.2 Å²	143.2	75%	0.752	79%	0.785	S	S	*	*			trans	-65	152.5	-166.9	-63.3	93.6	132.3	0	0	114.8
32	S	27.1	Very low	30	Very low	124 Å²	124	140 Å²	140	87%	0.867	78%	0.779	S	S	*	*				-159.6	132.3	111.8	-77.7	0	0	0	0	111.6
33	S	28.6	Very low	29.4	Very low	117 Å²	117	139.4 Å²	139.4	82%	0.818	78%	0.777	S	S	*	*			trans	-85.3	136.3	167.5	-60.7	0	0	0	0	110.6
34	S	27.1	Very low	28.9	Very low	128 Å²	128	140.4 Å²	140.4	90%	0.895	78%	0.776	S	S	*	*			trans	173.6	152	132.4	41.1	0	0	0	0	111.1
35	A	29.7	Very low	28.6	Very low	92 Å²	92	141.8 Å²	141.8	76%	0.76	78%	0.775	S	S	*	*			trans	-116.6	142.8	170.2	0	0	0	0	0	109.4
36	S	27.1	Very low	28.4	Very low	112 Å²	112	134.7 Å²	134.7	78%	0.783	76%	0.763	S	S	*	*			trans	-171.4	109	153.3	-86.2	0	0	0	0	114.7
37	T	25.3	Very low	28.3	Very low	121 Å²	121	130.7 Å²	130.7	74%	0.742	76%	0.759	S	S	*	*				72.1	123	114.2	-46.1	0	0	0	0	122.2
38	S	25.9	Very low	28	Very low	90 Å²	90	131 Å²	131	63%	0.629	76%	0.761	S	S	*	*			trans	72.1	148.6	153.1	63.8	0	0	0	0	118.5
39	Y	25.2	Very low	27.9	Very low	211 Å²	211	129.7 Å²	129.7	83%	0.827	76%	0.764	S	S	*	*			cis	-150.7	179.6	44.4	-106.1	-86.5	0	0	0	116.8
40	Y	25	Very low	28.1	Very low	197 Å²	197	128 Å²	128	77%	0.773	75%	0.754	S	S	*	*			trans	-44.9	138.3	-175	-93.5	-123.2	0	0	0	122
41	S	25.4	Very low	28.3	Very low	85 Å²	85	126.9 Å²	126.9	59%	0.594	75%	0.751	S	S	*	*				53.1	144.5	115	-50.9	0	0	0	0	126.5
42	Q	30.5	Very low	28.1	Very low	159 Å²	159	125.5 Å²	125.5	74%	0.743	75%	0.749	S	S	*	*			trans	76.5	148.4	147.4	-76.1	168.5	-93.1	0	0	119
43	D	28.2	Very low	28.2	Very low	123 Å²	123	126.2 Å²	126.2	66%	0.658	74%	0.742	S	S	*	*			cis	-155.3	-171.4	3.2	-129.5	-34.5	0	0	0	114.5
44	D	28.5	Very low	28.1	Very low	139 Å²	139	129 Å²	129	74%	0.743	74%	0.742	S	S	*	*			trans	106.4	76.4	151.1	-76.6	-39	0	0	0	124.6
45	N	32.1	Very low	28	Very low	140 Å²	140	132 Å²	132	75%	0.749	74%	0.739	S	S	*	*				72.6	150.4	107.9	-122.2	-31	0	0	0	128.1
46	C	28.8	Very low	27.8	Very low	110 Å²	110	134.4 Å²	134.4	74%	0.743	74%	0.735	S	S	*	*			trans	76.2	147.2	153.7	-70.6	0	0	0	0	122.8
47	A	30.5	Very low	27.7	Very low	82 Å²	82	137 Å²	137	68%	0.678	73%	0.732	S	S	*	*			cis	-173.8	166.1	-23	0	0	0	0	0	112.8
48	V	28.1	Very low	27.7	Very low	151 Å²	151	139.7 Å²	139.7	92%	0.915	73%	0.733	S	S	*	*			trans	73.1	135.8	167.3	-167.4	0	0	0	0	116.3
49	G	28.8	Very low	27.6	Very low	70 Å²	70	142.2 Å²	142.2	72%	0.722	74%	0.74	S	S	*	*			cis	154.5	164.4	0.4	0	0	0	0	0	109.8
50	S	30.8	Very low	27.6	Very low	89 Å²	89	140.3 Å²	140.3	62%	0.622	74%	0.74	S	S	*	*			cis	-163.5	172.1	-7	51.8	0	0	0	0	110.5
51	E	32.2	Very low	27.7	Very low	163 Å²	163	139 Å²	139	76%	0.762	74%	0.741	S	S	*	*			trans	63.6	153.3	166.7	-76	94.8	-136.2	0	0	119.9
52	D	25.9	Very low	27.6	Very low	132 Å²	132	141.2 Å²	141.2	71%	0.706	75%	0.752	S	S	*	*			cis	-143.4	135.8	7.8	-104	-27.5	0	0	0	109.3
53	I	29.5	Very low	27.4	Very low	139 Å²	139	137.6 Å²	137.6	71%	0.713	75%	0.749	S	S	*	*				108.9	123.5	66.3	-84.9	-171.8	0	0	0	114.6
54	Q	26	Very low	27.3	Very low	175 Å²	175	140.5 Å²	140.5	82%	0.818	76%	0.755	S	S	*	*			trans	41.5	139.7	159.3	-65.4	-174.8	-6.2	0	0	123.1
55	F	24	Very low	27.1	Very low	191 Å²	191	141 Å²	141	84%	0.838	76%	0.757	S	S	*	*			cis	99.5	98.8	22.6	-151.7	-55	0	0	0	115.5
56	Q	25.6	Very low	26.9	Very low	144 Å²	144	138.3 Å²	138.3	67%	0.673	75%	0.75	S	S	*	*			trans	-178.1	129.6	139.5	-103	-176.2	65.2	0	0	110.9
57	K	25	Very low	26.7	Very low	166 Å²	166	141.1 Å²	141.1	72%	0.722	76%	0.757	S	S	*	*				81.8	139.2	98.4	-158.7	171.6	175	178.6	0	112.3
58	K	25.5	Very low	27.5	Very low	177 Å²	177	142.1 Å²	142.1	77%	0.77	76%	0.756	S	S	*	*			cis	-156.5	159.2	35.1	-160.2	175.4	178.6	-172.7	0	112.7
59	N	23.5	Very low	27.5	Very low	144 Å²	144	141.1 Å²	141.1	77%	0.77	75%	0.75	S	S	*	*			trans	-53.2	165.6	161.1	-40.6	11.6	0	0	0	110.8
60	M	24.7	Very low	27.6	Very low	170 Å²	170	142.8 Å²	142.8	84%	0.837	75%	0.746	S	S	*	*				-173.1	154.2	65.1	-162.7	158.4	66.7	0	0	113.9
61	E	28	Very low	27.5	Very low	170 Å²	170	146.8 Å²	146.8	79%	0.794	76%	0.755	S	S	*	*			trans	-66.8	157.5	170.1	-58	155.6	81.6	0	0	113.1
62	T	24.4	Very low	27.3	Very low	132 Å²	132	142.6 Å²	142.6	81%	0.81	75%	0.748	S	S	*	*				-170.5	128.2	128.4	16.8	0	0	0	0	106.8
63	A	25.9	Very low	27.4	Very low	83 Å²	83	143.6 Å²	143.6	69%	0.686	75%	0.752	S	S	*	*				67	136.6	73.1	0	0	0	0	0	112.6
64	K	25.2	Very low	27.8	Very low	183 Å²	183	142.7 Å²	142.7	80%	0.796	76%	0.756	S	S	*	*			cis	-172	160.2	5.2	-127.9	176.6	-175.5	176.9	0	110.1
65	L	24.4	Very low	27.8	Very low	150 Å²	150	138.9 Å²	138.9	79%	0.785	75%	0.745	S	S	*	*			trans	66.6	155.3	152.8	-62.5	164.4	0	0	0	118.8
66	S	27.1	Very low	28.1	Very low	84 Å²	84	135.7 Å²	135.7	59%	0.587	74%	0.741	S	S	*	*			cis	-177.7	131.5	-29.5	54.4	0	0	0	0	113.3
67	L	25.8	Very low	28.1	Very low	169 Å²	169	135 Å²	135	89%	0.885	74%	0.742	S	S	*	*			trans	51.8	-176.9	133	-74.2	166.5	0	0	0	119.5
68	P	48	Very low	28.4	Very low	103 Å²	103	131.4 Å²	131.4	67%	0.669	74%	0.737	S	S	*	*			cis	-132.7	-166.8	-3.2	36	-14.5	0	0	0	115.9
69	V	27.7	Very low	28.5	Very low	130 Å²	130	130.7 Å²	130.7	79%	0.788	74%	0.736	S	S	*	*			trans	81.8	134	140.4	138.5	0	0	0	0	118.5
70	V	30.8	Very low	28.9	Very low	105 Å²	105	131.3 Å²	131.3	64%	0.636	73%	0.734	S	S	*	*			cis	-166.8	160.7	-8.5	83.7	0	0	0	0	113.9
71	E	27.2	Very low	29	Very low	173 Å²	173	131.1 Å²	131.1	81%	0.808	73%	0.732	S	S	*	*			trans	29.5	160.4	153.1	-73.7	161.8	138.4	0	0	125
72	A	29.6	Very low	29.1	Very low	75 Å²	75	127.2 Å²	127.2	62%	0.62	72%	0.723	S	S	*	*			cis	179.1	141.4	-30.7	0	0	0	0	0	112.8
73	L	26.6	Very low	29.2	Very low	152 Å²	152	125.8 Å²	125.8	80%	0.796	72%	0.718	S	S	*	*			trans	56.4	177.8	142.9	-63	176	0	0	0	119.4
74	P	39.6	Very low	29.3	Very low	121 Å²	121	126.5 Å²	126.5	79%	0.786	72%	0.718	S	S	*	*			cis	-123.5	-170.4	-11.2	34.1	-15.5	0	0	0	114.2
75	T	26.3	Very low	29.4	Very low	95 Å²	95	123.8 Å²	123.8	58%	0.583	72%	0.717	S	S	*	*			cis	-176.8	173.3	-44	-64.8	0	0	0	0	106.9
76	V	30.1	Very low	29.4	Very low	124 Å²	124	122 Å²	122	75%	0.752	71%	0.712	S	S	*	*			trans	89.5	129.9	160.5	-171.3	0	0	0	0	117
77	D	25	Very low	29.5	Very low	130 Å²	130	125 Å²	125	70%	0.695	73%	0.726	S	S	*	*			cis	-176.7	172.1	-30	-92.2	-26	0	0	0	107.3
78	S	30.4	Very low	29.5	Very low	89 Å²	89	119.7 Å²	119.7	62%	0.622	71%	0.712	S	S	*	*			cis	-173.1	155.6	-44.4	68.8	0	0	0	0	108.4
79	H	29	Very low	28.7	Very low	162 Å²	162	120.5 Å²	120.5	75%	0.75	72%	0.72	S	S	*	*			trans	-169.2	116.4	139.9	-117.1	-78.3	0	0	0	113.1
80	E	30.7	Very low	28.8	Very low	157 Å²	157	123.2 Å²	123.2	73%	0.734	72%	0.724	S	S	*	*			trans	46.9	127.4	142.1	-76.1	177.3	150.4	0	0	125.8
81	E	26.6	Very low	28.8	Very low	167 Å²	167	125 Å²	125	78%	0.78	73%	0.73	S	S	*	*			trans	79.6	91.4	135.9	-63.6	-130.3	98.7	0	0	122.9
82	S	30.6	Very low	28.9	Very low	88 Å²	88	124 Å²	124	62%	0.615	73%	0.729	S	S	*	*				99.3	104.1	108.5	-64.1	0	0	0	0	121.5
83	S	27.3	Very low	29.1	Very low	101 Å²	101	128.7 Å²	128.7	71%	0.706	74%	0.738	S	S	*	*			trans	49.8	126.6	145.3	56.7	0	0	0	0	120.9
84	S	26.9	Very low	29.1	Very low	98 Å²	98	129.3 Å²	129.3	69%	0.685	74%	0.743	S	S	*	*			cis	63.7	150.6	49	87.1	0	0	0	0	114.1
85	V	28.1	Very low	28.4	Very low	127 Å²	127	128.7 Å²	128.7	77%	0.77	74%	0.741	S	S	*	*			cis	-131	142.5	9.2	171.5	0	0	0	0	108.2
86	V	24.6	Very low	28.3	Very low	113 Å²	113	129.6 Å²	129.6	69%	0.685	75%	0.751	S	S	*	*			cis	101.8	94.1	16.2	-177.5	0	0	0	0	115.6
87	V	28.4	Very low	28.4	Very low	145 Å²	145	129 Å²	129	88%	0.879	75%	0.752	S	S	*	*			trans	76.2	159.8	150.5	179.2	0	0	0	0	118.8
88	G	25.7	Very low	28.6	Very low	58 Å²	58	128.1 Å²	128.1	60%	0.598	76%	0.756	S	S	*	*			trans	-138.2	-145.8	178.1	0	0	0	0	0	113.3
89	S	30.7	Very low	28.6	Very low	120 Å²	120	128.7 Å²	128.7	84%	0.839	76%	0.761	S	S	*	*			trans	90.9	159.2	172.7	-55.2	0	0	0	0	119.4
90	E	30.6	Very low	28.6	Very low	187 Å²	187	126.6 Å²	126.6	87%	0.874	76%	0.759	S	S	*	*			trans	80.3	150	165.1	-60.5	-171	-175.5	0	0	120.5
91	N	30.5	Very low	28.7	Very low	142 Å²	142	124 Å²	124	76%	0.759	76%	0.759	S	S	*	*			cis	-169	-177.8	-34.5	-158.2	4.9	0	0	0	111.4
92	I	30.6	Very low	28.8	Very low	152 Å²	152	124.2 Å²	124.2	78%	0.779	76%	0.76	S	S	*	*			trans	95.3	153.8	157.7	-62.8	161.1	0	0	0	119.2
93	E	32.6	Very low	28.5	Very low	174 Å²	174	126.3 Å²	126.3	81%	0.813	77%	0.769	S	S	*	*			trans	-112.5	175.7	-157.4	-49.1	171.3	115.4	0	0	115.6
94	N	26.2	Very low	28.5	Very low	166 Å²	166	127.7 Å²	127.7	89%	0.888	77%	0.773	S	S	*	*			trans	-178.3	176.7	145.8	-97	-45.3	0	0	0	113.8
95	S	26.2	Very low	29	Very low	107 Å²	107	127.9 Å²	127.9	75%	0.748	77%	0.772	S	S	*	*			trans	-121.3	144.9	-145.1	-46.3	0	0	0	0	120.4
96	S	24.3	Very low	28.8	Very low	114 Å²	114	129.5 Å²	129.5	80%	0.797	78%	0.775	S	S	*	*			trans	53.5	123.5	139	-59.6	0	0	0	0	126.2
97	S	31.6	Very low	28.9	Very low	112 Å²	112	129.7 Å²	129.7	78%	0.783	78%	0.781	S	S	*	*				122.6	135.6	118.8	73.8	0	0	0	0	122.4
98	S	28.8	Very low	28.9	Very low	111 Å²	111	131.5 Å²	131.5	78%	0.776	78%	0.777	S	S	*	*			trans	67.6	151.5	150.4	-72.9	0	0	0	0	121.8
99	S	31.4	Very low	29	Very low	102 Å²	102	136 Å²	136	71%	0.713	79%	0.786	S	S	*	*			cis	-172.2	178.9	-11	-97	0	0	0	0	108.7
100	T	28.8	Very low	28.8	Very low	118 Å²	118	136.6 Å²	136.6	72%	0.724	78%	0.78	S	S	*	*			cis	-117.6	-109.7	6.4	44.9	0	0	0	0	113.5
101	S	31.8	Very low	28.7	Very low	103 Å²	103	135.5 Å²	135.5	72%	0.72	78%	0.775	S	S	*	*			cis	-156.4	101.3	8.4	-61	0	0	0	0	114.9
102	E	28.1	Very low	28.7	Very low	171 Å²	171	135.4 Å²	135.4	80%	0.799	77%	0.773	S	S	*	*			trans	47.2	131	137.8	-67.2	-161.5	122.1	0	0	128
103	T	25.6	Very low	28.4	Very low	131 Å²	131	136 Å²	136	80%	0.804	77%	0.773	S	S	*	*			trans	84.1	140.1	141.4	54.5	0	0	0	0	124.3
104	T	26.9	Very low	28.2	Very low	130 Å²	130	133.8 Å²	133.8	80%	0.798	77%	0.766	S	S	*	*			trans	-90.5	-178.8	173.5	51.1	0	0	0	0	109.9
105	P	37.7	Very low	28.3	Very low	103 Å²	103	131.5 Å²	131.5	67%	0.669	76%	0.763	S	S	*	*			cis	-159	-171.7	36.4	46.2	-22.1	0	0	0	120.3
106	I	24	Very low	28.3	Very low	160 Å²	160	129.4 Å²	129.4	82%	0.821	76%	0.759	S	S	*	*			trans	55.2	120.1	146.2	-72.1	156.5	0	0	0	118
107	S	26.8	Very low	28.4	Very low	117 Å²	117	130.6 Å²	130.6	82%	0.818	76%	0.761	S	S	*	*				-165.7	171.7	78	45	0	0	0	0	114.6
108	K	28.2	Very low	28.2	Very low	184 Å²	184	132.8 Å²	132.8	80%	0.8	76%	0.764	S	S	*	*			trans	-152.7	176.4	-176.7	-157.1	-175.4	-178.8	-171.8	0	109
109	L	28.5	Very low	27.9	Very low	151 Å²	151	132.2 Å²	132.2	79%	0.791	76%	0.76	S	S	*	*			trans	74.4	155.5	-179.3	-62.8	114.4	0	0	0	115.1
110	D	26.1	Very low	27.6	Very low	133 Å²	133	134 Å²	134	71%	0.711	77%	0.766	S	S	*	*			cis	164.7	176.5	-29.5	-93.4	-50.9	0	0	0	105.4
111	E	28	Very low	27.4	Very low	164 Å²	164	132.9 Å²	132.9	77%	0.766	77%	0.769	S	S	*	*			trans	80.4	99.5	159	-56	-149.8	124.8	0	0	122.4
112	I	29.9	Very low	27.1	Very low	141 Å²	141	135.2 Å²	135.2	72%	0.723	77%	0.766	S	S	*	*				81.7	133.7	109.7	-71.9	164.6	0	0	0	123
113	E	25.8	Very low	27.7	Very low	165 Å²	165	133 Å²	133	77%	0.771	77%	0.766	S	S	*	*			trans	79.3	113.5	151.9	-97.8	-170.4	156.1	0	0	126.6
114	N	27.1	Very low	27.8	Very low	126 Å²	126	129 Å²	129	67%	0.674	75%	0.751	S	S	*	*				111	136.7	113.8	-119.3	-35.8	0	0	0	123.2
115	S	29.8	Very low	28.1	Very low	118 Å²	118	128.8 Å²	128.8	83%	0.825	75%	0.745	S	S	*	*			trans	61.4	141.4	165	72	0	0	0	0	119.7
116	G	26.1	Very low	27.7	Very low	63 Å²	63	130 Å²	130	65%	0.649	75%	0.751	S	S	*	*			cis	166.9	-176.3	-10.2	0	0	0	0	0	114.9
117	T	25.6	Very low	27.8	Very low	139 Å²	139	131 Å²	131	85%	0.853	75%	0.752	S	S	*	*			trans	80.4	135.6	160.5	13.9	0	0	0	0	123.1
118	L	26.6	Very low	27.8	Very low	159 Å²	159	133.5 Å²	133.5	83%	0.832	75%	0.751	S	S	*	*			trans	78.4	111.9	152.4	-61.2	179.3	0	0	0	122.9
119	S	23.1	Very low	29.1	Very low	99 Å²	99	129.6 Å²	129.6	69%	0.692	74%	0.744	S	S	*	*			trans	-53.8	162.5	152.5	52.9	0	0	0	0	116.3
120	V	25.5	Very low	29	Very low	138 Å²	138	130.7 Å²	130.7	84%	0.836	75%	0.746	S	S	*	*				178.5	149.1	122.4	143.3	0	0	0	0	114.4
121	A	24.7	Very low	29.4	Very low	96 Å²	96	128.4 Å²	128.4	79%	0.793	75%	0.745	S	S	*	*			trans	75.4	132	157	0	0	0	0	0	123.8
122	K	25.8	Very low	29.2	Very low	152 Å²	152	127.2 Å²	127.2	66%	0.661	74%	0.744	S	S	*	*			trans	-91.7	172.8	160.4	-154.5	-158.1	-179.7	-178.7	0	108.9	D125	K122-D125 IonicContact NZ-OD1 2.61Å; K122-D125 PolarHBondContact NZ-OD1 3.49Å
123	P	39.7	Very low	29	Very low	123 Å²	123	125.7 Å²	125.7	80%	0.799	74%	0.744	S	S	*	*				-138.8	168.2	87.3	39.6	-26.9	0	0	0	112.5
124	G	27.8	Very low	29.2	Very low	48 Å²	48	125.2 Å²	125.2	50%	0.495	75%	0.747	S	S	.	*			cis	107.9	133.1	6.1	0	0	0	0	0	112.2
125	D	32.7	Very low	29.4	Very low	125 Å²	125	123.6 Å²	123.6	67%	0.668	75%	0.751	S	S	*	*			cis	-152.5	-137.1	-4.8	-78.5	-60.1	0	0	0	109.2	K122	K122-D125 IonicContact NZ-OD1 2.61Å; K122-D125 PolarHBondContact NZ-OD1 3.49Å
126	T	29	Very low	29.4	Very low	128 Å²	128	121.5 Å²	121.5	79%	0.785	75%	0.748	S	S	*	*			trans	83.2	125.9	-178.2	-29.2	0	0	0	0	113.5
127	E	27.3	Very low	29.3	Very low	183 Å²	183	127.5 Å²	127.5	86%	0.855	76%	0.759	S	S	*	*			cis	-163.1	-164.3	-16.8	-153.6	144	-115.2	0	0	110.8
128	Q	27.2	Very low	29.3	Very low	168 Å²	168	125.3 Å²	125.3	79%	0.785	76%	0.755	S	S	*	*			trans	-135	-155.9	173.6	-125.6	-173.3	-84.9	0	0	107.2
129	P	55.7	Low	29.4	Very low	102 Å²	102	122 Å²	122	66%	0.662	75%	0.75	S	S	*	*			cis	-131.7	-177.2	-3.1	43.9	-27.3	0	0	0	115
130	E	25.7	Very low	29.5	Very low	175 Å²	175	124.9 Å²	124.9	82%	0.818	76%	0.758	S	S	*	*				-170.8	168.7	127.8	-96.8	-59.5	144.8	0	0	108
131	A	33.8	Very low	29.6	Very low	84 Å²	84	122.9 Å²	122.9	69%	0.694	76%	0.756	S	S	*	*			trans	-105.8	-173.6	-169.4	0	0	0	0	0	113.5
132	D	23.5	Very low	29.7	Very low	140 Å²	140	126 Å²	126	75%	0.749	76%	0.76	S	S	*	*			cis	-163.5	159.6	13.1	-158.4	2.5	0	0	0	112.7
133	C	27.1	Very low	29.9	Very low	108 Å²	108	122.9 Å²	122.9	73%	0.73	76%	0.762	S	S	*	*			trans	45.7	157.2	159.9	-71.6	0	0	0	0	123.6
134	D	29.6	Very low	29.2	Very low	156 Å²	156	122 Å²	122	83%	0.834	76%	0.758	S	S	*	*			cis	-163.2	173.8	-33.3	-164.5	24.3	0	0	0	112
135	A	32.1	Very low	29.4	Very low	91 Å²	91	125.5 Å²	125.5	75%	0.752	77%	0.77	S	S	*	*			trans	-56	167.2	-163.8	0	0	0	0	0	124.5
136	G	27.9	Very low	29	Very low	74 Å²	74	128.5 Å²	128.5	76%	0.763	78%	0.78	S	S	*	*			trans	114.6	160.8	142.4	0	0	0	0	0	117.9
137	E	25.2	Very low	29.3	Very low	189 Å²	189	131 Å²	131	88%	0.883	78%	0.783	S	S	*	*			cis	-165.8	136.7	-49.3	177.1	168.3	168.3	0	0	108.8
138	A	25.8	Very low	29.7	Very low	93 Å²	93	128.7 Å²	128.7	77%	0.769	78%	0.784	S	S	*	*			trans	55.3	147.9	160.6	0	0	0	0	0	124.5
139	A	27.8	Very low	29.7	Very low	89 Å²	89	124.9 Å²	124.9	74%	0.736	78%	0.781	S	S	*	*			trans	94	124.5	144.6	0	0	0	0	0	123.6
140	D	25.5	Very low	28.4	Very low	161 Å²	161	129.8 Å²	129.8	86%	0.861	79%	0.792	S	S	*	*			trans	80.1	132.4	143.4	-63.1	-29.4	0	0	0	125.9
141	A	28	Very low	28.6	Very low	95 Å²	95	127.5 Å²	127.5	79%	0.785	79%	0.79	S	S	*	*			trans	63.1	123.2	163.1	0	0	0	0	0	119.4
142	D	27.2	Very low	28.2	Very low	163 Å²	163	129.1 Å²	129.1	87%	0.872	80%	0.797	S	S	*	*			cis	72.4	134.2	25.6	-155.1	52	0	0	0	114.5
143	A	29.7	Very low	28.4	Very low	86 Å²	86	126.9 Å²	126.9	71%	0.711	80%	0.797	S	S	*	*			cis	-140.7	-170.4	-6.4	0	0	0	0	0	108.4
144	S	24.4	Very low	29	Very low	103 Å²	103	126.9 Å²	126.9	72%	0.72	80%	0.796	S	S	*	*			cis	-146.2	174.9	1.8	81.9	0	0	0	0	107.2
145	V	31.7	Very low	28.8	Very low	122 Å²	122	128.1 Å²	128.1	74%	0.739	80%	0.796	S	S	*	*			cis	87.7	120.6	20.9	-172.6	0	0	0	0	116.7
146	E	25.7	Very low	28.6	Very low	189 Å²	189	128.8 Å²	128.8	88%	0.883	80%	0.796	S	S	*	*			trans	79.7	159.9	156.5	-86.3	179.5	159.6	0	0	126.3
147	Q	35.1	Very low	28.7	Very low	180 Å²	180	132.7 Å²	132.7	84%	0.841	80%	0.798	S	S	*	*			trans	-84.4	175	174	-53.1	176.7	-34.9	0	0	110.6
148	P	34.8	Very low	28.9	Very low	135 Å²	135	130.1 Å²	130.1	88%	0.877	80%	0.795	S	S	*	*				-150.8	-155.1	88.3	39.9	-19.8	0	0	0	113.1
149	A	28.3	Very low	29	Very low	88 Å²	88	128.5 Å²	128.5	73%	0.727	79%	0.788	S	S	*	*			trans	-138.9	156.3	-169.9	0	0	0	0	0	116.3
150	F	28.2	Very low	29.1	Very low	204 Å²	204	133.3 Å²	133.3	90%	0.895	80%	0.795	S	S	*	*			trans	77.5	166	145.2	-123	-93.2	0	0	0	122.4
151	V	29.3	Very low	29.3	Very low	128 Å²	128	132.7 Å²	132.7	78%	0.776	79%	0.787	S	S	*	*			trans	98.4	107.7	160.3	-169.8	0	0	0	0	119.4
152	S	24.4	Very low	29.4	Very low	118 Å²	118	133.8 Å²	133.8	83%	0.825	78%	0.778	S	S	*	*				-162.9	140.8	123.5	59	0	0	0	0	111.2
153	A	28.5	Very low	29.4	Very low	92 Å²	92	133.5 Å²	133.5	76%	0.76	77%	0.771	S	S	*	*			trans	-119.8	-179.5	172.1	0	0	0	0	0	109.9
154	P	40.5	Very low	29.3	Very low	108 Å²	108	135.6 Å²	135.6	70%	0.701	77%	0.771	S	S	*	*				-149.1	162.5	90.3	39.1	-22.3	0	0	0	116.8
155	E	25.5	Very low	29.3	Very low	182 Å²	182	137 Å²	137	85%	0.85	77%	0.774	S	S	*	*			trans	54.6	132	144.1	-68.6	168.7	159.3	0	0	120.2
156	S	26.3	Very low	29	Very low	105 Å²	105	135.9 Å²	135.9	73%	0.734	77%	0.773	S	S	*	*			cis	-165	-177.6	5.1	51.4	0	0	0	0	108.4
157	L	30.4	Very low	29.2	Very low	157 Å²	157	131.9 Å²	131.9	82%	0.822	77%	0.765	S	S	*	*			cis	-146.2	-179.2	21.3	-107	-177.1	0	0	0	112.6
158	V	29.2	Very low	28.9	Very low	134 Å²	134	129.2 Å²	129.2	81%	0.812	77%	0.767	S	S	*	*			trans	-48.4	146.7	167.6	-175.4	0	0	0	0	114.5
159	G	28.1	Very low	28.6	Very low	60 Å²	60	132.2 Å²	132.2	62%	0.619	77%	0.768	S	S	*	*			cis	147.3	144.6	-9.1	0	0	0	0	0	115.2
160	Q	31.4	Very low	28.6	Very low	190 Å²	190	131.5 Å²	131.5	89%	0.888	77%	0.77	S	S	*	*			trans	63	152.5	160.2	-83.8	-177.7	-40.4	0	0	119.7
161	H	28.3	Very low	28.6	Very low	148 Å²	148	131.6 Å²	131.6	69%	0.685	77%	0.77	S	S	*	*			cis	-161.5	139.4	-14.8	-166	-112.8	0	0	0	111.8
162	I	31.5	Very low	28.4	Very low	117 Å²	117	132.3 Å²	132.3	60%	0.6	77%	0.765	S	S	*	*			trans	23.9	128.7	152	-54.2	-172	0	0	0	122.3
163	E	26.2	Very low	28.4	Very low	157 Å²	157	134.7 Å²	134.7	73%	0.734	76%	0.76	S	S	*	*			trans	73.8	132.9	149.9	-80.8	174.5	-134.4	0	0	126.1
164	N	26.8	Very low	28.4	Very low	131 Å²	131	135.8 Å²	135.8	70%	0.701	76%	0.758	S	S	*	*			trans	77.4	138	132.2	-78.6	-36.8	0	0	0	124.7
165	V	25.3	Very low	27.7	Very low	131 Å²	131	137.3 Å²	137.3	79%	0.794	77%	0.765	S	S	*	*			trans	72.1	111	151.4	175.6	0	0	0	0	120.6
166	S	25.3	Very low	27.7	Very low	100 Å²	100	137.4 Å²	137.4	70%	0.699	76%	0.762	S	S	*	*			trans	56.2	124.1	138.7	-150.3	0	0	0	0	123.4
167	S	29.9	Very low	27.6	Very low	104 Å²	104	136.4 Å²	136.4	73%	0.727	76%	0.755	S	S	*	*			trans	46.5	119.1	136.6	67.2	0	0	0	0	121.9
168	S	29	Very low	27.3	Very low	125 Å²	125	137.2 Å²	137.2	87%	0.874	76%	0.755	S	S	*	*				-167.3	170.9	126.7	46.2	0	0	0	0	112
169	H	27.4	Very low	27	Very low	197 Å²	197	139.5 Å²	139.5	91%	0.912	76%	0.755	S	S	*	*			trans	-92.9	141.6	-165.3	-74.3	-90.8	0	0	0	115.4
170	G	28.4	Very low	26.9	Very low	74 Å²	74	145 Å²	145	76%	0.763	76%	0.764	S	S	*	*			trans	-126.4	144.6	155.1	0	0	0	0	0	110.8
171	K	28.9	Very low	26.7	Very low	206 Å²	206	140.3 Å²	140.3	90%	0.896	75%	0.752	S	S	*	*			trans	-92.2	160.1	174.4	-58	169.1	-173.9	169.4	0	108
172	E	25.6	Very low	26.5	Very low	143 Å²	143	142.9 Å²	142.9	67%	0.668	76%	0.761	S	S	*	*			cis	-161.2	154.3	24.7	-156.5	-165.3	123.9	0	0	111.2
173	K	25.1	Very low	26.2	Very low	167 Å²	167	144.1 Å²	144.1	73%	0.726	77%	0.774	S	S	*	*			trans	75.9	137.5	141.6	-125.2	-166.5	-156.5	110.9	0	122.6
174	V	26.6	Very low	26.2	Very low	116 Å²	116	141.8 Å²	141.8	70%	0.703	78%	0.775	S	S	*	*			trans	89.1	131	152	-161.8	0	0	0	0	120.5
175	T	27.2	Very low	26.2	Very low	140 Å²	140	142.5 Å²	142.5	86%	0.859	78%	0.784	S	S	*	*			trans	79.1	148.8	159.9	32.3	0	0	0	0	123.5
176	K	24.9	Very low	26.3	Very low	183 Å²	183	140.5 Å²	140.5	80%	0.796	78%	0.776	S	S	*	*			trans	-92.5	173.6	176.3	-179.7	-166.6	171	-164.8	0	109.3
177	S	24.9	Very low	26.4	Very low	84 Å²	84	144 Å²	144	59%	0.587	78%	0.782	S	S	*	*			trans	70.6	110.3	155.1	37.2	0	0	0	0	118.1
178	E	22.9	Very low	26.4	Very low	175 Å²	175	147.2 Å²	147.2	82%	0.818	79%	0.785	S	S	*	*				46.6	104.1	96.7	-178.8	-171.7	-161.7	0	0	116.3
179	F	23.5	Very low	26.3	Very low	182 Å²	182	149.3 Å²	149.3	80%	0.798	79%	0.786	S	S	*	*				-162.1	139.3	126.5	-145.7	-108.9	0	0	0	111.2	S181	F179-S181 WeakPolarHBondContact CD1-O 3.43Å; F179-S181 WeakPolarHBondContact CE1-O 3.3Å
180	E	26.8	Very low	26.3	Very low	174 Å²	174	143.1 Å²	143.1	81%	0.813	78%	0.776	S	S	*	*			trans	-102.8	143.6	163.6	-179.2	170.2	-143.2	0	0	109.7
181	S	27.1	Very low	26.4	Very low	92 Å²	92	143.5 Å²	143.5	64%	0.643	78%	0.779	S	S	*	*			trans	64.2	117.1	176.8	76.3	0	0	0	0	116.4	F179	F179-S181 WeakPolarHBondContact CD1-O 3.43Å; F179-S181 WeakPolarHBondContact CE1-O 3.3Å
182	K	23.9	Very low	26.4	Very low	202 Å²	202	141 Å²	141	88%	0.878	78%	0.776	S	S	*	*			trans	-100	129.5	155.5	-71.3	-175.7	179.1	-178.8	0	108.2
183	V	25.5	Very low	27.5	Very low	143 Å²	143	139.4 Å²	139.4	87%	0.867	78%	0.778	S	S	*	*			trans	-114.3	123.1	150.4	175.7	0	0	0	0	106.5
184	S	24.7	Very low	27.7	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	78%	0.78	S	S	*	*			trans	-106.1	122.5	-174.6	52.4	0	0	0	0	111.5
185	V	27.3	Very low	27.8	Very low	145 Å²	145	139.6 Å²	139.6	88%	0.879	78%	0.783	S	S	*	*			trans	-116.3	147.2	151.8	178.6	0	0	0	0	106.6
186	S	27.1	Very low	27.7	Very low	90 Å²	90	137.1 Å²	137.1	63%	0.629	78%	0.776	S	S	*	*			trans	-111.3	170.2	-157.9	50.7	0	0	0	0	114.2
187	E	28.2	Very low	27.9	Very low	174 Å²	174	135.3 Å²	135.3	81%	0.813	78%	0.775	S	S	*	*			trans	73.6	155.7	164.9	-58.3	169.9	-160	0	0	117.7
188	Q	28.7	Very low	28	Very low	171 Å²	171	138 Å²	138	80%	0.799	78%	0.783	S	S	*	*			cis	-163.7	144.2	-44.4	-171.2	165.5	-14.6	0	0	107.6
189	D	27.1	Very low	28.3	Very low	169 Å²	169	134 Å²	134	90%	0.904	78%	0.779	S	S	*	*			trans	65	154	172.9	-126.7	24	0	0	0	115.1
190	G	28.1	Very low	28.8	Very low	67 Å²	67	130.1 Å²	130.1	69%	0.691	78%	0.775	S	S	*	*			cis	174.7	137.7	-9.3	0	0	0	0	0	110.5
191	G	29.6	Very low	29.1	Very low	81 Å²	81	128.6 Å²	128.6	84%	0.835	77%	0.772	S	S	*	*			trans	99	100.8	167.1	0	0	0	0	0	118.4
192	D	29.8	Very low	29.3	Very low	154 Å²	154	130 Å²	130	82%	0.824	78%	0.777	S	S	*	*			trans	-58.3	162.4	141.4	-106	-52.3	0	0	0	110.2
193	P	48.5	Very low	29.7	Very low	109 Å²	109	127.4 Å²	127.4	71%	0.708	77%	0.772	S	S	*	*			cis	-146.9	161.3	31.6	42.7	-22.9	0	0	0	119.5
194	K	29.7	Very low	30	Very low	178 Å²	178	128.9 Å²	128.9	77%	0.774	77%	0.767	S	S	*	*			trans	50.7	108	135.6	-68.6	179.6	177.2	174.9	0	121.9
195	S	27.4	Very low	30.1	Very low	110 Å²	110	129.9 Å²	129.9	77%	0.769	76%	0.764	S	S	*	*				83	146.2	111.1	78.9	0	0	0	0	122.3
196	A	25.3	Very low	30.2	Very low	87 Å²	87	130.2 Å²	130.2	72%	0.719	76%	0.755	S	S	*	*			trans	72.7	147.1	156.3	0	0	0	0	0	118
197	L	30.3	Very low	30.5	Very low	146 Å²	146	130.2 Å²	130.2	76%	0.764	76%	0.755	S	S	*	*			cis	-163	163	-17.8	-111	177.7	0	0	0	108.7
198	N	26.1	Very low	30.8	Very low	141 Å²	141	127.1 Å²	127.1	75%	0.754	75%	0.753	S	S	*	*			trans	70.2	130.6	156.4	-61	-21.5	0	0	0	122
199	A	28.9	Very low	30.7	Very low	90 Å²	90	126.5 Å²	126.5	74%	0.744	76%	0.755	S	S	*	*			trans	-13.5	160.9	139.1	0	0	0	0	0	118.6
200	S	34	Very low	30.9	Very low	100 Å²	100	128.5 Å²	128.5	70%	0.699	75%	0.752	S	S	*	*			cis	-160.4	168.8	43.8	-60.7	0	0	0	0	116.2
201	D	34.9	Very low	31	Very low	142 Å²	142	131.7 Å²	131.7	76%	0.759	76%	0.758	S	S	*	*			trans	13.6	142	143.7	-44.4	-51.6	0	0	0	120.1
202	T	29.8	Very low	31.2	Very low	122 Å²	122	135.4 Å²	135.4	75%	0.748	75%	0.751	S	S	*	*				-169.6	139.6	61.2	29.3	0	0	0	0	114.6
203	L	33	Very low	31.8	Very low	148 Å²	148	133.6 Å²	133.6	78%	0.775	75%	0.748	S	S	*	*			trans	19.5	141.5	130.5	-53.9	174.2	0	0	0	119.2
204	K	30.6	Very low	30.9	Very low	174 Å²	174	137.8 Å²	137.8	76%	0.757	75%	0.749	S	S	*	*				167.8	-174.1	52.5	-137.8	170.8	-174.2	-178.3	0	111.8
205	N	26.9	Very low	30.8	Very low	129 Å²	129	135.2 Å²	135.2	69%	0.69	74%	0.74	S	S	*	*			trans	79	139.1	166.4	-75.6	35.1	0	0	0	118.1
206	E	30	Very low	30.9	Very low	152 Å²	152	136.8 Å²	136.8	71%	0.71	75%	0.745	S	S	*	*			cis	-160.3	166	-16.6	-143.8	-169.5	94.5	0	0	112.2
207	S	32.8	Very low	31	Very low	90 Å²	90	139.4 Å²	139.4	63%	0.629	75%	0.747	S	S	*	*			trans	24.7	151.3	151.7	49.5	0	0	0	0	123.6
208	S	34.8	Very low	31.7	Very low	109 Å²	109	137.5 Å²	137.5	76%	0.762	74%	0.744	S	S	*	*			cis	178	141.7	-23.3	53.3	0	0	0	0	110.7
209	D	27.5	Very low	31.9	Very low	158 Å²	158	136.7 Å²	136.7	85%	0.845	74%	0.744	S	S	*	*			trans	-167	179.9	135.1	-138.6	-29.9	0	0	0	113.2
210	Y	31.5	Very low	32.1	Very low	212 Å²	212	137.3 Å²	137.3	83%	0.831	74%	0.743	S	S	*	*			trans	-106.5	160.2	-152.7	-105.1	-97.8	0	0	0	118.6
211	T	29	Very low	32	Very low	134 Å²	134	138.7 Å²	138.7	82%	0.822	75%	0.747	S	S	*	*			trans	102.6	120.4	153.6	-41.1	0	0	0	0	118.3
212	K	34.4	Very low	31.7	Very low	159 Å²	159	138.1 Å²	138.1	69%	0.691	75%	0.749	S	S	*	*			trans	-111.7	156.5	165.6	-141.9	-161.8	-177.7	-175.2	0	107.4
213	P	42	Very low	31.7	Very low	115 Å²	115	137.6 Å²	137.6	75%	0.747	75%	0.75	S	S	*	*				-147.1	139.9	78.2	36.5	-17.1	0	0	0	116.6
214	R	29.3	Very low	32.4	Very low	197 Å²	197	136.4 Å²	136.4	74%	0.743	75%	0.751	S	S	*	*				60.4	135.6	113.6	-161.6	171.3	-162.3	-177.5	6	120
215	E	28.8	Very low	32.6	Very low	125 Å²	125	137.1 Å²	137.1	58%	0.584	75%	0.754	S	S	*	*			cis	-158.7	156.4	-14.4	-118.9	153.3	-153.3	0	0	107.6
216	T	28.8	Very low	33	Very low	143 Å²	143	137.1 Å²	137.1	88%	0.877	75%	0.754	S	S	*	*			trans	-153.5	150.4	173.4	-33.6	0	0	0	0	112.7
217	D	27.3	Very low	33.8	Very low	141 Å²	141	135.2 Å²	135.2	75%	0.754	76%	0.755	S	S	*	*			trans	-45.5	-179.8	165.2	-104.6	-42.1	0	0	0	116.8
218	P	46.1	Very low	34.1	Very low	107 Å²	107	139.8 Å²	139.8	70%	0.695	77%	0.766	S	S	*	*			cis	-143.6	169.5	-7	30.3	-6.5	0	0	0	118.3
219	T	29.1	Very low	34.7	Very low	124 Å²	124	141.9 Å²	141.9	76%	0.761	77%	0.769	S	S	*	*			trans	45.6	129.8	131.5	-55.9	0	0	0	0	125.4
220	S	33.4	Very low	35.7	Very low	102 Å²	102	141.3 Å²	141.3	71%	0.713	76%	0.764	S	S	*	*			trans	100	160.4	139.8	70.8	0	0	0	0	124.5
221	V	31.1	Very low	37.2	Very low	129 Å²	129	134.3 Å²	134.3	78%	0.782	75%	0.745	S	S	*	*			trans	70	137.7	172	-128.6	0	0	0	0	114.8
222	T	30.4	Very low	39.3	Very low	131 Å²	131	132 Å²	132	80%	0.804	73%	0.731	S	S	*	*			cis	-148.5	170.3	25.2	-43.2	0	0	0	0	113.4
223	S	29.2	Very low	40.2	Very low	110 Å²	110	130.8 Å²	130.8	77%	0.769	73%	0.725	S	S	*	*			trans	-77	165.2	-175.1	-50.5	0	0	0	0	116.5
224	P	48.2	Very low	41.6	Very low	123 Å²	123	130.7 Å²	130.7	80%	0.799	72%	0.719	S	S	*	*			trans	-110.1	165	-171.7	41.5	-34.9	0	0	0	116.4
225	K	34.7	Very low	43.7	Very low	189 Å²	189	126.6 Å²	126.6	82%	0.822	71%	0.708	S	S	*	*			trans	166.7	151.5	155.1	-94.2	-180	178.1	-169.3	0	106.7
226	D	34.1	Very low	46	Very low	129 Å²	129	127.4 Å²	127.4	69%	0.69	71%	0.706	S	S	*	*			cis	-164.1	178.3	-3.3	-113.3	-34.4	0	0	0	106
227	P	47.4	Very low	48.2	Very low	112 Å²	112	125.6 Å²	125.6	73%	0.727	69%	0.686	S	S	*	*			cis	-128.5	-174.1	-20.4	39	-21.7	0	0	0	113.4
228	E	38.6	Very low	50.8	Low	186 Å²	186	124.3 Å²	124.3	87%	0.869	67%	0.673	S	S	*	*			trans	-23.3	132.8	173.8	-53.5	-178.3	137.9	0	0	120.2
229	D	48.7	Very low	52.1	Low	154 Å²	154	125.7 Å²	125.7	82%	0.824	67%	0.669	S	S	*	*			trans	-104.9	139.3	152	-166.5	4	0	0	0	108.6	P231	D229-P231 WeakPolarHBondContact O-CD 3.27Å
230	I	47.9	Very low	54.4	Low	146 Å²	146	122.5 Å²	122.5	75%	0.749	65%	0.649	S	S	*	*			trans	-86.3	114.4	-168.6	-58.4	176.3	0	0	0	109.4
231	P	61.9	Low	56	Low	64 Å²	64	122.9 Å²	122.9	42%	0.416	64%	0.641	S	S	.	*			trans	-65.4	141.4	-175.8	27.1	-34.8	0	0	0	111.8	D229 E235	D229-P231 WeakPolarHBondContact O-CD 3.27Å; P231-E235 HydrophobicContact CB-CB 4.15Å
232	T	74.4	Confident	57.8	Low	86 Å²	86	120.7 Å²	120.7	53%	0.528	62%	0.622	S	S	.	*			trans	-59.3	150.8	176.7	-45.7	0	0	0	0	110.2	D234 E235 W236	T232-D234 PolarHBondContact O-N 3.18Å; T232-D234 VanDerWaalsContact O-N 3.08Å; T232-E235 WeakPolarHBondContact CB-OE2 3.29Å; T232-E235 PolarHBondContact N-OE2 2.92Å; T232-E235 CarbonylContact O-C 3.6Å; T232-E235 WeakPolarHBondContact O-CA 3.38Å; T232-E235 WeakPolarHBondContact O-CB 3.38Å; T232-E235 PolarHBondContact O-N 3.43Å; T232-E235 PolarHBondContact OG1-OE2 2.88Å; T232-W236 PolarHBondContact O-N 3.47Å
233	F	52	Low	60	Low	133 Å²	133	118.3 Å²	118.3	58%	0.583	61%	0.607	S	S	*	*	H	α-helix	trans	-51.6	-38.3	-178.1	-179.8	-98.3	0	0	0	113.8	W236 K237	F233-W236 AromaticContact CD2-CE3 3.96Å; F233-W236 HydrophobicContact CD2-CE3 3.96Å; F233-W236 HydrophobicContact CD2-CZ3 4.19Å; F233-W236 AromaticContact CE2-CE3 3.93Å; F233-W236 HydrophobicContact CE2-CE3 3.93Å; F233-W236 AromaticContact CE2-CZ3 3.7Å; F233-W236 HydrophobicContact CE2-CZ3 3.7Å; F233-W236 HydrophobicContact CZ-CZ3 4.41Å; F233-K237 HydrophobicContact CE1-CD 4.35Å; F233-K237 WeakPolarHBondContact O-CB 3.42Å; F233-K237 PolarHBondContact O-N 3.43Å
234	D	72.6	Confident	61.5	Low	114 Å²	114	119 Å²	119	61%	0.61	60%	0.598	S	S	*	*	H	α-helix	trans	-72.7	-30.9	176.3	-65.4	-56.1	0	0	0	113.3	T232 K238	T232-D234 PolarHBondContact O-N 3.18Å; T232-D234 VanDerWaalsContact O-N 3.08Å; D234-K238 VanDerWaalsContact O-CB 3.28Å; D234-K238 WeakPolarHBondContact O-CB 3.39Å; D234-K238 PolarHBondContact O-N 3.49Å
235	E	73.8	Confident	62.2	Low	110 Å²	110	119.1 Å²	119.1	51%	0.514	59%	0.586	S	S	.	*	H	α-helix	trans	-72	-43.9	172.9	-62.2	176.4	112.5	0	0	110.8	P231 T232 K238 K239	P231-E235 HydrophobicContact CB-CB 4.15Å; T232-E235 WeakPolarHBondContact CB-OE2 3.29Å; T232-E235 PolarHBondContact N-OE2 2.92Å; T232-E235 CarbonylContact O-C 3.6Å; T232-E235 WeakPolarHBondContact O-CA 3.38Å; T232-E235 WeakPolarHBondContact O-CB 3.38Å; T232-E235 PolarHBondContact O-N 3.43Å; T232-E235 PolarHBondContact OG1-OE2 2.88Å; E235-K238 PolarHBondContact O-N 3.16Å; E235-K239 WeakPolarHBondContact O-CB 3.44Å; E235-K239 PolarHBondContact O-N 3.18Å
236	W	75.4	Confident	63	Low	142 Å²	142	116.1 Å²	116.1	54%	0.538	58%	0.575	S	S	.	*	H	α-helix	trans	-58.6	-48.8	171.5	173.7	73.6	0	0	0	111.1	T232 F233 K238 K239 V240	T232-W236 PolarHBondContact O-N 3.47Å; F233-W236 AromaticContact CD2-CE3 3.96Å; F233-W236 HydrophobicContact CD2-CE3 3.96Å; F233-W236 HydrophobicContact CD2-CZ3 4.19Å; F233-W236 AromaticContact CE2-CE3 3.93Å; F233-W236 HydrophobicContact CE2-CE3 3.93Å; F233-W236 AromaticContact CE2-CZ3 3.7Å; F233-W236 HydrophobicContact CE2-CZ3 3.7Å; F233-W236 HydrophobicContact CZ-CZ3 4.41Å; W236-K238 PolarHBondContact O-N 2.93Å; W236-K239 CarbonylContact O-C 3.53Å; W236-K239 PolarHBondContact O-N 3.4Å; W236-K239 VanDerWaalsContact O-N 3.13Å; W236-V240 HydrophobicContact CD2-CG2 4.29Å; W236-V240 HydrophobicContact CZ2-CG2 4.16Å; W236-V240 WeakPolarHBondContact O-CG2 3.39Å; W236-V240 PolarHBondContact O-N 3.48Å
237	K	76.8	Confident	63.7	Low	105 Å²	105	118 Å²	118	46%	0.457	58%	0.577	S	S	.	*	H	α-helix	trans	-62.1	-40.6	177.5	-176.3	178.3	178.8	-177.8	0	112.5	F233 M241	F233-K237 HydrophobicContact CE1-CD 4.35Å; F233-K237 WeakPolarHBondContact O-CB 3.42Å; F233-K237 PolarHBondContact O-N 3.43Å; K237-M241 WeakPolarHBondContact O-CG 3.42Å; K237-M241 PolarHBondContact O-N 3.18Å; K237-M241 VanDerWaalsContact O-N 3.15Å
238	K	80.1	Confident	63.5	Low	114 Å²	114	116.9 Å²	116.9	50%	0.496	57%	0.572	S	S	.	*	H	α-helix	trans	-59.4	-50.4	171.1	-175.9	-175.6	-180	-88.3	0	110.1	D234 E235 W236 V240 M241 E242	D234-K238 VanDerWaalsContact O-CB 3.28Å; D234-K238 WeakPolarHBondContact O-CB 3.39Å; D234-K238 PolarHBondContact O-N 3.49Å; E235-K238 PolarHBondContact O-N 3.16Å; W236-K238 PolarHBondContact O-N 2.93Å; K238-V240 VanDerWaalsContact C-N 3.35Å; K238-V240 PolarHBondContact O-N 3.21Å; K238-M241 PolarHBondContact O-N 3.42Å; K238-E242 VanDerWaalsContact NZ-CD 3.27Å; K238-E242 IonicContact NZ-OE1 3.03Å; K238-E242 PolarHBondContact NZ-OE1 2.86Å; K238-E242 IonicContact NZ-OE2 2.69Å; K238-E242 PolarHBondContact NZ-OE2 3.16Å; K238-E242 VanDerWaalsContact O-CB 3.24Å; K238-E242 WeakPolarHBondContact O-CB 3.45Å; K238-E242 PolarHBondContact O-N 3.09Å
239	K	74	Confident	63.6	Low	137 Å²	137	114.2 Å²	114.2	60%	0.596	56%	0.559	S	S	*	*	H	α-helix	trans	-65.6	-33.7	-176.1	-156.9	169.5	-169.4	175.7	0	112.5	E235 W236 V243	E235-K239 WeakPolarHBondContact O-CB 3.44Å; E235-K239 PolarHBondContact O-N 3.18Å; W236-K239 CarbonylContact O-C 3.53Å; W236-K239 PolarHBondContact O-N 3.4Å; W236-K239 VanDerWaalsContact O-N 3.13Å; K239-V243 VanDerWaalsContact O-CB 3.31Å; K239-V243 WeakPolarHBondContact O-CB 3.48Å; K239-V243 VanDerWaalsContact O-CG2 3.23Å; K239-V243 WeakPolarHBondContact O-CG2 3.37Å; K239-V243 PolarHBondContact O-N 2.98Å
240	V	77.3	Confident	62.9	Low	56 Å²	56	111.2 Å²	111.2	34%	0.339	55%	0.55	S	S	.	*	H	α-helix	trans	-64.5	-51.6	170.2	170.5	0	0	0	0	110.7	W236 K238 E242 V243 E244	W236-V240 HydrophobicContact CD2-CG2 4.29Å; W236-V240 HydrophobicContact CZ2-CG2 4.16Å; W236-V240 WeakPolarHBondContact O-CG2 3.39Å; W236-V240 PolarHBondContact O-N 3.48Å; K238-V240 VanDerWaalsContact C-N 3.35Å; K238-V240 PolarHBondContact O-N 3.21Å; V240-E242 VanDerWaalsContact C-N 3.27Å; V240-E242 PolarHBondContact O-N 2.91Å; V240-V243 PolarHBondContact O-N 3.43Å; V240-E244 WeakPolarHBondContact O-CB 3.16Å; V240-E244 WeakPolarHBondContact O-CG 3.11Å; V240-E244 PolarHBondContact O-N 3.15Å
241	M	67	Low	62.4	Low	110 Å²	110	110.7 Å²	110.7	54%	0.542	55%	0.548	S	S	.	.	H	α-helix	trans	-64.3	-31.1	177.1	-67.6	-171.8	-57.5	0	0	112.8	K237 K238 K245	K237-M241 WeakPolarHBondContact O-CG 3.42Å; K237-M241 PolarHBondContact O-N 3.18Å; K237-M241 VanDerWaalsContact O-N 3.15Å; K238-M241 PolarHBondContact O-N 3.42Å; M241-K245 WeakPolarHBondContact O-CB 3.36Å; M241-K245 PolarHBondContact O-N 2.98Å
242	E	69.3	Low	61	Low	84 Å²	84	115.4 Å²	115.4	39%	0.393	56%	0.564	S	S	.	*	H	α-helix	trans	-71.9	-42.4	177.2	-157.9	151.5	-135.9	0	0	110.4	K238 V240 K245 E246	K238-E242 VanDerWaalsContact NZ-CD 3.27Å; K238-E242 IonicContact NZ-OE1 3.03Å; K238-E242 PolarHBondContact NZ-OE1 2.86Å; K238-E242 IonicContact NZ-OE2 2.69Å; K238-E242 PolarHBondContact NZ-OE2 3.16Å; K238-E242 VanDerWaalsContact O-CB 3.24Å; K238-E242 WeakPolarHBondContact O-CB 3.45Å; K238-E242 PolarHBondContact O-N 3.09Å; V240-E242 VanDerWaalsContact C-N 3.27Å; V240-E242 PolarHBondContact O-N 2.91Å; E242-K245 WeakPolarHBondContact O-CB 3.38Å; E242-K245 PolarHBondContact O-N 2.88Å; E242-E246 WeakPolarHBondContact O-CG 3.47Å; E242-E246 PolarHBondContact O-N 2.76Å
243	V	76	Confident	59.2	Low	81 Å²	81	117 Å²	117	49%	0.491	58%	0.577	S	S	.	*	H	α-helix	trans	-67.8	-39.5	172.6	167.6	0	0	0	0	112.4	K239 V240 K245 E246 K247	K239-V243 VanDerWaalsContact O-CB 3.31Å; K239-V243 WeakPolarHBondContact O-CB 3.48Å; K239-V243 VanDerWaalsContact O-CG2 3.23Å; K239-V243 WeakPolarHBondContact O-CG2 3.37Å; K239-V243 PolarHBondContact O-N 2.98Å; V240-V243 PolarHBondContact O-N 3.43Å; V243-K245 VanDerWaalsContact C-N 3.3Å; V243-K245 PolarHBondContact O-N 3.3Å; V243-E246 PolarHBondContact O-N 3.1Å; V243-K247 WeakPolarHBondContact O-CB 3.26Å; V243-K247 PolarHBondContact O-N 3.07Å
244	E	61.1	Low	58.5	Low	124 Å²	124	116.7 Å²	116.7	58%	0.579	59%	0.591	S	S	*	*	H	α-helix	trans	-64.4	-35.9	173	-73.8	-174.6	132	0	0	111.8	V240 S248	V240-E244 WeakPolarHBondContact O-CB 3.16Å; V240-E244 WeakPolarHBondContact O-CG 3.11Å; V240-E244 PolarHBondContact O-N 3.15Å; E244-S248 WeakPolarHBondContact O-CB 3.45Å; E244-S248 PolarHBondContact O-N 3.32Å; E244-S248 VanDerWaalsContact O-N 3.11Å; E244-S248 PolarHBondContact O-OG 2.99Å
245	K	61.9	Low	56.5	Low	125 Å²	125	116.6 Å²	116.6	54%	0.543	60%	0.599	S	S	.	*	H	α-helix	trans	-69.7	-43.1	174	-175.4	-178	174.8	-167.3	0	112.3	M241 E242 V243 S248 Q249	M241-K245 WeakPolarHBondContact O-CB 3.36Å; M241-K245 PolarHBondContact O-N 2.98Å; E242-K245 WeakPolarHBondContact O-CB 3.38Å; E242-K245 PolarHBondContact O-N 2.88Å; V243-K245 VanDerWaalsContact C-N 3.3Å; V243-K245 PolarHBondContact O-N 3.3Å; K245-S248 WeakPolarHBondContact CA-OG 3.36Å; K245-S248 CarbonylContact O-C 3.47Å; K245-S248 PolarHBondContact O-N 2.87Å; K245-S248 PolarHBondContact O-OG 2.99Å; K245-S248 VanDerWaalsContact O-OG 3.05Å; K245-Q249 WeakPolarHBondContact O-CB 3.34Å; K245-Q249 WeakPolarHBondContact O-CG 3.4Å; K245-Q249 PolarHBondContact O-N 3.2Å
246	E	52.8	Low	54.7	Low	126 Å²	126	118.9 Å²	118.9	59%	0.589	62%	0.615	S	S	*	*	H	α-helix	trans	-68.7	-37.6	175.9	-73.2	-177.1	159.6	0	0	112.1	E242 V243 S248 Q249 S250	E242-E246 WeakPolarHBondContact O-CG 3.47Å; E242-E246 PolarHBondContact O-N 2.76Å; V243-E246 PolarHBondContact O-N 3.1Å; E246-S248 PolarHBondContact O-N 3.37Å; E246-Q249 PolarHBondContact O-N 3.47Å; E246-Q249 VanDerWaalsContact O-N 3.15Å; E246-S250 WeakPolarHBondContact O-CB 3.46Å; E246-S250 PolarHBondContact O-N 3.18Å; E246-S250 PolarHBondContact O-OG 3.22Å
247	K	48.4	Very low	52.6	Low	170 Å²	170	116.3 Å²	116.3	74%	0.739	63%	0.632	S	S	*	*	H	α-helix	trans	-64	-21.5	171.7	-169.7	174	-179	-179.2	0	112.9	V243	V243-K247 WeakPolarHBondContact O-CB 3.26Å; V243-K247 PolarHBondContact O-N 3.07Å
248	S	43.8	Very low	50.4	Low	88 Å²	88	114.3 Å²	114.3	62%	0.615	64%	0.642	S	S	*	*	H	α-helix	trans	-101.2	-5.6	173.2	51.7	0	0	0	0	114.8	E244 K245 E246	E244-S248 WeakPolarHBondContact O-CB 3.45Å; E244-S248 PolarHBondContact O-N 3.32Å; E244-S248 VanDerWaalsContact O-N 3.11Å; E244-S248 PolarHBondContact O-OG 2.99Å; K245-S248 WeakPolarHBondContact CA-OG 3.36Å; K245-S248 CarbonylContact O-C 3.47Å; K245-S248 PolarHBondContact O-N 2.87Å; K245-S248 PolarHBondContact O-OG 2.99Å; K245-S248 VanDerWaalsContact O-OG 3.05Å; E246-S248 PolarHBondContact O-N 3.37Å
249	Q	39.9	Very low	48.7	Very low	130 Å²	130	115.4 Å²	115.4	61%	0.607	66%	0.66	S	S	*	*	H	α-helix	trans	-111.1	-10.2	176.7	-68.3	-165.9	-62.5	0	0	114.8	K245 E246 L251	K245-Q249 WeakPolarHBondContact O-CB 3.34Å; K245-Q249 WeakPolarHBondContact O-CG 3.4Å; K245-Q249 PolarHBondContact O-N 3.2Å; E246-Q249 PolarHBondContact O-N 3.47Å; E246-Q249 VanDerWaalsContact O-N 3.15Å; Q249-L251 VanDerWaalsContact C-N 3.32Å; Q249-L251 PolarHBondContact O-N 2.87Å
250	S	34.4	Very low	46.9	Very low	91 Å²	91	118.1 Å²	118.1	64%	0.636	68%	0.675	S	S	*	*	S	Bend	trans	-78.8	0.6	-177.9	41.5	0	0	0	0	116.1	E246	E246-S250 WeakPolarHBondContact O-CB 3.46Å; E246-S250 PolarHBondContact O-N 3.18Å; E246-S250 PolarHBondContact O-OG 3.22Å
251	L	37.3	Very low	44.9	Very low	134 Å²	134	119.8 Å²	119.8	70%	0.702	69%	0.694	S	S	*	*			trans	-99.2	31.6	-176.1	-74	176	0	0	0	115.5	Q249	Q249-L251 VanDerWaalsContact C-N 3.32Å; Q249-L251 PolarHBondContact O-N 2.87Å
252	H	32.6	Very low	43.5	Very low	163 Å²	163	120.9 Å²	120.9	76%	0.755	71%	0.707	S	S	*	*			trans	-132.6	99.6	175.5	-79.6	-92	0	0	0	113.3
253	P	37.1	Very low	42.3	Very low	121 Å²	121	125.6 Å²	125.6	79%	0.786	73%	0.727	S	S	*	*			trans	-68.4	135.9	157.3	30	-32.8	0	0	0	109.5
254	S	36.3	Very low	40.8	Very low	126 Å²	126	130.2 Å²	130.2	88%	0.881	74%	0.74	S	S	*	*			trans	-72.8	130.6	176.9	-174.5	0	0	0	0	111.2
255	S	30.7	Very low	39.9	Very low	112 Å²	112	130.9 Å²	130.9	78%	0.783	75%	0.752	S	S	*	*			trans	-155	136.9	169.2	-172.5	0	0	0	0	110.6
256	N	36	Very low	38.9	Very low	158 Å²	158	133.9 Å²	133.9	85%	0.845	77%	0.768	S	S	*	*			trans	-83	136	178.6	-79	-19.3	0	0	0	112
257	G	32.9	Very low	39.1	Very low	87 Å²	87	133.1 Å²	133.1	90%	0.897	76%	0.763	S	S	*	*			trans	67.1	91	147.3	0	0	0	0	0	118.6
258	G	30.4	Very low	39.4	Very low	64 Å²	64	131 Å²	131	66%	0.66	76%	0.76	S	S	*	*			trans	-169.7	140.5	162.3	0	0	0	0	0	111.1
259	P	43.9	Very low	41.1	Very low	137 Å²	137	134 Å²	134	89%	0.89	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-68.9	153.5	-175.7	27.8	-34.2	0	0	0	112.8	A261	P259-A261 PolarHBondContact O-N 3.05Å
260	H	35.2	Very low	43.4	Very low	194 Å²	194	132.1 Å²	132.1	90%	0.898	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-71.4	121.4	-166.2	-67	-89.7	0	0	0	114.1
261	A	36.8	Very low	46.3	Very low	91 Å²	91	129 Å²	129	75%	0.752	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-84.3	137.6	145.4	0	0	0	0	0	108.8	P259 K263	P259-A261 PolarHBondContact O-N 3.05Å; A261-K263 PolarHBondContact O-N 3.32Å
262	T	37.4	Very low	49.1	Very low	132 Å²	132	123 Å²	123	81%	0.81	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-69.7	116.5	179.9	40.4	0	0	0	0	110.8	K264	T262-K264 PolarHBondContact O-N 2.98Å
263	K	44.1	Very low	52.2	Low	184 Å²	184	115.2 Å²	115.2	80%	0.8	66%	0.66	S	S	*	*			trans	-66.1	97.4	167.1	-78.5	-172.5	176.4	-177.4	0	108.5	A261 V265	A261-K263 PolarHBondContact O-N 3.32Å; K263-V265 PolarHBondContact O-N 3.34Å
264	K	44.6	Very low	55	Low	177 Å²	177	109.9 Å²	109.9	77%	0.77	63%	0.626	S	S	*	*			trans	-55.3	131	157.7	-70.2	-162	174.3	-162.5	0	107.3	T262 Q266	T262-K264 PolarHBondContact O-N 2.98Å; K264-Q266 PolarHBondContact O-N 2.83Å
265	V	41.1	Very low	57.9	Low	139 Å²	139	106.8 Å²	106.8	84%	0.842	60%	0.601	S	S	*	*			trans	-57.9	129.1	168.6	175.8	0	0	0	0	106.7	K263 K267	K263-V265 PolarHBondContact O-N 3.34Å; V265-K267 VanDerWaalsContact C-N 3.29Å; V265-K267 PolarHBondContact O-N 3.48Å
266	Q	42.1	Very low	60.9	Low	188 Å²	188	110 Å²	110	88%	0.879	60%	0.604	S	S	*	*			trans	-73.3	88.4	-178	-175.3	169.4	-15.1	0	0	108.5	K264 N268	K264-Q266 PolarHBondContact O-N 2.83Å; Q266-N268 PolarHBondContact O-N 3.3Å; Q266-N268 VanDerWaalsContact O-N 3.13Å
267	K	55.4	Low	63.7	Low	109 Å²	109	105.2 Å²	105.2	47%	0.474	58%	0.582	S	S	.	*			trans	-45.8	120.7	175.3	-163.4	-178	-170.1	-172.7	0	107.5	V265 R269 E417	V265-K267 VanDerWaalsContact C-N 3.29Å; V265-K267 PolarHBondContact O-N 3.48Å; K267-R269 PolarHBondContact O-N 2.92Å; K267-R269 VanDerWaalsContact O-N 3.09Å; K267-E417 WeakPolarHBondContact CE-OE1 3.37Å; K267-E417 IonicContact NZ-OE1 3.95Å; K267-E417 PolarHBondContact NZ-OE1 3.23Å
268	N	56.3	Low	66.7	Low	127 Å²	127	103.4 Å²	103.4	68%	0.679	56%	0.564	S	S	*	*			trans	-59.9	115.1	176.7	50.5	-58.2	0	0	0	107.5	Q266 N270	Q266-N268 PolarHBondContact O-N 3.3Å; Q266-N268 VanDerWaalsContact O-N 3.13Å; N268-N270 PolarHBondContact O-N 3.11Å; N268-N270 PolarHBondContact O-OD1 3.49Å
269	R	78.4	Confident	69.9	Low	150 Å²	150	100.7 Å²	100.7	57%	0.566	54%	0.535	S	S	*	.			trans	-69.8	118.8	177	-70.4	-179.5	167.6	-179	-5.4	107.8	K267 N271 F411	K267-R269 PolarHBondContact O-N 2.92Å; K267-R269 VanDerWaalsContact O-N 3.09Å; R269-N271 PolarHBondContact O-N 3.38Å; R269-F411 HydrophobicContact CB-CB 4.3Å; R269-F411 HydrophobicContact CB-CD1 3.48Å; R269-F411 VanDerWaalsContact CB-CD1 3.48Å; R269-F411 HydrophobicContact CB-CE1 3.95Å; R269-F411 HydrophobicContact CB-CG 4.02Å; R269-F411 WeakPolarHBondContact O-CD1 3.17Å; R269-F411 WeakPolarHBondContact O-CE1 3.45Å
270	N	89.1	Confident	72.5	Confident	90 Å²	90	98.8 Å²	98.8	48%	0.481	51%	0.513	S	S	.	.			trans	-67	130.6	-179.7	-70.9	7.2	0	0	0	110.1	N268 Y272 F411	N268-N270 PolarHBondContact O-N 3.11Å; N268-N270 PolarHBondContact O-OD1 3.49Å; N270-Y272 HydrophobicContact CB-CE2 4.12Å; N270-Y272 WeakPolarHBondContact O-CD2 3.08Å; N270-Y272 WeakPolarHBondContact O-CE2 3.47Å; N270-Y272 PolarHBondContact O-N 2.99Å; N270-F411 WeakPolarHBondContact O-CD1 3.02Å
271	N	95	Very high	75.5	Confident	25 Å²	25	91.1 Å²	91.1	13%	0.134	48%	0.478	C	S	.	.			trans	-80.9	96.9	173.3	178.6	17.1	0	0	0	109.7	R269 A273 S274 R409 V410 F411	R269-N271 PolarHBondContact O-N 3.38Å; N271-A273 PolarHBondContact O-N 3.48Å; N271-A273 VanDerWaalsContact O-N 3.12Å; N271-A273 PolarHBondContact OD1-N 3.41Å; N271-S274 WeakPolarHBondContact O-CB 3.4Å; N271-S274 PolarHBondContact O-N 2.9Å; N271-R409 HydrophobicContact CB-CB 4.43Å; N271-R409 VanDerWaalsContact OD1-CA 3.27Å; N271-R409 WeakPolarHBondContact OD1-CA 3.32Å; N271-R409 WeakPolarHBondContact OD1-CB 3.35Å; N271-V410 PolarHBondContact OD1-N 3.05Å; N271-F411 HydrophobicContact CB-CE1 4.16Å
272	Y	96.4	Very high	78.3	Confident	8 Å²	8	89.3 Å²	89.3	3%	0.031	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-6.5	179.8	-66.3	-86.4	0	0	0	113.8	N270 A279 L317 C318 E319 I321 V410	N270-Y272 HydrophobicContact CB-CE2 4.12Å; N270-Y272 WeakPolarHBondContact O-CD2 3.08Å; N270-Y272 WeakPolarHBondContact O-CE2 3.47Å; N270-Y272 PolarHBondContact O-N 2.99Å; Y272-A279 WeakPolarHBondContact O-CB 3.35Å; Y272-L317 WeakPolarHBondContact O-CA 3.46Å; Y272-L317 VanDerWaalsContact O-CD2 3.28Å; Y272-L317 WeakPolarHBondContact O-CD2 3.15Å; Y272-C318 PolarHBondContact O-N 3.47Å; Y272-C318 PolarHBondContact O-SG 2.92Å; Y272-E319 HydrophobicContact CD1-CB 4.09Å; Y272-E319 HydrophobicContact CE1-CB 4.17Å; Y272-I321 HydrophobicContact CD1-CG2 3.56Å; Y272-I321 HydrophobicContact CD2-CD1 3.78Å; Y272-I321 HydrophobicContact CD2-CG2 3.96Å; Y272-I321 HydrophobicContact CE1-CG2 3.6Å; Y272-I321 HydrophobicContact CE2-CG2 3.99Å; Y272-I321 HydrophobicContact CG-CD1 3.9Å; Y272-I321 HydrophobicContact CG-CG2 3.74Å; Y272-V410 PolarHBondContact N-O 2.83Å
273	A	97.4	Very high	81.1	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	7.2	171.3	0	0	0	0	0	113.7	N271 A279 L295 L317 V410	N271-A273 PolarHBondContact O-N 3.48Å; N271-A273 VanDerWaalsContact O-N 3.12Å; N271-A273 PolarHBondContact OD1-N 3.41Å; A273-A279 VanDerWaalsContact C-CB 3.45Å; A273-L295 HydrophobicContact CB-CD2 4.34Å; A273-L295 WeakPolarHBondContact O-CB 3.37Å; A273-L295 VanDerWaalsContact O-CD2 3.3Å; A273-L295 WeakPolarHBondContact O-CD2 3.49Å; A273-L317 HydrophobicContact CB-CD2 3.9Å; A273-V410 HydrophobicContact CB-CB 3.99Å; A273-V410 HydrophobicContact CB-CG2 3.67Å
274	S	96.4	Very high	83.7	Confident	10 Å²	10	76.6 Å²	76.6	7%	0.07	40%	0.398	C	S	.	.			trans	-73.3	140.4	173.1	-178.4	0	0	0	0	111.7	N271 E276 C277 G278 A279 L295	N271-S274 WeakPolarHBondContact O-CB 3.4Å; N271-S274 PolarHBondContact O-N 2.9Å; S274-E276 PolarHBondContact O-N 3.27Å; S274-E276 WeakPolarHBondContact OG-CB 3.45Å; S274-E276 PolarHBondContact OG-N 3.06Å; S274-E276 VanDerWaalsContact OG-N 3.1Å; S274-C277 WeakPolarHBondContact O-CB 3.29Å; S274-C277 PolarHBondContact O-N 2.89Å; S274-C277 VanDerWaalsContact O-N 3.1Å; S274-G278 PolarHBondContact O-N 3.33Å; S274-A279 VanDerWaalsContact O-CB 3.3Å; S274-A279 WeakPolarHBondContact O-CB 3.46Å; S274-A279 PolarHBondContact O-N 2.94Å; S274-A279 VanDerWaalsContact O-N 3.13Å; S274-L295 WeakPolarHBondContact CA-O 3.39Å
275	V	96.1	Very high	86.2	Confident	60 Å²	60	68.4 Å²	68.4	36%	0.364	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-57	-29.7	167.1	-63.7	0	0	0	0	112.3	C277 G278 L295 I296	V275-C277 VanDerWaalsContact C-N 3.26Å; V275-C277 PolarHBondContact O-N 2.76Å; V275-G278 WeakPolarHBondContact O-CA 3.23Å; V275-G278 PolarHBondContact O-N 3.42Å; V275-L295 HydrophobicContact CG1-CB 3.59Å; V275-L295 PolarHBondContact N-O 3.09Å; V275-I296 HydrophobicContact CG1-CG1 3.88Å; V275-I296 HydrophobicContact CG2-CG1 3.94Å
276	E	94.4	Very high	88.8	Confident	181 Å²	181	67.3 Å²	67.3	85%	0.846	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-69	-26.5	179.4	-57	174.4	142	0	0	112.1	S274 G278	S274-E276 PolarHBondContact O-N 3.27Å; S274-E276 WeakPolarHBondContact OG-CB 3.45Å; S274-E276 PolarHBondContact OG-N 3.06Å; S274-E276 VanDerWaalsContact OG-N 3.1Å; E276-G278 VanDerWaalsContact C-N 3.31Å
277	C	94.5	Very high	91.4	Very high	56 Å²	56	62.5 Å²	62.5	38%	0.378	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-79.2	-17.4	170.6	-163.7	0	0	0	0	111.8	S274 V275 C318	S274-C277 WeakPolarHBondContact O-CB 3.29Å; S274-C277 PolarHBondContact O-N 2.89Å; S274-C277 VanDerWaalsContact O-N 3.1Å; V275-C277 VanDerWaalsContact C-N 3.26Å; V275-C277 PolarHBondContact O-N 2.76Å; C277-C318 VanDerWaalsContact C-CB 3.5Å; C277-C318 HydrophobicContact CB-CB 3.67Å; C277-C318 WeakPolarHBondContact CB-SG 3.43Å; C277-C318 WeakPolarHBondContact O-CB 3.43Å; C277-C318 WeakPolarHBondContact SG-CB 3.3Å; C277-C318 CovalentContact SG-SG 2.04Å; C277-C318 PolarHBondContact SG-SG 3.45Å
278	G	95.9	Very high	93.3	Very high	50 Å²	50	58.1 Å²	58.1	52%	0.515	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.9	16	-172.2	0	0	0	0	0	114.7	S274 V275 E276	S274-G278 PolarHBondContact O-N 3.33Å; V275-G278 WeakPolarHBondContact O-CA 3.23Å; V275-G278 PolarHBondContact O-N 3.42Å; E276-G278 VanDerWaalsContact C-N 3.31Å
279	A	97.9	Very high	95.2	Very high	7 Å²	7	59 Å²	59	6%	0.058	32%	0.318	C	S	.	.			trans	-71	152.3	173.3	0	0	0	0	0	112.1	Y272 A273 S274 E316	Y272-A279 WeakPolarHBondContact O-CB 3.35Å; A273-A279 VanDerWaalsContact C-CB 3.45Å; S274-A279 VanDerWaalsContact O-CB 3.3Å; S274-A279 WeakPolarHBondContact O-CB 3.46Å; S274-A279 PolarHBondContact O-N 2.94Å; S274-A279 VanDerWaalsContact O-N 3.13Å; A279-E316 VanDerWaalsContact CA-O 3.32Å; A279-E316 WeakPolarHBondContact CA-O 3.3Å
280	K	97.4	Very high	96.1	Very high	97 Å²	97	55.1 Å²	55.1	42%	0.422	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	153.5	-174.5	57.8	-178.9	169.9	164.6	0	112.7	L282 I315 E316	K280-L282 HydrophobicContact CD-CD2 4.09Å; K280-L282 HydrophobicContact CG-CD2 4.22Å; K280-I315 WeakPolarHBondContact O-CA 3.16Å; K280-E316 WeakPolarHBondContact CE-OE2 3.43Å; K280-E316 HydrophobicContact CG-CB 4Å; K280-E316 PolarHBondContact N-O 3.49Å; K280-E316 VanDerWaalsContact NZ-CD 3.31Å; K280-E316 IonicContact NZ-OE1 2.65Å; K280-E316 PolarHBondContact NZ-OE1 2.88Å; K280-E316 IonicContact NZ-OE2 3.25Å; K280-E316 PolarHBondContact NZ-OE2 3.34Å; K280-E316 PolarHBondContact O-N 2.87Å
281	I	97.8	Very high	96.5	Very high	33 Å²	33	52.7 Å²	52.7	17%	0.169	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	129.1	167.9	-54.3	-58.5	0	0	0	109	T291 I294 L295 V314 I315	I281-T291 WeakPolarHBondContact CG1-O 3.32Å; I281-I294 HydrophobicContact CD1-CD1 3.93Å; I281-I294 HydrophobicContact CD1-CG1 4.15Å; I281-L295 HydrophobicContact CD1-CD1 3.77Å; I281-L295 HydrophobicContact CD1-CD2 4.04Å; I281-L295 HydrophobicContact CD1-CG 3.95Å; I281-L295 HydrophobicContact CG1-CD1 3.88Å; I281-L295 HydrophobicContact CG1-CG 4.34Å; I281-V314 CarbonylContact C-O 3.56Å; I281-V314 WeakPolarHBondContact CA-O 3.44Å; I281-I315 HydrophobicContact CD1-CG1 3.95Å
282	L	96.8	Very high	96.5	Very high	53 Å²	53	54.6 Å²	54.6	28%	0.277	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-32.5	175.6	-65.3	-171.8	0	0	0	113.5	K280 V314 E316 Y349 Y388	K280-L282 HydrophobicContact CD-CD2 4.09Å; K280-L282 HydrophobicContact CG-CD2 4.22Å; L282-V314 HydrophobicContact CB-CB 4.48Å; L282-V314 HydrophobicContact CB-CG1 4.29Å; L282-V314 HydrophobicContact CD1-CG1 4.45Å; L282-V314 PolarHBondContact N-O 3.4Å; L282-E316 HydrophobicContact CD1-CB 3.94Å; L282-E316 HydrophobicContact CD2-CB 4.1Å; L282-E316 HydrophobicContact CG-CB 3.9Å; L282-Y349 HydrophobicContact CB-CE1 4.16Å; L282-Y349 HydrophobicContact CD1-CD1 3.48Å; L282-Y349 VanDerWaalsContact CD1-CD1 3.48Å; L282-Y349 HydrophobicContact CD1-CD2 4.08Å; L282-Y349 HydrophobicContact CD1-CE1 3.79Å; L282-Y349 HydrophobicContact CD1-CE2 4.35Å; L282-Y349 HydrophobicContact CD1-CG 3.62Å; L282-Y388 HydrophobicContact CD1-CD1 3.65Å; L282-Y388 HydrophobicContact CD1-CE1 3.66Å
283	A	96.8	Very high	96.5	Very high	25 Å²	25	54.3 Å²	54.3	21%	0.207	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	153.5	-179.2	0	0	0	0	0	110.4	W312 F313 V314	A283-W312 HydrophobicContact CB-CH2 4.03Å; A283-W312 HydrophobicContact CB-CZ3 3.77Å; A283-F313 CarbonylContact O-C 3.59Å; A283-F313 VanDerWaalsContact O-CA 3.3Å; A283-F313 WeakPolarHBondContact O-CA 3.28Å; A283-V314 HydrophobicContact CB-CB 4.47Å; A283-V314 HydrophobicContact CB-CG2 4.5Å; A283-V314 PolarHBondContact O-N 2.83Å
284	A	97.4	Very high	96.5	Very high	24 Å²	24	54.3 Å²	54.3	20%	0.198	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	172.5	170.9	0	0	0	0	0	110.1	A288 T291 W312 F313	A284-A288 HydrophobicContact CB-CB 4.07Å; A284-T291 HydrophobicContact CB-CG2 3.66Å; A284-W312 CarbonylContact C-O 3.41Å; A284-W312 VanDerWaalsContact CA-O 3.22Å; A284-W312 WeakPolarHBondContact CA-O 3.36Å; A284-W312 WeakPolarHBondContact O-CH2 3.48Å; A284-W312 WeakPolarHBondContact O-CZ2 3.42Å; A284-F313 HydrophobicContact CB-CB 4.08Å
285	N	96.8	Very high	96.5	Very high	4 Å²	4	54 Å²	54	2%	0.021	31%	0.314	C	S	.	.			trans	-62.6	142.3	167.3	69.9	-79.8	0	0	0	110.6	E287 A288 N305 I311 W312	N285-E287 WeakPolarHBondContact CB-OE2 3.27Å; N285-E287 PolarHBondContact ND2-OE2 3.28Å; N285-E287 PolarHBondContact O-N 2.93Å; N285-E287 VanDerWaalsContact O-N 3.12Å; N285-A288 WeakPolarHBondContact O-CB 3.42Å; N285-A288 PolarHBondContact O-N 3.32Å; N285-N305 PolarHBondContact ND2-ND2 2.99Å; N285-N305 PolarHBondContact ND2-OD1 3.48Å; N285-N305 PolarHBondContact OD1-ND2 2.88Å; N285-I311 WeakPolarHBondContact OD1-CA 3.24Å; N285-W312 HydrophobicContact CB-CG 4.4Å; N285-W312 PolarHBondContact N-O 3.02Å; N285-W312 PolarHBondContact OD1-N 3.37Å; N285-W312 PolarHBondContact OD1-O 3.04Å
286	P	96.6	Very high	96.5	Very high	117 Å²	117	53.8 Å²	53.8	76%	0.76	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-14.1	-169.1	27	-35.1	0	0	0	114.4	A288	P286-A288 VanDerWaalsContact C-N 3.33Å
287	E	96.1	Very high	96.5	Very high	86 Å²	86	50.8 Å²	50.8	40%	0.402	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-9.8	175.3	-48.5	81.6	-179.3	0	0	113	N285 P306 T309	N285-E287 WeakPolarHBondContact CB-OE2 3.27Å; N285-E287 PolarHBondContact ND2-OE2 3.28Å; N285-E287 PolarHBondContact O-N 2.93Å; N285-E287 VanDerWaalsContact O-N 3.12Å; E287-P306 HydrophobicContact CB-CG 4.39Å; E287-T309 HydrophobicContact CB-CG2 4.41Å; E287-T309 HydrophobicContact CG-CG2 4.05Å
288	A	96.6	Very high	96.4	Very high	18 Å²	18	51 Å²	51	15%	0.149	29%	0.294	C	S	.	.			trans	-72.8	127.9	179.7	0	0	0	0	0	111.9	A284 N285 P286 T291 M303 N305	A284-A288 HydrophobicContact CB-CB 4.07Å; N285-A288 WeakPolarHBondContact O-CB 3.42Å; N285-A288 PolarHBondContact O-N 3.32Å; P286-A288 VanDerWaalsContact C-N 3.33Å; A288-T291 HydrophobicContact CB-CG2 3.62Å; A288-M303 HydrophobicContact CB-CG 4.39Å; A288-M303 HydrophobicContact CB-SD 4.14Å; A288-N305 VanDerWaalsContact CB-ND2 3.27Å; A288-N305 WeakPolarHBondContact CB-ND2 3.46Å
289	K	96.4	Very high	96.1	Very high	146 Å²	146	54.5 Å²	54.5	64%	0.635	30%	0.298	S	S	*	.	B	Isolated β-bridge	trans	-109.7	146.8	174.8	-61.6	-179.9	-177.8	179.3	0	110.2	T291 M303 L304	K289-T291 VanDerWaalsContact C-N 3.34Å; K289-T291 PolarHBondContact O-N 3.39Å; K289-M303 CarbonylContact O-C 3.5Å; K289-M303 VanDerWaalsContact O-CA 3.3Å; K289-M303 WeakPolarHBondContact O-CA 3.37Å; K289-M303 WeakPolarHBondContact O-CG 3.36Å; K289-L304 HydrophobicContact CB-CB 4.46Å; K289-L304 PolarHBondContact N-O 3.02Å; K289-L304 PolarHBondContact O-N 2.68Å
290	S	96.3	Very high	95.8	Very high	68 Å²	68	60.6 Å²	60.6	48%	0.476	33%	0.33	S	S	.	.	S	Bend	trans	55.9	43.3	177.4	-163.4	0	0	0	0	113.5	S292 A293 Y302 M303	S290-S292 VanDerWaalsContact C-N 3.28Å; S290-S292 PolarHBondContact O-N 3.25Å; S290-A293 VanDerWaalsContact O-CB 3.26Å; S290-A293 WeakPolarHBondContact O-CB 3.35Å; S290-A293 PolarHBondContact O-N 3.23Å; S290-A293 VanDerWaalsContact O-N 3.11Å; S290-Y302 WeakPolarHBondContact CB-O 3.44Å; S290-Y302 PolarHBondContact OG-O 3.45Å; S290-M303 WeakPolarHBondContact O-CA 3.18Å
291	T	96.9	Very high	95.7	Very high	39 Å²	39	59 Å²	59	24%	0.239	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-58.8	-34.8	-172.4	52.6	0	0	0	0	114	I281 A284 A288 K289 A293 M303	I281-T291 WeakPolarHBondContact CG1-O 3.32Å; A284-T291 HydrophobicContact CB-CG2 3.66Å; A288-T291 HydrophobicContact CB-CG2 3.62Å; K289-T291 VanDerWaalsContact C-N 3.34Å; K289-T291 PolarHBondContact O-N 3.39Å; T291-A293 VanDerWaalsContact C-N 3.26Å; T291-A293 PolarHBondContact O-N 2.65Å; T291-M303 HydrophobicContact CG2-CG 4.31Å; T291-M303 HydrophobicContact CG2-SD 4.02Å
292	S	95.5	Very high	95.6	Very high	65 Å²	65	61.2 Å²	61.2	46%	0.455	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-68.7	-18.8	179.3	51.9	0	0	0	0	114.2	S290 I294 L295	S290-S292 VanDerWaalsContact C-N 3.28Å; S290-S292 PolarHBondContact O-N 3.25Å; S292-I294 PolarHBondContact O-N 3.41Å; S292-L295 PolarHBondContact O-N 2.97Å
293	A	97	Very high	95.6	Very high	2 Å²	2	58.7 Å²	58.7	2%	0.017	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-57.6	-34.5	-177.5	0	0	0	0	0	113.1	S290 T291 L295 I296 L301 Y302	S290-A293 VanDerWaalsContact O-CB 3.26Å; S290-A293 WeakPolarHBondContact O-CB 3.35Å; S290-A293 PolarHBondContact O-N 3.23Å; S290-A293 VanDerWaalsContact O-N 3.11Å; T291-A293 VanDerWaalsContact C-N 3.26Å; T291-A293 PolarHBondContact O-N 2.65Å; A293-L295 PolarHBondContact O-N 3.46Å; A293-L295 VanDerWaalsContact O-N 3.08Å; A293-I296 WeakPolarHBondContact O-CB 3.33Å; A293-I296 PolarHBondContact O-N 3.03Å; A293-L301 HydrophobicContact CB-CB 3.97Å; A293-Y302 VanDerWaalsContact CB-C 3.47Å
294	I	97.1	Very high	95.5	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-64.5	-16.8	-177.1	73.4	-178	0	0	0	114	I281 S292 M303 F313 L405 I408	I281-I294 HydrophobicContact CD1-CD1 3.93Å; I281-I294 HydrophobicContact CD1-CG1 4.15Å; S292-I294 PolarHBondContact O-N 3.41Å; I294-M303 HydrophobicContact CG2-CB 3.49Å; I294-M303 VanDerWaalsContact CG2-CB 3.49Å; I294-M303 HydrophobicContact CG2-CE 4.47Å; I294-F313 HydrophobicContact CD1-CD1 4.47Å; I294-F313 HydrophobicContact CD1-CD2 3.64Å; I294-F313 HydrophobicContact CD1-CE1 4.29Å; I294-F313 HydrophobicContact CD1-CE2 3.42Å; I294-F313 VanDerWaalsContact CD1-CE2 3.42Å; I294-F313 HydrophobicContact CD1-CG 4.17Å; I294-F313 HydrophobicContact CD1-CZ 3.78Å; I294-L405 HydrophobicContact CB-CD2 4.36Å; I294-L405 HydrophobicContact CB-CG 4.35Å; I294-L405 HydrophobicContact CD1-CD2 4.11Å; I294-L405 HydrophobicContact CG2-CB 4.07Å; I294-L405 HydrophobicContact CG2-CD2 3.97Å; I294-L405 HydrophobicContact CG2-CG 3.78Å; I294-L405 WeakPolarHBondContact CG2-O 3.17Å; I294-I408 HydrophobicContact CB-CG2 4.16Å; I294-I408 HydrophobicContact CD1-CG2 3.91Å; I294-I408 HydrophobicContact CG1-CG2 3.81Å; I294-I408 PolarHBondContact O-N 3.49Å
295	L	96.9	Very high	95.5	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.01	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-93.9	-0.1	178.8	-52.6	-178.1	0	0	0	112.1	A273 S274 V275 I281 S292 A293 I315 I408	A273-L295 HydrophobicContact CB-CD2 4.34Å; A273-L295 WeakPolarHBondContact O-CB 3.37Å; A273-L295 VanDerWaalsContact O-CD2 3.3Å; A273-L295 WeakPolarHBondContact O-CD2 3.49Å; S274-L295 WeakPolarHBondContact CA-O 3.39Å; V275-L295 HydrophobicContact CG1-CB 3.59Å; V275-L295 PolarHBondContact N-O 3.09Å; I281-L295 HydrophobicContact CD1-CD1 3.77Å; I281-L295 HydrophobicContact CD1-CD2 4.04Å; I281-L295 HydrophobicContact CD1-CG 3.95Å; I281-L295 HydrophobicContact CG1-CD1 3.88Å; I281-L295 HydrophobicContact CG1-CG 4.34Å; S292-L295 PolarHBondContact O-N 2.97Å; A293-L295 PolarHBondContact O-N 3.46Å; A293-L295 VanDerWaalsContact O-N 3.08Å; L295-I315 HydrophobicContact CD2-CD1 3.93Å; L295-I315 HydrophobicContact CD2-CG1 4.24Å; L295-I315 HydrophobicContact CD2-CG2 4.05Å; L295-I408 HydrophobicContact CD2-CG2 3.98Å
296	I	95.7	Very high	95.5	Very high	56 Å²	56	59.9 Å²	59.9	29%	0.287	32%	0.321	S	S	.	.	S	Bend	trans	-110.3	130	-178.8	-49.4	-179.6	0	0	0	108	V275 A293 N298 L301	V275-I296 HydrophobicContact CG1-CG1 3.88Å; V275-I296 HydrophobicContact CG2-CG1 3.94Å; A293-I296 WeakPolarHBondContact O-CB 3.33Å; A293-I296 PolarHBondContact O-N 3.03Å; I296-N298 HydrophobicContact CG2-CB 4.12Å; I296-N298 PolarHBondContact O-N 3.47Å; I296-L301 HydrophobicContact CD1-CD1 4.12Å; I296-L301 HydrophobicContact CG2-CD1 4.33Å
297	E	93.6	Very high	95.4	Very high	119 Å²	119	55 Å²	55	56%	0.556	29%	0.289	S	S	*	.			trans	-82.7	68.2	177.4	-166.4	151.6	146.5	0	0	111.6	L407 R409	E297-L407 HydrophobicContact CB-CD1 4.44Å; E297-L407 HydrophobicContact CG-CD2 4.4Å; E297-R409 IonicContact OE1-CZ 3.85Å; E297-R409 IonicContact OE1-NE 2.81Å; E297-R409 IonicContact OE1-NH2 3.88Å; E297-R409 PolarHBondContact OE1-NH2 3.37Å; E297-R409 IonicContact OE2-CZ 2.98Å; E297-R409 VanDerWaalsContact OE2-CZ 3.27Å; E297-R409 IonicContact OE2-NE 3.24Å; E297-R409 PolarHBondContact OE2-NE 3.18Å; E297-R409 IonicContact OE2-NH2 2.77Å; E297-R409 PolarHBondContact OE2-NH2 2.99Å
298	N	92.3	Very high	95.3	Very high	61 Å²	61	56.5 Å²	56.5	33%	0.326	31%	0.309	S	S	.	.			trans	-128.3	136.3	176.3	-174.1	-27.5	0	0	0	109.4	I296 D300 L301	I296-N298 HydrophobicContact CG2-CB 4.12Å; I296-N298 PolarHBondContact O-N 3.47Å; N298-D300 PolarHBondContact OD1-N 2.85Å; N298-L301 HydrophobicContact CB-CB 4.25Å; N298-L301 HydrophobicContact CB-CD1 4Å; N298-L301 HydrophobicContact CB-CG 4.06Å
299	M	90.7	Very high	95.2	Very high	122 Å²	122	57.5 Å²	57.5	60%	0.601	31%	0.313	S	S	*	.	S	Bend	trans	-77.6	-27.3	-178	-62.2	-169.6	71.1	0	0	113.7	L301 Y331	M299-L301 VanDerWaalsContact C-N 3.34Å; M299-Y331 HydrophobicContact CB-CD2 4.07Å; M299-Y331 HydrophobicContact CB-CE2 4.49Å; M299-Y331 HydrophobicContact CE-CD1 3.75Å; M299-Y331 HydrophobicContact CE-CD2 4.19Å; M299-Y331 HydrophobicContact CE-CE1 4.11Å; M299-Y331 HydrophobicContact CE-CG 3.79Å; M299-Y331 HydrophobicContact CG-CD2 4.03Å; M299-Y331 HydrophobicContact CG-CE2 4.02Å
300	D	91.1	Very high	95.2	Very high	136 Å²	136	56.1 Å²	56.1	73%	0.727	31%	0.307	S	S	*	.	S	Bend	trans	-84.7	-10.2	-178	-56.3	-41.9	0	0	0	112.7	N298	N298-D300 PolarHBondContact OD1-N 2.85Å
301	L	94.5	Very high	95.2	Very high	64 Å²	64	53.2 Å²	53.2	34%	0.335	29%	0.286	S	S	.	.			trans	-103.7	137.3	180	-59.9	-177.7	0	0	0	110.7	A293 I296 N298 M299	A293-L301 HydrophobicContact CB-CB 3.97Å; I296-L301 HydrophobicContact CD1-CD1 4.12Å; I296-L301 HydrophobicContact CG2-CD1 4.33Å; N298-L301 HydrophobicContact CB-CB 4.25Å; N298-L301 HydrophobicContact CB-CD1 4Å; N298-L301 HydrophobicContact CB-CG 4.06Å; M299-L301 VanDerWaalsContact C-N 3.34Å
302	Y	95.9	Very high	95.3	Very high	78 Å²	78	54.7 Å²	54.7	31%	0.306	29%	0.288	S	S	.	.			trans	-152.8	153.9	175.7	47.4	-99.4	0	0	0	111.4	S290 A293 L304 P404 L405	S290-Y302 WeakPolarHBondContact CB-O 3.44Å; S290-Y302 PolarHBondContact OG-O 3.45Å; A293-Y302 VanDerWaalsContact CB-C 3.47Å; Y302-L304 HydrophobicContact CD2-CB 4.18Å; Y302-L304 HydrophobicContact CD2-CD1 4.45Å; Y302-L304 HydrophobicContact CE2-CB 4.21Å; Y302-L304 HydrophobicContact CE2-CD1 4.1Å; Y302-P404 HydrophobicContact CD2-CB 3.94Å; Y302-P404 HydrophobicContact CG-CB 4.21Å; Y302-L405 CarbonylContact C-O 3.58Å; Y302-L405 VanDerWaalsContact CA-O 3.25Å; Y302-L405 WeakPolarHBondContact CA-O 3.48Å; Y302-L405 VanDerWaalsContact CB-O 3.27Å; Y302-L405 WeakPolarHBondContact CB-O 3.3Å
303	M	96.8	Very high	95.4	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-77.9	129.1	160.4	174.1	-175.2	66.3	0	0	108.1	A288 K289 S290 T291 I294 I311 F313 P404 L405	A288-M303 HydrophobicContact CB-CG 4.39Å; A288-M303 HydrophobicContact CB-SD 4.14Å; K289-M303 CarbonylContact O-C 3.5Å; K289-M303 VanDerWaalsContact O-CA 3.3Å; K289-M303 WeakPolarHBondContact O-CA 3.37Å; K289-M303 WeakPolarHBondContact O-CG 3.36Å; S290-M303 WeakPolarHBondContact O-CA 3.18Å; T291-M303 HydrophobicContact CG2-CG 4.31Å; T291-M303 HydrophobicContact CG2-SD 4.02Å; I294-M303 HydrophobicContact CG2-CB 3.49Å; I294-M303 VanDerWaalsContact CG2-CB 3.49Å; I294-M303 HydrophobicContact CG2-CE 4.47Å; M303-I311 HydrophobicContact CE-CG2 4.45Å; M303-F313 HydrophobicContact CE-CD1 3.68Å; M303-F313 HydrophobicContact CE-CE1 3.75Å; M303-F313 HydrophobicContact SD-CD1 4.26Å; M303-P404 CarbonylContact O-C 3.57Å; M303-P404 WeakPolarHBondContact O-CA 3.47Å; M303-L405 HydrophobicContact CE-CB 4.05Å; M303-L405 HydrophobicContact CE-CD2 4.15Å; M303-L405 PolarHBondContact N-O 2.9Å; M303-L405 PolarHBondContact O-N 2.88Å
304	L	95.7	Very high	95.4	Very high	45 Å²	45	51.7 Å²	51.7	24%	0.236	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-105.8	136.1	178.8	-173.1	68.3	0	0	0	110.6	K289 Y302 F402 P404	K289-L304 HydrophobicContact CB-CB 4.46Å; K289-L304 PolarHBondContact N-O 3.02Å; K289-L304 PolarHBondContact O-N 2.68Å; Y302-L304 HydrophobicContact CD2-CB 4.18Å; Y302-L304 HydrophobicContact CD2-CD1 4.45Å; Y302-L304 HydrophobicContact CE2-CB 4.21Å; Y302-L304 HydrophobicContact CE2-CD1 4.1Å; L304-F402 HydrophobicContact CD1-CB 3.66Å; L304-F402 HydrophobicContact CD1-CD1 3.89Å; L304-F402 HydrophobicContact CD1-CG 3.83Å; L304-F402 HydrophobicContact CD2-CD1 4.26Å; L304-F402 HydrophobicContact CD2-CE1 4.37Å; L304-F402 HydrophobicContact CG-CD1 3.93Å; L304-F402 HydrophobicContact CG-CE1 4.45Å; L304-F402 HydrophobicContact CG-CG 4.36Å; L304-P404 HydrophobicContact CD1-CB 4.19Å
305	N	97	Very high	95.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.266	C	S	.	.			trans	-150.3	139.5	-176.1	-135.4	-44.9	0	0	0	111	N285 A288 T309 I311 F402 C403	N285-N305 PolarHBondContact ND2-ND2 2.99Å; N285-N305 PolarHBondContact ND2-OD1 3.48Å; N285-N305 PolarHBondContact OD1-ND2 2.88Å; A288-N305 VanDerWaalsContact CB-ND2 3.27Å; A288-N305 WeakPolarHBondContact CB-ND2 3.46Å; N305-T309 PolarHBondContact OD1-OG1 3.3Å; N305-I311 HydrophobicContact CB-CD1 3.9Å; N305-I311 HydrophobicContact CB-CG1 3.88Å; N305-I311 HydrophobicContact CB-CG2 4.35Å; N305-F402 WeakPolarHBondContact O-CA 3.44Å; N305-C403 PolarHBondContact O-N 3.25Å
306	P	96.2	Very high	95.5	Very high	33 Å²	33	52.7 Å²	52.7	21%	0.214	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-71	128.5	175.7	-15.3	30.1	0	0	0	111.6	E287 S308 T309 H401 F402	E287-P306 HydrophobicContact CB-CG 4.39Å; P306-S308 PolarHBondContact O-N 2.95Å; P306-T309 HydrophobicContact CB-CG2 4.15Å; P306-T309 HydrophobicContact CG-CG2 4.36Å; P306-T309 PolarHBondContact O-N 3.16Å; P306-T309 PolarHBondContact O-OG1 3.37Å; P306-H401 WeakPolarHBondContact CA-O 3.36Å; P306-F402 HydrophobicContact CG-CE1 4.37Å
307	C	95.5	Very high	95.6	Very high	15 Å²	15	50.1 Å²	50.1	10%	0.101	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-18	-176.9	-69.9	0	0	0	0	114.7	T309 S336 H396 E400 H401 F402 C403	C307-T309 VanDerWaalsContact C-N 3.3Å; C307-S336 VanDerWaalsContact SG-CB 3.51Å; C307-H396 PolarHBondContact O-CE1 3.46Å; C307-E400 PolarHBondContact SG-O 3.3Å; C307-E400 VanDerWaalsContact SG-O 3.32Å; C307-H401 PolarHBondContact N-O 3.24Å; C307-F402 PolarHBondContact SG-O 3.14Å; C307-C403 VanDerWaalsContact CA-SG 3.57Å; C307-C403 HydrophobicContact CB-CB 4.16Å; C307-C403 WeakPolarHBondContact CB-SG 3.27Å; C307-C403 VanDerWaalsContact SG-CA 3.5Å; C307-C403 WeakPolarHBondContact SG-CB 3.48Å; C307-C403 PolarHBondContact SG-N 2.99Å; C307-C403 CovalentContact SG-SG 2.04Å; C307-C403 PolarHBondContact SG-SG 3.24Å
308	S	93.8	Very high	95.7	Very high	116 Å²	116	45.6 Å²	45.6	81%	0.811	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-9.5	177.2	52.7	0	0	0	0	114.3	P306	P306-S308 PolarHBondContact O-N 2.95Å
309	T	95.1	Very high	95.9	Very high	40 Å²	40	46.6 Å²	46.6	25%	0.245	24%	0.242	C	C	.	.	S	Bend	trans	-101.9	161.4	-177.1	67.3	0	0	0	0	111.5	E287 N305 P306 C307 I311	E287-T309 HydrophobicContact CB-CG2 4.41Å; E287-T309 HydrophobicContact CG-CG2 4.05Å; N305-T309 PolarHBondContact OD1-OG1 3.3Å; P306-T309 HydrophobicContact CB-CG2 4.15Å; P306-T309 HydrophobicContact CG-CG2 4.36Å; P306-T309 PolarHBondContact O-N 3.16Å; P306-T309 PolarHBondContact O-OG1 3.37Å; C307-T309 VanDerWaalsContact C-N 3.3Å; T309-I311 PolarHBondContact O-N 3.41Å; T309-I311 VanDerWaalsContact O-N 3.11Å
310	K	95.6	Very high	96.1	Very high	116 Å²	116	42.8 Å²	42.8	50%	0.504	23%	0.226	S	C	.	.			trans	-79.8	96	171.2	-169.6	-175.3	177.9	-173.7	0	109.8	W312 E392	K310-W312 VanDerWaalsContact O-CD1 3.25Å; K310-W312 PolarHBondContact O-N 2.82Å; K310-E392 WeakPolarHBondContact CE-OE2 3.43Å; K310-E392 VanDerWaalsContact NZ-CD 3.26Å; K310-E392 IonicContact NZ-OE1 3.27Å; K310-E392 PolarHBondContact NZ-OE1 2.82Å; K310-E392 IonicContact NZ-OE2 2.7Å; K310-E392 PolarHBondContact NZ-OE2 2.91Å
311	I	97.1	Very high	96.2	Very high	7 Å²	7	36.3 Å²	36.3	4%	0.036	19%	0.192	C	C	.	.			trans	-70.3	122	178.6	-56.9	169	0	0	0	110.5	N285 M303 N305 T309 L393 C403	N285-I311 WeakPolarHBondContact OD1-CA 3.24Å; M303-I311 HydrophobicContact CE-CG2 4.45Å; N305-I311 HydrophobicContact CB-CD1 3.9Å; N305-I311 HydrophobicContact CB-CG1 3.88Å; N305-I311 HydrophobicContact CB-CG2 4.35Å; T309-I311 PolarHBondContact O-N 3.41Å; T309-I311 VanDerWaalsContact O-N 3.11Å; I311-L393 HydrophobicContact CB-CB 4.11Å; I311-L393 HydrophobicContact CD1-CD2 4.38Å; I311-L393 HydrophobicContact CG2-CB 4.3Å; I311-L393 HydrophobicContact CG2-CD1 4.43Å; I311-L393 HydrophobicContact CG2-CD2 4.05Å; I311-L393 HydrophobicContact CG2-CG 4.5Å; I311-L393 PolarHBondContact O-N 2.98Å; I311-C403 HydrophobicContact CD1-CB 3.52Å
312	W	97.4	Very high	96.1	Very high	70 Å²	70	33.7 Å²	33.7	27%	0.265	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	153.6	173.1	65.1	-91.9	0	0	0	112.3	A283 A284 N285 K310 V314 V391 E392	A283-W312 HydrophobicContact CB-CH2 4.03Å; A283-W312 HydrophobicContact CB-CZ3 3.77Å; A284-W312 CarbonylContact C-O 3.41Å; A284-W312 VanDerWaalsContact CA-O 3.22Å; A284-W312 WeakPolarHBondContact CA-O 3.36Å; A284-W312 WeakPolarHBondContact O-CH2 3.48Å; A284-W312 WeakPolarHBondContact O-CZ2 3.42Å; N285-W312 HydrophobicContact CB-CG 4.4Å; N285-W312 PolarHBondContact N-O 3.02Å; N285-W312 PolarHBondContact OD1-N 3.37Å; N285-W312 PolarHBondContact OD1-O 3.04Å; K310-W312 VanDerWaalsContact O-CD1 3.25Å; K310-W312 PolarHBondContact O-N 2.82Å; W312-V314 HydrophobicContact CE3-CG2 4.43Å; W312-V314 HydrophobicContact CZ3-CG2 4.22Å; W312-V391 VanDerWaalsContact CA-O 3.25Å; W312-V391 WeakPolarHBondContact CA-O 3.34Å; W312-V391 WeakPolarHBondContact CB-O 3.35Å; W312-E392 HydrophobicContact CB-CB 4.3Å; W312-E392 HydrophobicContact CB-CG 3.98Å
313	F	97.8	Very high	96	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	159.7	175.6	52.6	-88.4	0	0	0	112.2	A283 A284 I294 M303 I315 K390 V391 L393 L405 I408	A283-F313 CarbonylContact O-C 3.59Å; A283-F313 VanDerWaalsContact O-CA 3.3Å; A283-F313 WeakPolarHBondContact O-CA 3.28Å; A284-F313 HydrophobicContact CB-CB 4.08Å; I294-F313 HydrophobicContact CD1-CD1 4.47Å; I294-F313 HydrophobicContact CD1-CD2 3.64Å; I294-F313 HydrophobicContact CD1-CE1 4.29Å; I294-F313 HydrophobicContact CD1-CE2 3.42Å; I294-F313 VanDerWaalsContact CD1-CE2 3.42Å; I294-F313 HydrophobicContact CD1-CG 4.17Å; I294-F313 HydrophobicContact CD1-CZ 3.78Å; M303-F313 HydrophobicContact CE-CD1 3.68Å; M303-F313 HydrophobicContact CE-CE1 3.75Å; M303-F313 HydrophobicContact SD-CD1 4.26Å; F313-I315 HydrophobicContact CD2-CD1 4.38Å; F313-I315 HydrophobicContact CD2-CG1 4.1Å; F313-I315 HydrophobicContact CE2-CD1 4.12Å; F313-I315 HydrophobicContact CE2-CG1 4.34Å; F313-K390 WeakPolarHBondContact O-CA 3.47Å; F313-V391 HydrophobicContact CD2-CB 4.17Å; F313-V391 HydrophobicContact CD2-CG2 4.32Å; F313-V391 HydrophobicContact CE1-CB 4.04Å; F313-V391 HydrophobicContact CE1-CG1 4.19Å; F313-V391 HydrophobicContact CE2-CB 3.62Å; F313-V391 HydrophobicContact CE2-CG1 4.35Å; F313-V391 HydrophobicContact CE2-CG2 3.6Å; F313-V391 HydrophobicContact CZ-CB 3.55Å; F313-V391 HydrophobicContact CZ-CG1 3.8Å; F313-V391 HydrophobicContact CZ-CG2 3.91Å; F313-V391 PolarHBondContact N-O 3.38Å; F313-V391 PolarHBondContact O-N 2.57Å; F313-L393 HydrophobicContact CE1-CD1 4.11Å; F313-L405 HydrophobicContact CE1-CD2 3.66Å; F313-L405 HydrophobicContact CE2-CD2 4.47Å; F313-L405 HydrophobicContact CZ-CD2 3.44Å; F313-L405 VanDerWaalsContact CZ-CD2 3.44Å; F313-I408 HydrophobicContact CE2-CD1 4.08Å; F313-I408 HydrophobicContact CZ-CD1 4.32Å
314	V	98.1	Very high	95.7	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.024	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	125.5	177.7	-179.7	0	0	0	0	109.6	I281 L282 A283 W312 Y349 W354 I389 K390	I281-V314 CarbonylContact C-O 3.56Å; I281-V314 WeakPolarHBondContact CA-O 3.44Å; L282-V314 HydrophobicContact CB-CB 4.48Å; L282-V314 HydrophobicContact CB-CG1 4.29Å; L282-V314 HydrophobicContact CD1-CG1 4.45Å; L282-V314 PolarHBondContact N-O 3.4Å; A283-V314 HydrophobicContact CB-CB 4.47Å; A283-V314 HydrophobicContact CB-CG2 4.5Å; A283-V314 PolarHBondContact O-N 2.83Å; W312-V314 HydrophobicContact CE3-CG2 4.43Å; W312-V314 HydrophobicContact CZ3-CG2 4.22Å; V314-Y349 HydrophobicContact CB-CE2 4.45Å; V314-Y349 HydrophobicContact CG1-CD2 4.01Å; V314-Y349 HydrophobicContact CG1-CE2 3.86Å; V314-Y349 HydrophobicContact CG2-CE2 4.42Å; V314-W354 HydrophobicContact CG1-CH2 3.79Å; V314-W354 HydrophobicContact CG1-CZ2 4.22Å; V314-W354 HydrophobicContact CG2-CH2 4.32Å; V314-W354 HydrophobicContact CG2-CZ2 4.15Å; V314-I389 CarbonylContact C-O 3.54Å; V314-I389 WeakPolarHBondContact CA-O 3.5Å; V314-K390 HydrophobicContact CG2-CB 4.09Å; V314-K390 HydrophobicContact CG2-CD 4.32Å; V314-K390 HydrophobicContact CG2-CG 3.87Å
315	I	98.2	Very high	95.6	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	133.9	176	-50.1	175.7	0	0	0	108.7	K280 I281 L295 F313 L317 Y388 I389 I408	K280-I315 WeakPolarHBondContact O-CA 3.16Å; I281-I315 HydrophobicContact CD1-CG1 3.95Å; L295-I315 HydrophobicContact CD2-CD1 3.93Å; L295-I315 HydrophobicContact CD2-CG1 4.24Å; L295-I315 HydrophobicContact CD2-CG2 4.05Å; F313-I315 HydrophobicContact CD2-CD1 4.38Å; F313-I315 HydrophobicContact CD2-CG1 4.1Å; F313-I315 HydrophobicContact CE2-CD1 4.12Å; F313-I315 HydrophobicContact CE2-CG1 4.34Å; I315-L317 HydrophobicContact CG2-CD2 4.33Å; I315-Y388 WeakPolarHBondContact O-CA 3.36Å; I315-I389 PolarHBondContact N-O 3.34Å; I315-I389 PolarHBondContact O-N 2.8Å; I315-I408 HydrophobicContact CD1-CD1 4.03Å; I315-I408 HydrophobicContact CD1-CG2 3.75Å
316	E	98	Very high	95.5	Very high	24 Å²	24	32.1 Å²	32.1	11%	0.112	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	118.8	153.8	-177.5	173.4	156.7	0	0	107.9	A279 K280 L282 K387 Y388	A279-E316 VanDerWaalsContact CA-O 3.32Å; A279-E316 WeakPolarHBondContact CA-O 3.3Å; K280-E316 WeakPolarHBondContact CE-OE2 3.43Å; K280-E316 HydrophobicContact CG-CB 4Å; K280-E316 PolarHBondContact N-O 3.49Å; K280-E316 VanDerWaalsContact NZ-CD 3.31Å; K280-E316 IonicContact NZ-OE1 2.65Å; K280-E316 PolarHBondContact NZ-OE1 2.88Å; K280-E316 IonicContact NZ-OE2 3.25Å; K280-E316 PolarHBondContact NZ-OE2 3.34Å; K280-E316 PolarHBondContact O-N 2.87Å; L282-E316 HydrophobicContact CD1-CB 3.94Å; L282-E316 HydrophobicContact CD2-CB 4.1Å; L282-E316 HydrophobicContact CG-CB 3.9Å; E316-K387 HydrophobicContact CG-CD 4.06Å; E316-K387 HydrophobicContact CG-CG 4.22Å; E316-K387 WeakPolarHBondContact OE1-CE 3.36Å; E316-K387 IonicContact OE1-NZ 2.68Å; E316-K387 PolarHBondContact OE1-NZ 2.85Å; E316-Y388 HydrophobicContact CB-CD1 3.87Å; E316-Y388 HydrophobicContact CB-CE1 3.75Å; E316-Y388 HydrophobicContact CG-CD1 3.97Å; E316-Y388 HydrophobicContact CG-CE1 3.46Å; E316-Y388 VanDerWaalsContact CG-CE1 3.46Å; E316-Y388 WeakPolarHBondContact OE2-CE1 3.49Å
317	L	97.6	Very high	95.5	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	155	171.3	-61	177.1	0	0	0	110.1	Y272 A273 I315 E319 I321 I386 K387 I389 V410	Y272-L317 WeakPolarHBondContact O-CA 3.46Å; Y272-L317 VanDerWaalsContact O-CD2 3.28Å; Y272-L317 WeakPolarHBondContact O-CD2 3.15Å; A273-L317 HydrophobicContact CB-CD2 3.9Å; I315-L317 HydrophobicContact CG2-CD2 4.33Å; L317-E319 WeakPolarHBondContact CB-O 3.45Å; L317-E319 PolarHBondContact O-N 2.96Å; L317-I321 HydrophobicContact CD1-CD1 3.65Å; L317-I321 HydrophobicContact CD1-CG1 3.63Å; L317-I386 HydrophobicContact CD1-CD1 4.1Å; L317-K387 PolarHBondContact N-O 2.91Å; L317-K387 WeakPolarHBondContact O-CE 3.39Å; L317-I389 HydrophobicContact CD1-CD1 3.77Å; L317-I389 HydrophobicContact CD2-CD1 3.99Å; L317-I389 HydrophobicContact CG-CD1 4.05Å; L317-V410 HydrophobicContact CD1-CG1 4.34Å; L317-V410 HydrophobicContact CD2-CB 3.99Å; L317-V410 HydrophobicContact CD2-CG1 4.22Å; L317-V410 HydrophobicContact CD2-CG2 4.1Å
318	C	96.1	Very high	95.6	Very high	25 Å²	25	30.4 Å²	30.4	17%	0.169	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	-47.3	174.3	47	0	0	0	0	112.3	Y272 C277 K387	Y272-C318 PolarHBondContact O-N 3.47Å; Y272-C318 PolarHBondContact O-SG 2.92Å; C277-C318 VanDerWaalsContact C-CB 3.5Å; C277-C318 HydrophobicContact CB-CB 3.67Å; C277-C318 WeakPolarHBondContact CB-SG 3.43Å; C277-C318 WeakPolarHBondContact O-CB 3.43Å; C277-C318 WeakPolarHBondContact SG-CB 3.3Å; C277-C318 CovalentContact SG-SG 2.04Å; C277-C318 PolarHBondContact SG-SG 3.45Å; C318-K387 WeakPolarHBondContact O-CE 3.29Å
319	E	95.4	Very high	95.7	Very high	81 Å²	81	25 Å²	25	38%	0.379	12%	0.122	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	154.1	179.2	-67.9	-174.9	-179.4	0	0	111.9	Y272 L317 I321 S414	Y272-E319 HydrophobicContact CD1-CB 4.09Å; Y272-E319 HydrophobicContact CE1-CB 4.17Å; L317-E319 WeakPolarHBondContact CB-O 3.45Å; L317-E319 PolarHBondContact O-N 2.96Å; E319-I321 HydrophobicContact CB-CG2 4.44Å; E319-S414 WeakPolarHBondContact OE2-CB 3.21Å; E319-S414 PolarHBondContact OE2-OG 3.25Å
320	P	94.8	Very high	95.6	Very high	43 Å²	43	23.2 Å²	23.2	28%	0.279	11%	0.111	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	126.9	168	32.4	-33.9	0	0	0	110.4	F385 I386 K387 M415	P320-F385 HydrophobicContact CB-CB 4.29Å; P320-F385 WeakPolarHBondContact O-CD1 3.42Å; P320-I386 WeakPolarHBondContact CA-O 3.4Å; P320-K387 HydrophobicContact CB-CB 4.29Å; P320-M415 HydrophobicContact CG-CE 4.28Å
321	I	94.4	Very high	95.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	155.2	-172.7	62.5	172.1	0	0	0	113.6	Y272 L317 E319 V323 F385 I386 V410 T413	Y272-I321 HydrophobicContact CD1-CG2 3.56Å; Y272-I321 HydrophobicContact CD2-CD1 3.78Å; Y272-I321 HydrophobicContact CD2-CG2 3.96Å; Y272-I321 HydrophobicContact CE1-CG2 3.6Å; Y272-I321 HydrophobicContact CE2-CG2 3.99Å; Y272-I321 HydrophobicContact CG-CD1 3.9Å; Y272-I321 HydrophobicContact CG-CG2 3.74Å; L317-I321 HydrophobicContact CD1-CD1 3.65Å; L317-I321 HydrophobicContact CD1-CG1 3.63Å; E319-I321 HydrophobicContact CB-CG2 4.44Å; I321-V323 HydrophobicContact CD1-CG2 4.11Å; I321-V323 HydrophobicContact CG1-CG2 4.07Å; I321-F385 WeakPolarHBondContact O-CA 3.43Å; I321-I386 PolarHBondContact N-O 2.92Å; I321-I386 PolarHBondContact O-N 2.8Å; I321-V410 HydrophobicContact CD1-CG1 3.83Å; I321-T413 CarbonylContact C-O 3.58Å; I321-T413 VanDerWaalsContact CA-O 3.29Å; I321-T413 WeakPolarHBondContact CA-O 3.33Å; I321-T413 WeakPolarHBondContact CB-O 3.39Å
322	Q	92.8	Very high	95.4	Very high	9 Å²	9	22.1 Å²	22.1	4%	0.042	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	105.9	159.3	-54.7	177.4	0.2	0	0	108.2	K324 V382 F385 G412 T413 E418	Q322-K324 PolarHBondContact O-N 2.95Å; Q322-V382 WeakPolarHBondContact CG-O 3.37Å; Q322-V382 PolarHBondContact NE2-O 3.44Å; Q322-V382 VanDerWaalsContact OE1-CG2 3.25Å; Q322-F385 HydrophobicContact CG-CD1 3.95Å; Q322-F385 HydrophobicContact CG-CD2 4.41Å; Q322-F385 HydrophobicContact CG-CE1 3.58Å; Q322-F385 HydrophobicContact CG-CE2 4.08Å; Q322-F385 HydrophobicContact CG-CG 4.34Å; Q322-F385 HydrophobicContact CG-CZ 3.65Å; Q322-F385 VanDerWaalsContact NE2-CZ 3.27Å; Q322-G412 CarbonylContact O-C 3.46Å; Q322-G412 WeakPolarHBondContact O-CA 3.17Å; Q322-T413 PolarHBondContact N-O 2.98Å; Q322-T413 PolarHBondContact O-N 3.46Å; Q322-E418 PolarHBondContact NE2-OE1 2.89Å; Q322-E418 VanDerWaalsContact NE2-OE1 3.11Å; Q322-E418 PolarHBondContact NE2-OE2 2.98Å
323	V	92.6	Very high	95	Very high	13 Å²	13	24.3 Å²	24.3	8%	0.079	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	134.2	-176.7	-168.9	0	0	0	0	111.1	I321 F326 L373 Y378 I386 V410	I321-V323 HydrophobicContact CD1-CG2 4.11Å; I321-V323 HydrophobicContact CG1-CG2 4.07Å; V323-F326 HydrophobicContact CB-CZ 4.37Å; V323-F326 HydrophobicContact CG1-CE1 3.96Å; V323-F326 HydrophobicContact CG1-CE2 3.88Å; V323-F326 HydrophobicContact CG1-CZ 3.53Å; V323-L373 HydrophobicContact CB-CD1 4.04Å; V323-L373 HydrophobicContact CG1-CD1 3.97Å; V323-L373 WeakPolarHBondContact O-CD1 3.38Å; V323-Y378 WeakPolarHBondContact O-CD2 3.48Å; V323-I386 HydrophobicContact CG2-CD1 3.61Å; V323-I386 HydrophobicContact CG2-CG1 3.93Å; V323-V410 HydrophobicContact CG1-CG1 3.87Å; V323-V410 HydrophobicContact CG2-CG1 4.24Å
324	K	91.3	Very high	94.5	Very high	48 Å²	48	32.6 Å²	32.6	21%	0.209	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-33.8	178	-73.4	169.2	170.2	165.1	0	112.3	Q322 L373 Y378 F411 T413 E421	Q322-K324 PolarHBondContact O-N 2.95Å; K324-L373 PolarHBondContact O-N 2.94Å; K324-Y378 HydrophobicContact CB-CE2 4.49Å; K324-Y378 WeakPolarHBondContact CE-OH 3.39Å; K324-Y378 HydrophobicContact CG-CD2 4.37Å; K324-Y378 HydrophobicContact CG-CE2 3.52Å; K324-F411 PolarHBondContact N-O 3.16Å; K324-T413 WeakPolarHBondContact CE-OG1 3.38Å; K324-T413 PolarHBondContact NZ-OG1 3.31Å; K324-E421 IonicContact NZ-OE2 2.68Å
325	Q	93.5	Very high	94.2	Very high	26 Å²	26	32.7 Å²	32.7	12%	0.121	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	149.6	-176.5	172.1	-177.3	-31.6	0	0	112.2	D327 S370 F371 F411	Q325-D327 PolarHBondContact NE2-OD1 3.43Å; Q325-S370 PolarHBondContact NE2-OG 3.35Å; Q325-F371 WeakPolarHBondContact CA-O 3.32Å; Q325-F411 HydrophobicContact CB-CB 4.33Å; Q325-F411 HydrophobicContact CB-CD2 4.24Å; Q325-F411 HydrophobicContact CG-CD2 4.04Å; Q325-F411 PolarHBondContact N-O 3.47Å; Q325-F411 PolarHBondContact O-N 3.25Å
326	F	94.7	Very high	94.1	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.018	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	146.3	164.7	-56.2	-87.1	0	0	0	110.1	V323 V343 L357 F360 F371 L373 I389 R409 V410	V323-F326 HydrophobicContact CB-CZ 4.37Å; V323-F326 HydrophobicContact CG1-CE1 3.96Å; V323-F326 HydrophobicContact CG1-CE2 3.88Å; V323-F326 HydrophobicContact CG1-CZ 3.53Å; F326-V343 HydrophobicContact CE1-CG1 3.88Å; F326-V343 HydrophobicContact CE2-CG1 4.33Å; F326-V343 HydrophobicContact CZ-CG1 3.72Å; F326-L357 HydrophobicContact CE2-CD2 3.55Å; F326-L357 HydrophobicContact CZ-CD2 3.43Å; F326-L357 VanDerWaalsContact CZ-CD2 3.43Å; F326-F360 HydrophobicContact CD2-CZ 4.43Å; F326-F360 HydrophobicContact CE2-CZ 4.41Å; F326-F371 PolarHBondContact N-O 2.97Å; F326-F371 PolarHBondContact O-N 3.09Å; F326-L373 HydrophobicContact CE2-CD1 4.12Å; F326-L373 HydrophobicContact CE2-CD2 4.3Å; F326-L373 HydrophobicContact CE2-CG 4.26Å; F326-I389 HydrophobicContact CE1-CD1 4.04Å; F326-I389 HydrophobicContact CE1-CG2 4.46Å; F326-R409 WeakPolarHBondContact CA-O 3.2Å; F326-V410 HydrophobicContact CD1-CG1 4.4Å; F326-V410 HydrophobicContact CD1-CG2 4.03Å; F326-V410 HydrophobicContact CE1-CG1 4.18Å; F326-V410 HydrophobicContact CE1-CG2 4.25Å
327	D	96.3	Very high	93.9	Very high	7 Å²	7	31.7 Å²	31.7	4%	0.037	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	147.7	158.2	-66.8	-11.1	0	0	0	109.4	Q325 V368 Q369 S370 I408 R409 F411	Q325-D327 PolarHBondContact NE2-OD1 3.43Å; D327-V368 HydrophobicContact CB-CG1 3.72Å; D327-V368 WeakPolarHBondContact OD2-CG1 3.34Å; D327-Q369 WeakPolarHBondContact CA-O 3.25Å; D327-S370 WeakPolarHBondContact OD1-CA 3.46Å; D327-S370 VanDerWaalsContact OD1-CB 3.22Å; D327-S370 WeakPolarHBondContact OD1-CB 3.35Å; D327-S370 PolarHBondContact OD1-OG 3.39Å; D327-I408 WeakPolarHBondContact O-CA 3.4Å; D327-I408 WeakPolarHBondContact O-CG1 3.47Å; D327-R409 HydrophobicContact CB-CB 3.94Å; D327-R409 HydrophobicContact CB-CG 4.15Å; D327-R409 PolarHBondContact N-O 2.94Å; D327-R409 PolarHBondContact O-N 3.42Å; D327-R409 IonicContact OD2-CZ 3.74Å; D327-R409 IonicContact OD2-NH1 2.72Å; D327-R409 PolarHBondContact OD2-NH1 3.5Å; D327-F411 WeakPolarHBondContact OD2-CE2 3.4Å
328	I	96.4	Very high	93.8	Very high	5 Å²	5	32 Å²	32	3%	0.026	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	147.9	168.6	-148.3	171.1	0	0	0	109.6	P338 F341 Q369 F371 L405 L407	I328-P338 HydrophobicContact CD1-CG 4.47Å; I328-F341 HydrophobicContact CD1-CE1 4.4Å; I328-F341 HydrophobicContact CD1-CE2 4.5Å; I328-F341 HydrophobicContact CD1-CZ 4.35Å; I328-F341 HydrophobicContact CG2-CE1 4.47Å; I328-Q369 HydrophobicContact CG2-CB 4.4Å; I328-Q369 PolarHBondContact N-O 2.98Å; I328-Q369 PolarHBondContact O-N 3.11Å; I328-F371 HydrophobicContact CB-CE2 4.42Å; I328-F371 HydrophobicContact CG2-CE2 3.71Å; I328-F371 HydrophobicContact CG2-CZ 4.43Å; I328-L405 HydrophobicContact CD1-CD1 3.85Å; I328-L405 HydrophobicContact CG1-CD1 3.39Å; I328-L407 CarbonylContact C-O 3.6Å; I328-L407 WeakPolarHBondContact CA-O 3.28Å
329	A	95.8	Very high	93.7	Very high	1 Å²	1	34 Å²	34	1%	0.008	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	141.8	170.3	0	0	0	0	0	112.4	Y331 V368 L405 S406 L407	A329-Y331 HydrophobicContact CB-CD1 4.41Å; A329-Y331 HydrophobicContact CB-CE1 3.75Å; A329-Y331 HydrophobicContact CB-CE2 4.24Å; A329-V368 HydrophobicContact CB-CG2 4.2Å; A329-L405 WeakPolarHBondContact O-CD1 3.42Å; A329-S406 WeakPolarHBondContact O-CB 3.44Å; A329-S406 PolarHBondContact O-N 3.47Å; A329-L407 HydrophobicContact CB-CB 4.03Å; A329-L407 PolarHBondContact N-O 2.98Å; A329-L407 PolarHBondContact O-N 3.05Å
330	N	94.9	Very high	93.8	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.021	15%	0.153	C	C	.	.			trans	-120.5	120.5	160.6	175.7	10.1	0	0	0	107.2	E332 S335 R366 P404	N330-E332 WeakPolarHBondContact OD1-CB 3.2Å; N330-E332 PolarHBondContact OD1-N 2.86Å; N330-S335 PolarHBondContact ND2-OG 2.97Å; N330-R366 CarbonylContact O-C 3.54Å; N330-R366 WeakPolarHBondContact O-CA 3.38Å; N330-R366 WeakPolarHBondContact O-CB 3.45Å; N330-P404 PolarHBondContact ND2-O 2.99Å
331	Y	94.5	Very high	93.9	Very high	45 Å²	45	29.8 Å²	29.8	18%	0.176	14%	0.141	C	C	.	.			trans	-96.1	-10.5	178.2	-54.8	-55.9	0	0	0	113.2	M299 A329 L333 V368 S406 L407	M299-Y331 HydrophobicContact CB-CD2 4.07Å; M299-Y331 HydrophobicContact CB-CE2 4.49Å; M299-Y331 HydrophobicContact CE-CD1 3.75Å; M299-Y331 HydrophobicContact CE-CD2 4.19Å; M299-Y331 HydrophobicContact CE-CE1 4.11Å; M299-Y331 HydrophobicContact CE-CG 3.79Å; M299-Y331 HydrophobicContact CG-CD2 4.03Å; M299-Y331 HydrophobicContact CG-CE2 4.02Å; A329-Y331 HydrophobicContact CB-CD1 4.41Å; A329-Y331 HydrophobicContact CB-CE1 3.75Å; A329-Y331 HydrophobicContact CB-CE2 4.24Å; Y331-L333 PolarHBondContact O-N 2.89Å; Y331-V368 HydrophobicContact CE1-CG2 4.45Å; Y331-V368 WeakPolarHBondContact OH-CG2 3.43Å; Y331-S406 PolarHBondContact N-OG 3.4Å; Y331-L407 HydrophobicContact CE2-CB 4.45Å
332	E	93.1	Very high	94	Very high	55 Å²	55	30.5 Å²	30.5	26%	0.257	14%	0.144	S	C	.	.			trans	-71.7	115.8	-176.3	176.5	54	-99.2	0	0	111.4	N330 F334 S335 R366 P404	N330-E332 WeakPolarHBondContact OD1-CB 3.2Å; N330-E332 PolarHBondContact OD1-N 2.86Å; E332-F334 PolarHBondContact OE1-N 2.7Å; E332-S335 WeakPolarHBondContact CB-OG 3.48Å; E332-S335 WeakPolarHBondContact CG-OG 3.26Å; E332-S335 PolarHBondContact O-OG 3.11Å; E332-R366 WeakPolarHBondContact O-CD 3.21Å; E332-R366 PolarHBondContact O-NE 2.87Å; E332-P404 HydrophobicContact CB-CG 3.88Å; E332-P404 HydrophobicContact CG-CG 4.17Å
333	L	88.3	Confident	94.2	Very high	116 Å²	116	30.1 Å²	30.1	61%	0.607	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-42.1	-176.5	-71.4	164.5	0	0	0	112.1	Y331 S335 R366	Y331-L333 PolarHBondContact O-N 2.89Å; L333-S335 PolarHBondContact O-N 3.21Å; L333-R366 PolarHBondContact O-NE 3.16Å; L333-R366 PolarHBondContact O-NH2 3.17Å
334	F	87.1	Confident	94.4	Very high	174 Å²	174	29.8 Å²	29.8	76%	0.763	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.7	49.2	-173.2	-56	-73.9	0	0	0	111.8	E332	E332-F334 PolarHBondContact OE1-N 2.7Å
335	S	92.9	Very high	94.6	Very high	6 Å²	6	27.7 Å²	27.7	4%	0.042	13%	0.132	C	C	.	.	S	Bend	trans	-144.5	163.5	-178.9	72.2	0	0	0	0	113.9	N330 E332 L333 R366 P404	N330-S335 PolarHBondContact ND2-OG 2.97Å; E332-S335 WeakPolarHBondContact CB-OG 3.48Å; E332-S335 WeakPolarHBondContact CG-OG 3.26Å; E332-S335 PolarHBondContact O-OG 3.11Å; L333-S335 PolarHBondContact O-N 3.21Å; S335-R366 PolarHBondContact O-NH2 3.35Å; S335-P404 VanDerWaalsContact CB-CG 3.45Å; S335-P404 VanDerWaalsContact OG-CG 3.28Å; S335-P404 WeakPolarHBondContact OG-CG 3.22Å
336	S	94.9	Very high	94.7	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.13	C	C	.	.	P	Polyproline II helix	trans	-78.4	126.4	172.2	-94.6	0	0	0	0	110.8	C307 F397 S399 E400 F402	C307-S336 VanDerWaalsContact SG-CB 3.51Å; S336-F397 WeakPolarHBondContact CA-O 3.42Å; S336-F397 WeakPolarHBondContact CB-O 3.28Å; S336-F397 PolarHBondContact OG-O 3.02Å; S336-S399 PolarHBondContact OG-N 3.06Å; S336-E400 PolarHBondContact OG-N 3.41Å; S336-E400 VanDerWaalsContact OG-N 3.11Å; S336-F402 PolarHBondContact N-O 3.18Å
337	T	94.8	Very high	94.6	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.012	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-86.3	145.7	-177.9	52	0	0	0	0	111.2	K339 D364 R366 H396 F397	T337-K339 PolarHBondContact O-N 3.36Å; T337-D364 WeakPolarHBondContact CG2-OD1 3.31Å; T337-D364 PolarHBondContact OG1-OD1 3.05Å; T337-R366 HydrophobicContact CG2-CG 3.96Å; T337-H396 CarbonylContact O-C 3.6Å; T337-H396 WeakPolarHBondContact O-CA 3.42Å; T337-H396 WeakPolarHBondContact O-CB 3.2Å; T337-F397 PolarHBondContact O-N 2.84Å; T337-F397 WeakPolarHBondContact OG1-CB 3.45Å; T337-F397 WeakPolarHBondContact OG1-CD2 3.43Å
338	P	94.6	Very high	94.5	Very high	8 Å²	8	38.3 Å²	38.3	5%	0.052	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-66.2	132.8	178.1	27.5	-34.5	0	0	0	110.9	I328 L393	I328-P338 HydrophobicContact CD1-CG 4.47Å; P338-L393 HydrophobicContact CB-CD2 3.84Å; P338-L393 HydrophobicContact CB-CG 4.24Å
339	K	95.4	Very high	94.4	Very high	66 Å²	66	42.1 Å²	42.1	29%	0.287	19%	0.192	S	C	.	.			trans	-106.4	-85.4	-178.2	176.3	179.2	176	-80.3	0	110.8	T337 G362 S395 F397	T337-K339 PolarHBondContact O-N 3.36Å; K339-G362 PolarHBondContact O-N 2.85Å; K339-S395 WeakPolarHBondContact CB-OG 3.48Å; K339-S395 WeakPolarHBondContact CG-OG 3.15Å; K339-S395 PolarHBondContact N-O 2.81Å; K339-F397 HydrophobicContact CB-CD2 3.62Å; K339-F397 HydrophobicContact CB-CE1 4.45Å; K339-F397 HydrophobicContact CB-CE2 3.51Å; K339-F397 HydrophobicContact CB-CG 4.16Å; K339-F397 HydrophobicContact CB-CZ 3.97Å; K339-F397 HydrophobicContact CD-CD1 3.93Å; K339-F397 HydrophobicContact CD-CD2 4.47Å; K339-F397 HydrophobicContact CD-CE1 3.66Å; K339-F397 HydrophobicContact CD-CE2 4.24Å; K339-F397 HydrophobicContact CD-CG 4.33Å; K339-F397 HydrophobicContact CD-CZ 3.83Å; K339-F397 HydrophobicContact CG-CD1 4.36Å; K339-F397 HydrophobicContact CG-CD2 4.1Å; K339-F397 HydrophobicContact CG-CE1 3.9Å; K339-F397 HydrophobicContact CG-CE2 3.61Å; K339-F397 HydrophobicContact CG-CG 4.46Å; K339-F397 HydrophobicContact CG-CZ 3.51Å
340	D	96.7	Very high	94.3	Very high	31 Å²	31	47.4 Å²	47.4	17%	0.166	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	129.4	-179.6	-43.6	-50.7	0	0	0	108.7	F360 H361 L394 S395	D340-F360 WeakPolarHBondContact CA-O 3.43Å; D340-H361 IonicContact OD1-CD2 2.97Å; D340-H361 PolarHBondContact OD1-CD2 3.34Å; D340-H361 IonicContact OD1-CG 2.74Å; D340-L394 HydrophobicContact CB-CB 4.33Å; D340-L394 WeakPolarHBondContact O-CA 3.47Å; D340-L394 WeakPolarHBondContact O-CB 3.43Å; D340-L394 PolarHBondContact O-N 2.96Å; D340-S395 WeakPolarHBondContact CB-OG 3.08Å; D340-S395 PolarHBondContact N-OG 3.49Å; D340-S395 PolarHBondContact O-N 3.17Å; D340-S395 PolarHBondContact OD2-OG 2.81Å
341	F	97.1	Very high	94.2	Very high	6 Å²	6	49 Å²	49	3%	0.026	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	139.9	178.9	66.8	-85.4	0	0	0	113	I328 V343 T359 F360 F371 V391 E392 L393	I328-F341 HydrophobicContact CD1-CE1 4.4Å; I328-F341 HydrophobicContact CD1-CE2 4.5Å; I328-F341 HydrophobicContact CD1-CZ 4.35Å; I328-F341 HydrophobicContact CG2-CE1 4.47Å; F341-V343 HydrophobicContact CD2-CG2 3.85Å; F341-V343 HydrophobicContact CE2-CG2 3.8Å; F341-T359 CarbonylContact O-C 3.52Å; F341-T359 WeakPolarHBondContact O-CA 3.47Å; F341-F360 HydrophobicContact CD1-CB 4.17Å; F341-F360 HydrophobicContact CD2-CB 4.23Å; F341-F360 HydrophobicContact CE1-CB 3.7Å; F341-F360 HydrophobicContact CE2-CB 3.77Å; F341-F360 HydrophobicContact CE2-CD2 4.14Å; F341-F360 HydrophobicContact CE2-CG 4.19Å; F341-F360 HydrophobicContact CG-CB 4.43Å; F341-F360 HydrophobicContact CZ-CB 3.49Å; F341-F360 VanDerWaalsContact CZ-CB 3.49Å; F341-F360 HydrophobicContact CZ-CG 4.22Å; F341-F360 PolarHBondContact N-O 3.29Å; F341-F360 PolarHBondContact O-N 2.95Å; F341-F371 HydrophobicContact CE1-CD2 4.45Å; F341-F371 HydrophobicContact CE1-CE1 4.3Å; F341-F371 AromaticContact CE1-CE2 4Å; F341-F371 HydrophobicContact CE1-CE2 4Å; F341-F371 AromaticContact CE1-CZ 3.92Å; F341-F371 HydrophobicContact CE1-CZ 3.92Å; F341-F371 HydrophobicContact CZ-CD1 4.49Å; F341-F371 AromaticContact CZ-CD2 3.84Å; F341-F371 HydrophobicContact CZ-CD2 3.84Å; F341-F371 HydrophobicContact CZ-CE1 4.46Å; F341-F371 AromaticContact CZ-CE2 3.81Å; F341-F371 HydrophobicContact CZ-CE2 3.81Å; F341-F371 HydrophobicContact CZ-CG 4.2Å; F341-F371 HydrophobicContact CZ-CZ 4.13Å; F341-V391 HydrophobicContact CD2-CG1 4.2Å; F341-E392 CarbonylContact C-O 3.58Å; F341-E392 WeakPolarHBondContact CA-O 3.33Å; F341-L393 HydrophobicContact CB-CD1 4.4Å; F341-L393 HydrophobicContact CB-CG 4.42Å
342	L	96.9	Very high	94	Very high	14 Å²	14	53.9 Å²	53.9	7%	0.073	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	126.2	178.2	172.8	66.3	0	0	0	109.8	K356 V391 E392 L394	L342-K356 HydrophobicContact CD1-CB 4.37Å; L342-K356 HydrophobicContact CD1-CD 4.25Å; L342-K356 HydrophobicContact CD1-CG 4.26Å; L342-K356 HydrophobicContact CD2-CD 4.4Å; L342-V391 WeakPolarHBondContact O-CA 3.13Å; L342-E392 HydrophobicContact CB-CB 4.42Å; L342-E392 PolarHBondContact N-O 2.8Å; L342-E392 PolarHBondContact O-N 3.19Å; L342-L394 HydrophobicContact CB-CD1 4.17Å; L342-L394 HydrophobicContact CB-CD2 4.22Å; L342-L394 HydrophobicContact CB-CG 4.33Å
343	V	96.6	Very high	93.9	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.006	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133.3	168.5	-172.6	0	0	0	0	109.6	F326 F341 L357 G358 F360 I389	F326-V343 HydrophobicContact CE1-CG1 3.88Å; F326-V343 HydrophobicContact CE2-CG1 4.33Å; F326-V343 HydrophobicContact CZ-CG1 3.72Å; F341-V343 HydrophobicContact CD2-CG2 3.85Å; F341-V343 HydrophobicContact CE2-CG2 3.8Å; V343-L357 HydrophobicContact CG1-CD2 4.28Å; V343-L357 WeakPolarHBondContact O-CB 3.47Å; V343-L357 PolarHBondContact O-N 3.03Å; V343-G358 PolarHBondContact N-O 3.28Å; V343-G358 PolarHBondContact O-N 3.47Å; V343-F360 HydrophobicContact CB-CD2 4.3Å; V343-F360 HydrophobicContact CB-CE2 3.94Å; V343-F360 HydrophobicContact CG2-CD2 3.75Å; V343-F360 HydrophobicContact CG2-CE2 3.8Å; V343-I389 HydrophobicContact CG1-CG2 3.74Å
344	S	96	Very high	94.3	Very high	6 Å²	6	56.6 Å²	56.6	4%	0.042	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	150.5	173.1	-53.9	0	0	0	0	110.7	I355 I389 K390	S344-I355 CarbonylContact C-O 3.59Å; S344-I355 WeakPolarHBondContact CA-O 3.45Å; S344-I355 WeakPolarHBondContact CB-O 3.22Å; S344-I389 CarbonylContact O-C 3.59Å; S344-I389 WeakPolarHBondContact O-CA 3.19Å; S344-K390 PolarHBondContact N-O 2.86Å; S344-K390 PolarHBondContact O-N 2.99Å
345	I	95.6	Very high	94.6	Very high	5 Å²	5	50.9 Å²	50.9	3%	0.026	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	157.5	-171.3	61.7	-179.2	0	0	0	112.3	I355 L357 Y381 I386 Y388 I389	I345-I355 HydrophobicContact CG1-CB 4Å; I345-I355 HydrophobicContact CG1-CG2 4.23Å; I345-I355 PolarHBondContact N-O 3.43Å; I345-I355 PolarHBondContact O-N 2.68Å; I345-L357 HydrophobicContact CD1-CB 4.49Å; I345-L357 HydrophobicContact CD1-CD1 4.31Å; I345-L357 HydrophobicContact CD1-CD2 4.49Å; I345-L357 HydrophobicContact CG2-CB 4.23Å; I345-L357 HydrophobicContact CG2-CD2 3.78Å; I345-Y381 HydrophobicContact CD1-CG 4.49Å; I345-I386 HydrophobicContact CB-CB 4.3Å; I345-I386 HydrophobicContact CB-CD1 4.26Å; I345-I386 HydrophobicContact CB-CG1 4.01Å; I345-I386 HydrophobicContact CB-CG2 4.18Å; I345-I386 HydrophobicContact CD1-CG1 4.41Å; I345-I386 HydrophobicContact CD1-CG2 4.08Å; I345-I386 HydrophobicContact CG1-CG2 4.28Å; I345-I386 HydrophobicContact CG2-CD1 4.06Å; I345-I386 HydrophobicContact CG2-CG1 4.15Å; I345-Y388 CarbonylContact C-O 3.5Å; I345-Y388 WeakPolarHBondContact CA-O 3.48Å; I345-I389 HydrophobicContact CG2-CG1 4.16Å
346	S	95.5	Very high	94.6	Very high	12 Å²	12	57.3 Å²	57.3	8%	0.084	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	148	171.3	-169.1	0	0	0	0	112.4	R348 K387 Y388	S346-R348 VanDerWaalsContact C-N 3.31Å; S346-R348 WeakPolarHBondContact CB-O 3.48Å; S346-R348 PolarHBondContact OG-N 2.97Å; S346-R348 VanDerWaalsContact OG-N 3.1Å; S346-R348 PolarHBondContact OG-O 3.3Å; S346-K387 PolarHBondContact O-N 2.91Å; S346-Y388 PolarHBondContact N-O 3.12Å; S346-Y388 PolarHBondContact O-N 2.89Å
347	D	93.6	Very high	94.5	Very high	70 Å²	70	57.7 Å²	57.7	37%	0.374	28%	0.275	S	S	.	.	S	Bend	trans	-69.3	-29.2	164.7	171.3	51.6	0	0	0	111.5	Y388	D347-Y388 WeakPolarHBondContact O-CD2 3.23Å; D347-Y388 VanDerWaalsContact O-CE2 3.23Å; D347-Y388 WeakPolarHBondContact O-CE2 3.46Å
348	R	93.1	Very high	94.4	Very high	177 Å²	177	58.2 Å²	58.2	67%	0.668	28%	0.281	S	S	*	.	S	Bend	trans	-131.1	148.1	-170.1	-53.2	-173	-171.3	-114.9	-26.5	113.5	S346 T351 Y388	S346-R348 VanDerWaalsContact C-N 3.31Å; S346-R348 WeakPolarHBondContact CB-O 3.48Å; S346-R348 PolarHBondContact OG-N 2.97Å; S346-R348 VanDerWaalsContact OG-N 3.1Å; S346-R348 PolarHBondContact OG-O 3.3Å; R348-T351 WeakPolarHBondContact O-CB 3.48Å; R348-T351 WeakPolarHBondContact O-CG2 3.49Å; R348-Y388 VanDerWaalsContact C-CD2 3.48Å
349	Y	95.1	Very high	94.4	Very high	85 Å²	85	61.1 Å²	61.1	33%	0.333	30%	0.299	S	S	.	.	S	Bend	trans	-138.4	140.2	172.2	-174.1	-87.9	0	0	0	110.3	L282 V314 W354 Y388	L282-Y349 HydrophobicContact CB-CE1 4.16Å; L282-Y349 HydrophobicContact CD1-CD1 3.48Å; L282-Y349 VanDerWaalsContact CD1-CD1 3.48Å; L282-Y349 HydrophobicContact CD1-CD2 4.08Å; L282-Y349 HydrophobicContact CD1-CE1 3.79Å; L282-Y349 HydrophobicContact CD1-CE2 4.35Å; L282-Y349 HydrophobicContact CD1-CG 3.62Å; V314-Y349 HydrophobicContact CB-CE2 4.45Å; V314-Y349 HydrophobicContact CG1-CD2 4.01Å; V314-Y349 HydrophobicContact CG1-CE2 3.86Å; V314-Y349 HydrophobicContact CG2-CE2 4.42Å; Y349-W354 HydrophobicContact CD2-CH2 4.33Å; Y349-W354 HydrophobicContact CD2-CZ2 4.05Å; Y349-W354 HydrophobicContact CE2-CZ2 4.31Å; Y349-Y388 HydrophobicContact CG-CD1 4.29Å; Y349-Y388 HydrophobicContact CG-CE1 4.47Å
350	P	94.4	Very high	94.4	Very high	113 Å²	113	58.8 Å²	58.8	73%	0.734	29%	0.289	S	S	*	.	S	Bend	cis	-63.4	151.9	-7.9	-21.3	34.4	0	0	0	112.7
351	T	92.9	Very high	94.4	Very high	38 Å²	38	63.2 Å²	63.2	23%	0.233	31%	0.309	C	S	.	.			trans	-138	141.6	173.6	-178.5	0	0	0	0	111.5	R348 K353 W354	R348-T351 WeakPolarHBondContact O-CB 3.48Å; R348-T351 WeakPolarHBondContact O-CG2 3.49Å; T351-K353 PolarHBondContact OG1-N 2.68Å; T351-K353 VanDerWaalsContact OG1-N 3.09Å; T351-K353 PolarHBondContact OG1-O 3.05Å; T351-W354 HydrophobicContact CG2-CD2 3.81Å; T351-W354 VanDerWaalsContact CG2-CE2 3.46Å; T351-W354 HydrophobicContact CG2-CE3 4.37Å; T351-W354 HydrophobicContact CG2-CG 4.16Å; T351-W354 HydrophobicContact CG2-CH2 4.32Å; T351-W354 HydrophobicContact CG2-CZ2 3.76Å; T351-W354 PolarHBondContact O-NE1 3.17Å
352	N	89.4	Confident	94.3	Very high	146 Å²	146	63.4 Å²	63.4	78%	0.781	31%	0.312	S	S	*	.	S	Bend	trans	-91.7	-9.4	171.1	61.3	3.4	0	0	0	112.9
353	K	91.9	Very high	94.2	Very high	166 Å²	166	68.3 Å²	68.3	72%	0.722	33%	0.329	S	S	*	.			trans	-126.5	82.7	-174.6	-73.9	171.7	-176.3	177.1	0	110.2	T351	T351-K353 PolarHBondContact OG1-N 2.68Å; T351-K353 VanDerWaalsContact OG1-N 3.09Å; T351-K353 PolarHBondContact OG1-O 3.05Å
354	W	95.1	Very high	94.1	Very high	63 Å²	63	72.1 Å²	72.1	24%	0.239	35%	0.35	C	S	.	.			trans	-76.3	130.5	173.5	-73.5	92.6	0	0	0	111.3	V314 Y349 T351 K356 K390	V314-W354 HydrophobicContact CG1-CH2 3.79Å; V314-W354 HydrophobicContact CG1-CZ2 4.22Å; V314-W354 HydrophobicContact CG2-CH2 4.32Å; V314-W354 HydrophobicContact CG2-CZ2 4.15Å; Y349-W354 HydrophobicContact CD2-CH2 4.33Å; Y349-W354 HydrophobicContact CD2-CZ2 4.05Å; Y349-W354 HydrophobicContact CE2-CZ2 4.31Å; T351-W354 HydrophobicContact CG2-CD2 3.81Å; T351-W354 VanDerWaalsContact CG2-CE2 3.46Å; T351-W354 HydrophobicContact CG2-CE3 4.37Å; T351-W354 HydrophobicContact CG2-CG 4.16Å; T351-W354 HydrophobicContact CG2-CH2 4.32Å; T351-W354 HydrophobicContact CG2-CZ2 3.76Å; T351-W354 PolarHBondContact O-NE1 3.17Å; W354-K356 PolarHBondContact O-N 2.78Å; W354-K390 HydrophobicContact CD2-CB 4.03Å; W354-K390 HydrophobicContact CD2-CD 4.38Å; W354-K390 HydrophobicContact CE3-CB 3.73Å; W354-K390 HydrophobicContact CH2-CB 3.88Å; W354-K390 HydrophobicContact CZ2-CB 4.15Å; W354-K390 HydrophobicContact CZ3-CB 3.65Å
355	I	94.1	Very high	94	Very high	54 Å²	54	75.4 Å²	75.4	28%	0.277	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	113.8	176.2	-60.8	174.5	0	0	0	108.1	S344 I345 L357 Y381 M384	S344-I355 CarbonylContact C-O 3.59Å; S344-I355 WeakPolarHBondContact CA-O 3.45Å; S344-I355 WeakPolarHBondContact CB-O 3.22Å; I345-I355 HydrophobicContact CG1-CB 4Å; I345-I355 HydrophobicContact CG1-CG2 4.23Å; I345-I355 PolarHBondContact N-O 3.43Å; I345-I355 PolarHBondContact O-N 2.68Å; I355-L357 PolarHBondContact O-N 3.36Å; I355-Y381 HydrophobicContact CG2-CD1 4.27Å; I355-Y381 HydrophobicContact CG2-CE1 3.53Å; I355-M384 HydrophobicContact CD1-CE 3.58Å; I355-M384 HydrophobicContact CD1-SD 3.91Å
356	K	93.6	Very high	93.8	Very high	140 Å²	140	79 Å²	79	61%	0.609	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	115.6	175.8	-65.3	-174	179.8	-174.9	0	109.6	L342 W354 Y381	L342-K356 HydrophobicContact CD1-CB 4.37Å; L342-K356 HydrophobicContact CD1-CD 4.25Å; L342-K356 HydrophobicContact CD1-CG 4.26Å; L342-K356 HydrophobicContact CD2-CD 4.4Å; W354-K356 PolarHBondContact O-N 2.78Å; K356-Y381 PolarHBondContact O-OH 3.1Å
357	L	92.5	Very high	93.7	Very high	8 Å²	8	81.8 Å²	81.8	4%	0.042	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-51.9	-179.2	177.5	54.8	0	0	0	110.2	F326 V343 I345 I355 L373 M377 Y381	F326-L357 HydrophobicContact CE2-CD2 3.55Å; F326-L357 HydrophobicContact CZ-CD2 3.43Å; F326-L357 VanDerWaalsContact CZ-CD2 3.43Å; V343-L357 HydrophobicContact CG1-CD2 4.28Å; V343-L357 WeakPolarHBondContact O-CB 3.47Å; V343-L357 PolarHBondContact O-N 3.03Å; I345-L357 HydrophobicContact CD1-CB 4.49Å; I345-L357 HydrophobicContact CD1-CD1 4.31Å; I345-L357 HydrophobicContact CD1-CD2 4.49Å; I345-L357 HydrophobicContact CG2-CB 4.23Å; I345-L357 HydrophobicContact CG2-CD2 3.78Å; I355-L357 PolarHBondContact O-N 3.36Å; L357-L373 HydrophobicContact CD1-CD1 4.43Å; L357-L373 HydrophobicContact CD1-CD2 3.72Å; L357-L373 HydrophobicContact CD2-CD1 4.21Å; L357-L373 HydrophobicContact CD2-CD2 4Å; L357-L373 HydrophobicContact CG-CD2 3.78Å; L357-M377 VanDerWaalsContact O-SD 3.34Å; L357-Y381 HydrophobicContact CD1-CD2 3.29Å; L357-Y381 HydrophobicContact CD1-CE2 3.66Å; L357-Y381 HydrophobicContact CD1-CG 4.17Å
358	G	92.1	Very high	93.8	Very high	13 Å²	13	80.9 Å²	80.9	13%	0.134	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.2	163.6	177	0	0	0	0	0	112.4	V343 F360	V343-G358 PolarHBondContact N-O 3.28Å; V343-G358 PolarHBondContact O-N 3.47Å; G358-F360 WeakPolarHBondContact O-CE2 3.37Å
359	T	95.1	Very high	93.9	Very high	69 Å²	69	72.8 Å²	72.8	42%	0.423	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	121	166.1	-55	0	0	0	0	108.4	F341 H361 L394	F341-T359 CarbonylContact O-C 3.52Å; F341-T359 WeakPolarHBondContact O-CA 3.47Å; T359-H361 PolarHBondContact O-ND1 2.89Å; T359-L394 HydrophobicContact CG2-CD1 3.79Å
360	F	95.6	Very high	94	Very high	18 Å²	18	71.5 Å²	71.5	8%	0.079	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	149.1	-173.4	-60.1	-90.5	0	0	0	109.5	F326 D340 F341 V343 G358 F371 L373	F326-F360 HydrophobicContact CD2-CZ 4.43Å; F326-F360 HydrophobicContact CE2-CZ 4.41Å; D340-F360 WeakPolarHBondContact CA-O 3.43Å; F341-F360 HydrophobicContact CD1-CB 4.17Å; F341-F360 HydrophobicContact CD2-CB 4.23Å; F341-F360 HydrophobicContact CE1-CB 3.7Å; F341-F360 HydrophobicContact CE2-CB 3.77Å; F341-F360 HydrophobicContact CE2-CD2 4.14Å; F341-F360 HydrophobicContact CE2-CG 4.19Å; F341-F360 HydrophobicContact CG-CB 4.43Å; F341-F360 HydrophobicContact CZ-CB 3.49Å; F341-F360 VanDerWaalsContact CZ-CB 3.49Å; F341-F360 HydrophobicContact CZ-CG 4.22Å; F341-F360 PolarHBondContact N-O 3.29Å; F341-F360 PolarHBondContact O-N 2.95Å; V343-F360 HydrophobicContact CB-CD2 4.3Å; V343-F360 HydrophobicContact CB-CE2 3.94Å; V343-F360 HydrophobicContact CG2-CD2 3.75Å; V343-F360 HydrophobicContact CG2-CE2 3.8Å; G358-F360 WeakPolarHBondContact O-CE2 3.37Å; F360-F371 HydrophobicContact CB-CD1 4.03Å; F360-F371 HydrophobicContact CB-CE1 4.43Å; F360-F371 HydrophobicContact CB-CG 4.44Å; F360-F371 HydrophobicContact CD1-CB 3.81Å; F360-F371 HydrophobicContact CD1-CD1 4.11Å; F360-F371 HydrophobicContact CD1-CG 4.22Å; F360-F371 HydrophobicContact CE1-CB 4.25Å; F360-F371 HydrophobicContact CG-CD1 4.48Å; F360-L373 HydrophobicContact CE1-CD2 4.41Å; F360-L373 HydrophobicContact CZ-CD2 3.86Å
361	H	96.4	Very high	94	Very high	124 Å²	124	67 Å²	67	57%	0.574	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.7	103.1	-172.2	-59.5	72.6	0	0	0	108.2	D340 T359	D340-H361 IonicContact OD1-CD2 2.97Å; D340-H361 PolarHBondContact OD1-CD2 3.34Å; D340-H361 IonicContact OD1-CG 2.74Å; T359-H361 PolarHBondContact O-ND1 2.89Å
362	G	95.1	Very high	94	Very high	9 Å²	9	69.3 Å²	69.3	9%	0.093	35%	0.349	C	S	.	.			trans	-71.2	163.4	174.5	0	0	0	0	0	112.9	K339 F397	K339-G362 PolarHBondContact O-N 2.85Å; G362-F397 WeakPolarHBondContact O-CE2 3.49Å; G362-F397 WeakPolarHBondContact O-CZ 3.42Å
363	R	94.9	Very high	94.1	Very high	117 Å²	117	63.2 Å²	63.2	44%	0.442	32%	0.316	S	S	.	.			trans	-100.6	160.1	170.4	-57	-175.3	-58.6	-74	-5.3	108.8	E365 Q369 F397	R363-E365 HydrophobicContact CB-CB 4.5Å; R363-E365 HydrophobicContact CB-CG 4.08Å; R363-E365 WeakPolarHBondContact CD-OE1 3.38Å; R363-E365 IonicContact CZ-OE1 3.17Å; R363-E365 IonicContact CZ-OE2 3.43Å; R363-E365 IonicContact NE-OE1 3.49Å; R363-E365 PolarHBondContact NE-OE1 2.83Å; R363-E365 IonicContact NE-OE2 2.66Å; R363-E365 PolarHBondContact NE-OE2 2.93Å; R363-E365 IonicContact NH2-OE1 2.66Å; R363-E365 IonicContact NH2-OE2 3.92Å; R363-E365 PolarHBondContact NH2-OE2 3.48Å; R363-E365 PolarHBondContact O-N 3.2Å; R363-Q369 PolarHBondContact O-NE2 3.39Å; R363-F397 VanDerWaalsContact C-CE2 3.48Å
364	D	94.6	Very high	93.7	Very high	82 Å²	82	60.6 Å²	60.6	44%	0.439	31%	0.31	S	S	.	.	S	Bend	trans	-78.8	67.3	172.4	-167.6	11.9	0	0	0	110.4	T337 R366 F397	T337-D364 WeakPolarHBondContact CG2-OD1 3.31Å; T337-D364 PolarHBondContact OG1-OD1 3.05Å; D364-R366 IonicContact OD1-NH1 2.71Å; D364-F397 HydrophobicContact CB-CB 4.19Å; D364-F397 HydrophobicContact CB-CD1 4.2Å; D364-F397 HydrophobicContact CB-CD2 3.85Å; D364-F397 HydrophobicContact CB-CE2 4.19Å; D364-F397 HydrophobicContact CB-CG 3.85Å
365	E	92.9	Very high	93	Very high	74 Å²	74	65.6 Å²	65.6	35%	0.346	34%	0.336	S	S	.	.			trans	-127.7	122.9	-177.5	-73.1	173.7	-157	0	0	109.6	R363 T367 Q369	R363-E365 HydrophobicContact CB-CB 4.5Å; R363-E365 HydrophobicContact CB-CG 4.08Å; R363-E365 WeakPolarHBondContact CD-OE1 3.38Å; R363-E365 IonicContact CZ-OE1 3.17Å; R363-E365 IonicContact CZ-OE2 3.43Å; R363-E365 IonicContact NE-OE1 3.49Å; R363-E365 PolarHBondContact NE-OE1 2.83Å; R363-E365 IonicContact NE-OE2 2.66Å; R363-E365 PolarHBondContact NE-OE2 2.93Å; R363-E365 IonicContact NH2-OE1 2.66Å; R363-E365 IonicContact NH2-OE2 3.92Å; R363-E365 PolarHBondContact NH2-OE2 3.48Å; R363-E365 PolarHBondContact O-N 3.2Å; E365-T367 PolarHBondContact O-N 2.87Å; E365-Q369 PolarHBondContact O-NE2 2.86Å
366	R	91.3	Very high	92.2	Very high	81 Å²	81	71.2 Å²	71.2	31%	0.306	36%	0.361	S	S	.	.	S	Bend	trans	-85.2	48.7	-179.6	-69.4	176.8	178.5	70.2	3	112.4	N330 E332 L333 S335 T337 D364	N330-R366 CarbonylContact O-C 3.54Å; N330-R366 WeakPolarHBondContact O-CA 3.38Å; N330-R366 WeakPolarHBondContact O-CB 3.45Å; E332-R366 WeakPolarHBondContact O-CD 3.21Å; E332-R366 PolarHBondContact O-NE 2.87Å; L333-R366 PolarHBondContact O-NE 3.16Å; L333-R366 PolarHBondContact O-NH2 3.17Å; S335-R366 PolarHBondContact O-NH2 3.35Å; T337-R366 HydrophobicContact CG2-CG 3.96Å; D364-R366 IonicContact OD1-NH1 2.71Å
367	T	93.5	Very high	91.4	Very high	71 Å²	71	66.7 Å²	66.7	44%	0.436	34%	0.343	S	S	.	.	S	Bend	trans	-136.9	174.4	-175.8	55	0	0	0	0	109.5	E365 Q369	E365-T367 PolarHBondContact O-N 2.87Å; T367-Q369 PolarHBondContact O-N 3.48Å
368	V	96.1	Very high	90.8	Very high	50 Å²	50	69.4 Å²	69.4	30%	0.303	35%	0.353	S	S	.	.			trans	-68.3	121	171.1	-175.6	0	0	0	0	109.4	D327 A329 Y331 L407	D327-V368 HydrophobicContact CB-CG1 3.72Å; D327-V368 WeakPolarHBondContact OD2-CG1 3.34Å; A329-V368 HydrophobicContact CB-CG2 4.2Å; Y331-V368 HydrophobicContact CE1-CG2 4.45Å; Y331-V368 WeakPolarHBondContact OH-CG2 3.43Å; V368-L407 HydrophobicContact CG2-CD2 4.47Å
369	Q	95.8	Very high	90.2	Very high	7 Å²	7	72 Å²	72	3%	0.033	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	120	175.1	-58.4	-176.4	42.2	0	0	109.8	D327 I328 R363 E365 T367 F371	D327-Q369 WeakPolarHBondContact CA-O 3.25Å; I328-Q369 HydrophobicContact CG2-CB 4.4Å; I328-Q369 PolarHBondContact N-O 2.98Å; I328-Q369 PolarHBondContact O-N 3.11Å; R363-Q369 PolarHBondContact O-NE2 3.39Å; E365-Q369 PolarHBondContact O-NE2 2.86Å; T367-Q369 PolarHBondContact O-N 3.48Å; Q369-F371 HydrophobicContact CB-CE2 3.73Å; Q369-F371 HydrophobicContact CB-CZ 3.9Å; Q369-F371 WeakPolarHBondContact O-CD2 3.23Å; Q369-F371 WeakPolarHBondContact O-CE2 3.45Å
370	S	95.9	Very high	89.5	Confident	59 Å²	59	75.3 Å²	75.3	41%	0.413	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	134.9	179.8	-60.1	0	0	0	0	112.7	Q325 D327	Q325-S370 PolarHBondContact NE2-OG 3.35Å; D327-S370 WeakPolarHBondContact OD1-CA 3.46Å; D327-S370 VanDerWaalsContact OD1-CB 3.22Å; D327-S370 WeakPolarHBondContact OD1-CB 3.35Å; D327-S370 PolarHBondContact OD1-OG 3.39Å
371	F	95.3	Very high	88.9	Confident	18 Å²	18	76 Å²	76	8%	0.079	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	88.4	178.8	-57.1	-87	0	0	0	109	Q325 F326 I328 F341 F360 Q369	Q325-F371 WeakPolarHBondContact CA-O 3.32Å; F326-F371 PolarHBondContact N-O 2.97Å; F326-F371 PolarHBondContact O-N 3.09Å; I328-F371 HydrophobicContact CB-CE2 4.42Å; I328-F371 HydrophobicContact CG2-CE2 3.71Å; I328-F371 HydrophobicContact CG2-CZ 4.43Å; F341-F371 HydrophobicContact CE1-CD2 4.45Å; F341-F371 HydrophobicContact CE1-CE1 4.3Å; F341-F371 AromaticContact CE1-CE2 4Å; F341-F371 HydrophobicContact CE1-CE2 4Å; F341-F371 AromaticContact CE1-CZ 3.92Å; F341-F371 HydrophobicContact CE1-CZ 3.92Å; F341-F371 HydrophobicContact CZ-CD1 4.49Å; F341-F371 AromaticContact CZ-CD2 3.84Å; F341-F371 HydrophobicContact CZ-CD2 3.84Å; F341-F371 HydrophobicContact CZ-CE1 4.46Å; F341-F371 AromaticContact CZ-CE2 3.81Å; F341-F371 HydrophobicContact CZ-CE2 3.81Å; F341-F371 HydrophobicContact CZ-CG 4.2Å; F341-F371 HydrophobicContact CZ-CZ 4.13Å; F360-F371 HydrophobicContact CB-CD1 4.03Å; F360-F371 HydrophobicContact CB-CE1 4.43Å; F360-F371 HydrophobicContact CB-CG 4.44Å; F360-F371 HydrophobicContact CD1-CB 3.81Å; F360-F371 HydrophobicContact CD1-CD1 4.11Å; F360-F371 HydrophobicContact CD1-CG 4.22Å; F360-F371 HydrophobicContact CE1-CB 4.25Å; F360-F371 HydrophobicContact CG-CD1 4.48Å; Q369-F371 HydrophobicContact CB-CE2 3.73Å; Q369-F371 HydrophobicContact CB-CZ 3.9Å; Q369-F371 WeakPolarHBondContact O-CD2 3.23Å; Q369-F371 WeakPolarHBondContact O-CE2 3.45Å
372	P	93.7	Very high	87.8	Confident	86 Å²	86	71.6 Å²	71.6	56%	0.558	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65	149.4	169.3	29.8	-34.5	0	0	0	109.9
373	L	89.9	Confident	87	Confident	19 Å²	19	80.4 Å²	80.4	10%	0.099	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-79.5	127.8	173.4	-77.1	160	0	0	0	110.5	V323 K324 F326 L357 F360 M377	V323-L373 HydrophobicContact CB-CD1 4.04Å; V323-L373 HydrophobicContact CG1-CD1 3.97Å; V323-L373 WeakPolarHBondContact O-CD1 3.38Å; K324-L373 PolarHBondContact O-N 2.94Å; F326-L373 HydrophobicContact CE2-CD1 4.12Å; F326-L373 HydrophobicContact CE2-CD2 4.3Å; F326-L373 HydrophobicContact CE2-CG 4.26Å; L357-L373 HydrophobicContact CD1-CD1 4.43Å; L357-L373 HydrophobicContact CD1-CD2 3.72Å; L357-L373 HydrophobicContact CD2-CD1 4.21Å; L357-L373 HydrophobicContact CD2-CD2 4Å; L357-L373 HydrophobicContact CG-CD2 3.78Å; F360-L373 HydrophobicContact CE1-CD2 4.41Å; F360-L373 HydrophobicContact CZ-CD2 3.86Å; L373-M377 HydrophobicContact CD2-CB 4.4Å
374	D	83.7	Confident	86.5	Confident	110 Å²	110	78 Å²	78	59%	0.588	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-53.1	141.4	173.3	-75.4	-35.3	0	0	0	110.9	Q376 M377 Y378	D374-Q376 PolarHBondContact O-N 3.27Å; D374-M377 HydrophobicContact CB-CE 3.79Å; D374-M377 HydrophobicContact CB-CG 4.47Å; D374-M377 WeakPolarHBondContact O-CA 2.89Å; D374-M377 PolarHBondContact O-N 3.45Å; D374-M377 WeakPolarHBondContact OD2-CE 3.38Å; D374-Y378 PolarHBondContact O-N 3.37Å
375	E	81.7	Confident	86.4	Confident	168 Å²	168	76.3 Å²	76.3	79%	0.785	39%	0.385	S	S	*	.	H	α-helix	trans	-50.4	-33.6	-178	-171.7	179.9	-156.2	0	0	113.2	A379	E375-A379 WeakPolarHBondContact O-CB 3.47Å; E375-A379 PolarHBondContact O-N 2.9Å
376	Q	76.8	Confident	86.5	Confident	172 Å²	172	72.9 Å²	72.9	80%	0.804	37%	0.369	S	S	*	.	H	α-helix	trans	-74.4	-36.9	176.3	-61.1	-176.1	15.7	0	0	113.6	D374 K380	D374-Q376 PolarHBondContact O-N 3.27Å; Q376-K380 WeakPolarHBondContact O-CB 3.37Å; Q376-K380 PolarHBondContact O-N 2.81Å
377	M	77.2	Confident	86.7	Confident	46 Å²	46	71.6 Å²	71.6	23%	0.227	37%	0.366	C	S	.	.	H	α-helix	trans	-72.8	-41.6	174.6	-67.5	-166.8	-76.8	0	0	110.2	L357 L373 D374 K380 Y381	L357-M377 VanDerWaalsContact O-SD 3.34Å; L373-M377 HydrophobicContact CD2-CB 4.4Å; D374-M377 HydrophobicContact CB-CE 3.79Å; D374-M377 HydrophobicContact CB-CG 4.47Å; D374-M377 WeakPolarHBondContact O-CA 2.89Å; D374-M377 PolarHBondContact O-N 3.45Å; D374-M377 WeakPolarHBondContact OD2-CE 3.38Å; M377-K380 PolarHBondContact O-N 2.83Å; M377-Y381 WeakPolarHBondContact O-CD2 3.46Å; M377-Y381 PolarHBondContact O-N 2.71Å; M377-Y381 VanDerWaalsContact O-N 3.11Å
378	Y	78.6	Confident	86.9	Confident	64 Å²	64	69.9 Å²	69.9	25%	0.251	35%	0.351	S	S	.	.	H	α-helix	trans	-58.4	-57	171.9	-172.3	-104.2	0	0	0	110.8	V323 K324 D374 K380 Y381 V382	V323-Y378 WeakPolarHBondContact O-CD2 3.48Å; K324-Y378 HydrophobicContact CB-CE2 4.49Å; K324-Y378 WeakPolarHBondContact CE-OH 3.39Å; K324-Y378 HydrophobicContact CG-CD2 4.37Å; K324-Y378 HydrophobicContact CG-CE2 3.52Å; D374-Y378 PolarHBondContact O-N 3.37Å; Y378-K380 PolarHBondContact O-N 2.84Å; Y378-Y381 CarbonylContact O-C 3.56Å; Y378-Y381 PolarHBondContact O-N 2.83Å; Y378-V382 HydrophobicContact CD1-CB 4.22Å; Y378-V382 HydrophobicContact CD1-CG2 4.36Å; Y378-V382 HydrophobicContact CE1-CB 3.97Å; Y378-V382 HydrophobicContact CE1-CG2 3.61Å; Y378-V382 HydrophobicContact CE2-CB 4.32Å; Y378-V382 HydrophobicContact CE2-CG2 4.11Å; Y378-V382 VanDerWaalsContact CZ-CG2 3.47Å; Y378-V382 WeakPolarHBondContact O-CA 3.42Å; Y378-V382 WeakPolarHBondContact O-CB 3.11Å; Y378-V382 WeakPolarHBondContact O-CG1 3.46Å; Y378-V382 PolarHBondContact O-N 3.11Å; Y378-V382 WeakPolarHBondContact OH-CG2 3.33Å
379	A	79.8	Confident	87	Confident	67 Å²	67	67.5 Å²	67.5	55%	0.554	34%	0.337	S	S	*	.	H	α-helix	trans	-58.8	-25.6	-179.9	0	0	0	0	0	114.4	E375	E375-A379 WeakPolarHBondContact O-CB 3.47Å; E375-A379 PolarHBondContact O-N 2.9Å
380	K	81.6	Confident	87.1	Confident	140 Å²	140	68.8 Å²	68.8	61%	0.609	34%	0.342	S	S	*	.	H	α-helix	trans	-75.9	-36.8	174.1	-174	-173.1	175.1	-161.8	0	113.1	Q376 M377 Y378	Q376-K380 WeakPolarHBondContact O-CB 3.37Å; Q376-K380 PolarHBondContact O-N 2.81Å; M377-K380 PolarHBondContact O-N 2.83Å; Y378-K380 PolarHBondContact O-N 2.84Å
381	Y	81.3	Confident	87.2	Confident	32 Å²	32	66 Å²	66	13%	0.125	32%	0.323	C	S	.	.	H	α-helix	trans	-113.3	-6	-171	-59	-56.6	0	0	0	114.7	I345 I355 K356 L357 M377 Y378 K383 M384	I345-Y381 HydrophobicContact CD1-CG 4.49Å; I355-Y381 HydrophobicContact CG2-CD1 4.27Å; I355-Y381 HydrophobicContact CG2-CE1 3.53Å; K356-Y381 PolarHBondContact O-OH 3.1Å; L357-Y381 HydrophobicContact CD1-CD2 3.29Å; L357-Y381 HydrophobicContact CD1-CE2 3.66Å; L357-Y381 HydrophobicContact CD1-CG 4.17Å; M377-Y381 WeakPolarHBondContact O-CD2 3.46Å; M377-Y381 PolarHBondContact O-N 2.71Å; M377-Y381 VanDerWaalsContact O-N 3.11Å; Y378-Y381 CarbonylContact O-C 3.56Å; Y378-Y381 PolarHBondContact O-N 2.83Å; Y381-K383 PolarHBondContact O-N 2.95Å; Y381-K383 VanDerWaalsContact O-N 3.16Å; Y381-M384 WeakPolarHBondContact O-CA 3.44Å; Y381-M384 WeakPolarHBondContact O-CB 3.35Å; Y381-M384 PolarHBondContact O-N 2.99Å
382	V	74.1	Confident	87.3	Confident	31 Å²	31	66.4 Å²	66.4	19%	0.188	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-30.6	179.2	62.6	0	0	0	0	112.6	Q322 Y378 M384	Q322-V382 WeakPolarHBondContact CG-O 3.37Å; Q322-V382 PolarHBondContact NE2-O 3.44Å; Q322-V382 VanDerWaalsContact OE1-CG2 3.25Å; Y378-V382 HydrophobicContact CD1-CB 4.22Å; Y378-V382 HydrophobicContact CD1-CG2 4.36Å; Y378-V382 HydrophobicContact CE1-CB 3.97Å; Y378-V382 HydrophobicContact CE1-CG2 3.61Å; Y378-V382 HydrophobicContact CE2-CB 4.32Å; Y378-V382 HydrophobicContact CE2-CG2 4.11Å; Y378-V382 VanDerWaalsContact CZ-CG2 3.47Å; Y378-V382 WeakPolarHBondContact O-CA 3.42Å; Y378-V382 WeakPolarHBondContact O-CB 3.11Å; Y378-V382 WeakPolarHBondContact O-CG1 3.46Å; Y378-V382 PolarHBondContact O-N 3.11Å; Y378-V382 WeakPolarHBondContact OH-CG2 3.33Å; V382-M384 PolarHBondContact O-N 3.18Å; V382-M384 VanDerWaalsContact O-N 3.17Å
383	K	77.4	Confident	87.4	Confident	194 Å²	194	63 Å²	63	84%	0.843	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	6.5	175	-58.1	-165.6	176.9	-165.9	0	114	Y381	Y381-K383 PolarHBondContact O-N 2.95Å; Y381-K383 VanDerWaalsContact O-N 3.16Å
384	M	86.4	Confident	87.7	Confident	68 Å²	68	66.4 Å²	66.4	34%	0.335	32%	0.32	S	S	.	.			trans	-119.4	103.2	178.3	-58.6	-166.7	69.1	0	0	109.8	I355 Y381 V382 I386	I355-M384 HydrophobicContact CD1-CE 3.58Å; I355-M384 HydrophobicContact CD1-SD 3.91Å; Y381-M384 WeakPolarHBondContact O-CA 3.44Å; Y381-M384 WeakPolarHBondContact O-CB 3.35Å; Y381-M384 PolarHBondContact O-N 2.99Å; V382-M384 PolarHBondContact O-N 3.18Å; V382-M384 VanDerWaalsContact O-N 3.17Å; M384-I386 HydrophobicContact CB-CG2 4.22Å; M384-I386 PolarHBondContact O-N 2.99Å
385	F	92.4	Very high	88.3	Confident	46 Å²	46	62.7 Å²	62.7	20%	0.202	30%	0.302	C	S	.	.			trans	-65	128.2	157.1	-71.2	-83.8	0	0	0	108.6	P320 I321 Q322 M415 E418	P320-F385 HydrophobicContact CB-CB 4.29Å; P320-F385 WeakPolarHBondContact O-CD1 3.42Å; I321-F385 WeakPolarHBondContact O-CA 3.43Å; Q322-F385 HydrophobicContact CG-CD1 3.95Å; Q322-F385 HydrophobicContact CG-CD2 4.41Å; Q322-F385 HydrophobicContact CG-CE1 3.58Å; Q322-F385 HydrophobicContact CG-CE2 4.08Å; Q322-F385 HydrophobicContact CG-CG 4.34Å; Q322-F385 HydrophobicContact CG-CZ 3.65Å; Q322-F385 VanDerWaalsContact NE2-CZ 3.27Å; F385-M415 HydrophobicContact CD1-CG 3.62Å; F385-M415 HydrophobicContact CD2-CG 3.88Å; F385-M415 HydrophobicContact CD2-SD 4.39Å; F385-M415 HydrophobicContact CE1-CB 4.14Å; F385-M415 HydrophobicContact CE1-CG 3.42Å; F385-M415 VanDerWaalsContact CE1-CG 3.42Å; F385-M415 VanDerWaalsContact CE1-N 3.33Å; F385-M415 HydrophobicContact CE2-CG 3.68Å; F385-M415 HydrophobicContact CG-CG 3.86Å; F385-M415 HydrophobicContact CG-SD 4.49Å; F385-M415 HydrophobicContact CZ-CB 4.17Å; F385-M415 HydrophobicContact CZ-CG 3.44Å; F385-M415 VanDerWaalsContact CZ-CG 3.44Å; F385-E418 VanDerWaalsContact CZ-OE2 3.26Å; F385-E418 WeakPolarHBondContact CZ-OE2 3.49Å
386	I	94.6	Very high	89	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	141.6	178.2	62.2	82.4	0	0	0	110.3	L317 P320 I321 V323 I345 M384 I389	L317-I386 HydrophobicContact CD1-CD1 4.1Å; P320-I386 WeakPolarHBondContact CA-O 3.4Å; I321-I386 PolarHBondContact N-O 2.92Å; I321-I386 PolarHBondContact O-N 2.8Å; V323-I386 HydrophobicContact CG2-CD1 3.61Å; V323-I386 HydrophobicContact CG2-CG1 3.93Å; I345-I386 HydrophobicContact CB-CB 4.3Å; I345-I386 HydrophobicContact CB-CD1 4.26Å; I345-I386 HydrophobicContact CB-CG1 4.01Å; I345-I386 HydrophobicContact CB-CG2 4.18Å; I345-I386 HydrophobicContact CD1-CG1 4.41Å; I345-I386 HydrophobicContact CD1-CG2 4.08Å; I345-I386 HydrophobicContact CG1-CG2 4.28Å; I345-I386 HydrophobicContact CG2-CD1 4.06Å; I345-I386 HydrophobicContact CG2-CG1 4.15Å; M384-I386 HydrophobicContact CB-CG2 4.22Å; M384-I386 PolarHBondContact O-N 2.99Å; I386-I389 HydrophobicContact CD1-CD1 3.97Å; I386-I389 HydrophobicContact CD1-CG1 3.64Å
387	K	95.9	Very high	89.8	Confident	55 Å²	55	52.6 Å²	52.6	24%	0.239	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-21.9	176.1	-154.2	-172.2	-175.1	-166.5	0	112.6	E316 L317 C318 P320 S346	E316-K387 HydrophobicContact CG-CD 4.06Å; E316-K387 HydrophobicContact CG-CG 4.22Å; E316-K387 WeakPolarHBondContact OE1-CE 3.36Å; E316-K387 IonicContact OE1-NZ 2.68Å; E316-K387 PolarHBondContact OE1-NZ 2.85Å; L317-K387 PolarHBondContact N-O 2.91Å; L317-K387 WeakPolarHBondContact O-CE 3.39Å; C318-K387 WeakPolarHBondContact O-CE 3.29Å; P320-K387 HydrophobicContact CB-CB 4.29Å; S346-K387 PolarHBondContact O-N 2.91Å
388	Y	97.6	Very high	90.6	Very high	35 Å²	35	53.2 Å²	53.2	14%	0.137	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128.8	-173	-52.8	-79.5	0	0	0	111.8	L282 I315 E316 I345 S346 D347 R348 Y349	L282-Y388 HydrophobicContact CD1-CD1 3.65Å; L282-Y388 HydrophobicContact CD1-CE1 3.66Å; I315-Y388 WeakPolarHBondContact O-CA 3.36Å; E316-Y388 HydrophobicContact CB-CD1 3.87Å; E316-Y388 HydrophobicContact CB-CE1 3.75Å; E316-Y388 HydrophobicContact CG-CD1 3.97Å; E316-Y388 HydrophobicContact CG-CE1 3.46Å; E316-Y388 VanDerWaalsContact CG-CE1 3.46Å; E316-Y388 WeakPolarHBondContact OE2-CE1 3.49Å; I345-Y388 CarbonylContact C-O 3.5Å; I345-Y388 WeakPolarHBondContact CA-O 3.48Å; S346-Y388 PolarHBondContact N-O 3.12Å; S346-Y388 PolarHBondContact O-N 2.89Å; D347-Y388 WeakPolarHBondContact O-CD2 3.23Å; D347-Y388 VanDerWaalsContact O-CE2 3.23Å; D347-Y388 WeakPolarHBondContact O-CE2 3.46Å; R348-Y388 VanDerWaalsContact C-CD2 3.48Å; Y349-Y388 HydrophobicContact CG-CD1 4.29Å; Y349-Y388 HydrophobicContact CG-CE1 4.47Å
389	I	97.5	Very high	91.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	128.7	177.4	-68	158.1	0	0	0	108.9	V314 I315 L317 F326 V343 S344 I345 I386 V391 V410	V314-I389 CarbonylContact C-O 3.54Å; V314-I389 WeakPolarHBondContact CA-O 3.5Å; I315-I389 PolarHBondContact N-O 3.34Å; I315-I389 PolarHBondContact O-N 2.8Å; L317-I389 HydrophobicContact CD1-CD1 3.77Å; L317-I389 HydrophobicContact CD2-CD1 3.99Å; L317-I389 HydrophobicContact CG-CD1 4.05Å; F326-I389 HydrophobicContact CE1-CD1 4.04Å; F326-I389 HydrophobicContact CE1-CG2 4.46Å; V343-I389 HydrophobicContact CG1-CG2 3.74Å; S344-I389 CarbonylContact O-C 3.59Å; S344-I389 WeakPolarHBondContact O-CA 3.19Å; I345-I389 HydrophobicContact CG2-CG1 4.16Å; I386-I389 HydrophobicContact CD1-CD1 3.97Å; I386-I389 HydrophobicContact CD1-CG1 3.64Å; I389-V391 HydrophobicContact CG2-CG2 4.03Å; I389-V410 HydrophobicContact CD1-CB 4.37Å; I389-V410 HydrophobicContact CD1-CG1 3.72Å; I389-V410 HydrophobicContact CD1-CG2 3.83Å
390	K	97.4	Very high	92	Very high	34 Å²	34	56.6 Å²	56.6	15%	0.148	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	131.2	166.4	-172.1	179.4	-166.7	-162.9	0	109.7	F313 V314 S344 W354 E392	F313-K390 WeakPolarHBondContact O-CA 3.47Å; V314-K390 HydrophobicContact CG2-CB 4.09Å; V314-K390 HydrophobicContact CG2-CD 4.32Å; V314-K390 HydrophobicContact CG2-CG 3.87Å; S344-K390 PolarHBondContact N-O 2.86Å; S344-K390 PolarHBondContact O-N 2.99Å; W354-K390 HydrophobicContact CD2-CB 4.03Å; W354-K390 HydrophobicContact CD2-CD 4.38Å; W354-K390 HydrophobicContact CE3-CB 3.73Å; W354-K390 HydrophobicContact CH2-CB 3.88Å; W354-K390 HydrophobicContact CZ2-CB 4.15Å; W354-K390 HydrophobicContact CZ3-CB 3.65Å; K390-E392 HydrophobicContact CD-CG 4.33Å; K390-E392 VanDerWaalsContact CE-OE1 3.3Å; K390-E392 WeakPolarHBondContact CE-OE1 2.96Å; K390-E392 HydrophobicContact CG-CG 4.38Å; K390-E392 IonicContact NZ-OE1 3.27Å; K390-E392 PolarHBondContact NZ-OE1 3.01Å
391	V	97.9	Very high	92.6	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	134.1	170.7	-172.1	0	0	0	0	108.7	W312 F313 F341 L342 I389 L393 I408	W312-V391 VanDerWaalsContact CA-O 3.25Å; W312-V391 WeakPolarHBondContact CA-O 3.34Å; W312-V391 WeakPolarHBondContact CB-O 3.35Å; F313-V391 HydrophobicContact CD2-CB 4.17Å; F313-V391 HydrophobicContact CD2-CG2 4.32Å; F313-V391 HydrophobicContact CE1-CB 4.04Å; F313-V391 HydrophobicContact CE1-CG1 4.19Å; F313-V391 HydrophobicContact CE2-CB 3.62Å; F313-V391 HydrophobicContact CE2-CG1 4.35Å; F313-V391 HydrophobicContact CE2-CG2 3.6Å; F313-V391 HydrophobicContact CZ-CB 3.55Å; F313-V391 HydrophobicContact CZ-CG1 3.8Å; F313-V391 HydrophobicContact CZ-CG2 3.91Å; F313-V391 PolarHBondContact N-O 3.38Å; F313-V391 PolarHBondContact O-N 2.57Å; F341-V391 HydrophobicContact CD2-CG1 4.2Å; L342-V391 WeakPolarHBondContact O-CA 3.13Å; I389-V391 HydrophobicContact CG2-CG2 4.03Å; V391-L393 HydrophobicContact CG1-CD1 3.95Å; V391-I408 HydrophobicContact CG2-CD1 3.89Å
392	E	97.4	Very high	93.3	Very high	26 Å²	26	60.6 Å²	60.6	12%	0.121	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	119.6	170.2	-49.7	-169.3	154.3	0	0	108.5	K310 W312 F341 L342 K390 L394	K310-E392 WeakPolarHBondContact CE-OE2 3.43Å; K310-E392 VanDerWaalsContact NZ-CD 3.26Å; K310-E392 IonicContact NZ-OE1 3.27Å; K310-E392 PolarHBondContact NZ-OE1 2.82Å; K310-E392 IonicContact NZ-OE2 2.7Å; K310-E392 PolarHBondContact NZ-OE2 2.91Å; W312-E392 HydrophobicContact CB-CB 4.3Å; W312-E392 HydrophobicContact CB-CG 3.98Å; F341-E392 CarbonylContact C-O 3.58Å; F341-E392 WeakPolarHBondContact CA-O 3.33Å; L342-E392 HydrophobicContact CB-CB 4.42Å; L342-E392 PolarHBondContact N-O 2.8Å; L342-E392 PolarHBondContact O-N 3.19Å; K390-E392 HydrophobicContact CD-CG 4.33Å; K390-E392 VanDerWaalsContact CE-OE1 3.3Å; K390-E392 WeakPolarHBondContact CE-OE1 2.96Å; K390-E392 HydrophobicContact CG-CG 4.38Å; K390-E392 IonicContact NZ-OE1 3.27Å; K390-E392 PolarHBondContact NZ-OE1 3.01Å; E392-L394 HydrophobicContact CB-CD2 4.38Å
393	L	96.5	Very high	94.3	Very high	15 Å²	15	59.3 Å²	59.3	8%	0.079	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	129.3	171.5	-82.3	58.5	0	0	0	107.6	I311 F313 P338 F341 V391	I311-L393 HydrophobicContact CB-CB 4.11Å; I311-L393 HydrophobicContact CD1-CD2 4.38Å; I311-L393 HydrophobicContact CG2-CB 4.3Å; I311-L393 HydrophobicContact CG2-CD1 4.43Å; I311-L393 HydrophobicContact CG2-CD2 4.05Å; I311-L393 HydrophobicContact CG2-CG 4.5Å; I311-L393 PolarHBondContact O-N 2.98Å; F313-L393 HydrophobicContact CE1-CD1 4.11Å; P338-L393 HydrophobicContact CB-CD2 3.84Å; P338-L393 HydrophobicContact CB-CG 4.24Å; F341-L393 HydrophobicContact CB-CD1 4.4Å; F341-L393 HydrophobicContact CB-CG 4.42Å; V391-L393 HydrophobicContact CG1-CD1 3.95Å
394	L	96.1	Very high	95.2	Very high	91 Å²	91	50.2 Å²	50.2	48%	0.476	26%	0.264	S	S	.	.			trans	-102.8	-30.7	-175.7	-50.9	179.8	0	0	0	111.9	D340 L342 T359 E392	D340-L394 HydrophobicContact CB-CB 4.33Å; D340-L394 WeakPolarHBondContact O-CA 3.47Å; D340-L394 WeakPolarHBondContact O-CB 3.43Å; D340-L394 PolarHBondContact O-N 2.96Å; L342-L394 HydrophobicContact CB-CD1 4.17Å; L342-L394 HydrophobicContact CB-CD2 4.22Å; L342-L394 HydrophobicContact CB-CG 4.33Å; T359-L394 HydrophobicContact CG2-CD1 3.79Å; E392-L394 HydrophobicContact CB-CD2 4.38Å
395	S	96.3	Very high	95.7	Very high	31 Å²	31	47 Å²	47	22%	0.217	25%	0.248	C	C	.	.			trans	-154.7	169.1	178.6	75.3	0	0	0	0	112	K339 D340	K339-S395 WeakPolarHBondContact CB-OG 3.48Å; K339-S395 WeakPolarHBondContact CG-OG 3.15Å; K339-S395 PolarHBondContact N-O 2.81Å; D340-S395 WeakPolarHBondContact CB-OG 3.08Å; D340-S395 PolarHBondContact N-OG 3.49Å; D340-S395 PolarHBondContact O-N 3.17Å; D340-S395 PolarHBondContact OD2-OG 2.81Å
396	H	95.8	Very high	95.9	Very high	72 Å²	72	44.8 Å²	44.8	33%	0.333	24%	0.239	S	C	.	.	B	Isolated β-bridge	trans	-136.5	162.6	179.1	48.1	-95.5	0	0	0	111.2	C307 T337 C403	C307-H396 PolarHBondContact O-CE1 3.46Å; T337-H396 CarbonylContact O-C 3.6Å; T337-H396 WeakPolarHBondContact O-CA 3.42Å; T337-H396 WeakPolarHBondContact O-CB 3.2Å; H396-C403 VanDerWaalsContact CB-SG 3.56Å; H396-C403 VanDerWaalsContact CG-SG 3.53Å
397	F	95.2	Very high	96	Very high	56 Å²	56	44.8 Å²	44.8	25%	0.246	24%	0.239	C	C	.	.	S	Bend	trans	-93.7	168	162.6	-56.8	-85.5	0	0	0	110.4	S336 T337 K339 G362 R363 D364	S336-F397 WeakPolarHBondContact CA-O 3.42Å; S336-F397 WeakPolarHBondContact CB-O 3.28Å; S336-F397 PolarHBondContact OG-O 3.02Å; T337-F397 PolarHBondContact O-N 2.84Å; T337-F397 WeakPolarHBondContact OG1-CB 3.45Å; T337-F397 WeakPolarHBondContact OG1-CD2 3.43Å; K339-F397 HydrophobicContact CB-CD2 3.62Å; K339-F397 HydrophobicContact CB-CE1 4.45Å; K339-F397 HydrophobicContact CB-CE2 3.51Å; K339-F397 HydrophobicContact CB-CG 4.16Å; K339-F397 HydrophobicContact CB-CZ 3.97Å; K339-F397 HydrophobicContact CD-CD1 3.93Å; K339-F397 HydrophobicContact CD-CD2 4.47Å; K339-F397 HydrophobicContact CD-CE1 3.66Å; K339-F397 HydrophobicContact CD-CE2 4.24Å; K339-F397 HydrophobicContact CD-CG 4.33Å; K339-F397 HydrophobicContact CD-CZ 3.83Å; K339-F397 HydrophobicContact CG-CD1 4.36Å; K339-F397 HydrophobicContact CG-CD2 4.1Å; K339-F397 HydrophobicContact CG-CE1 3.9Å; K339-F397 HydrophobicContact CG-CE2 3.61Å; K339-F397 HydrophobicContact CG-CG 4.46Å; K339-F397 HydrophobicContact CG-CZ 3.51Å; G362-F397 WeakPolarHBondContact O-CE2 3.49Å; G362-F397 WeakPolarHBondContact O-CZ 3.42Å; R363-F397 VanDerWaalsContact C-CE2 3.48Å; D364-F397 HydrophobicContact CB-CB 4.19Å; D364-F397 HydrophobicContact CB-CD1 4.2Å; D364-F397 HydrophobicContact CB-CD2 3.85Å; D364-F397 HydrophobicContact CB-CE2 4.19Å; D364-F397 HydrophobicContact CB-CG 3.85Å
398	G	93.2	Very high	96	Very high	59 Å²	59	42.4 Å²	42.4	61%	0.608	23%	0.229	S	C	*	.	S	Bend	trans	70.5	-170.5	-173.9	0	0	0	0	0	113
399	S	92.4	Very high	96	Very high	108 Å²	108	42.7 Å²	42.7	76%	0.755	23%	0.229	S	C	*	.			trans	-139.3	30.6	178.9	61.4	0	0	0	0	111.8	S336	S336-S399 PolarHBondContact OG-N 3.06Å
400	E	94.7	Very high	95.9	Very high	95 Å²	95	42.7 Å²	42.7	44%	0.444	23%	0.229	S	C	.	.			trans	-79.2	157.4	-177.9	-59.8	-56.6	154.4	0	0	111.2	C307 S336 F402	C307-E400 PolarHBondContact SG-O 3.3Å; C307-E400 VanDerWaalsContact SG-O 3.32Å; S336-E400 PolarHBondContact OG-N 3.41Å; S336-E400 VanDerWaalsContact OG-N 3.11Å; E400-F402 PolarHBondContact O-N 3.35Å
401	H	94.1	Very high	95.8	Very high	156 Å²	156	42 Å²	42	72%	0.722	23%	0.227	S	C	*	.	S	Bend	trans	-67.7	-24.7	-179.9	-66.1	-61.4	0	0	0	113.5	P306 C307	P306-H401 WeakPolarHBondContact CA-O 3.36Å; C307-H401 PolarHBondContact N-O 3.24Å
402	F	95.6	Very high	95.6	Very high	100 Å²	100	42.6 Å²	42.6	44%	0.439	23%	0.233	S	C	.	.	B	Isolated β-bridge	trans	-123.2	138.3	-173.7	-64.6	-72	0	0	0	113	L304 N305 P306 C307 S336 E400 P404	L304-F402 HydrophobicContact CD1-CB 3.66Å; L304-F402 HydrophobicContact CD1-CD1 3.89Å; L304-F402 HydrophobicContact CD1-CG 3.83Å; L304-F402 HydrophobicContact CD2-CD1 4.26Å; L304-F402 HydrophobicContact CD2-CE1 4.37Å; L304-F402 HydrophobicContact CG-CD1 3.93Å; L304-F402 HydrophobicContact CG-CE1 4.45Å; L304-F402 HydrophobicContact CG-CG 4.36Å; N305-F402 WeakPolarHBondContact O-CA 3.44Å; P306-F402 HydrophobicContact CG-CE1 4.37Å; C307-F402 PolarHBondContact SG-O 3.14Å; S336-F402 PolarHBondContact N-O 3.18Å; E400-F402 PolarHBondContact O-N 3.35Å; F402-P404 VanDerWaalsContact C-CD 3.47Å; F402-P404 VanDerWaalsContact O-CD 3.29Å; F402-P404 WeakPolarHBondContact O-CD 3.17Å
403	C	96.1	Very high	95.2	Very high	4 Å²	4	41.5 Å²	41.5	3%	0.027	23%	0.227	C	C	.	.			trans	-118	77.7	-179.9	-79.7	0	0	0	0	107.8	N305 C307 I311 H396	N305-C403 PolarHBondContact O-N 3.25Å; C307-C403 VanDerWaalsContact CA-SG 3.57Å; C307-C403 HydrophobicContact CB-CB 4.16Å; C307-C403 WeakPolarHBondContact CB-SG 3.27Å; C307-C403 VanDerWaalsContact SG-CA 3.5Å; C307-C403 WeakPolarHBondContact SG-CB 3.48Å; C307-C403 PolarHBondContact SG-N 2.99Å; C307-C403 CovalentContact SG-SG 2.04Å; C307-C403 PolarHBondContact SG-SG 3.24Å; I311-C403 HydrophobicContact CD1-CB 3.52Å; H396-C403 VanDerWaalsContact CB-SG 3.56Å; H396-C403 VanDerWaalsContact CG-SG 3.53Å
404	P	96	Very high	94.9	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.013	23%	0.226	C	C	.	.			trans	-74.4	158.9	178.7	32.1	-33.1	0	0	0	111.3	Y302 M303 L304 N330 E332 S335 F402	Y302-P404 HydrophobicContact CD2-CB 3.94Å; Y302-P404 HydrophobicContact CG-CB 4.21Å; M303-P404 CarbonylContact O-C 3.57Å; M303-P404 WeakPolarHBondContact O-CA 3.47Å; L304-P404 HydrophobicContact CD1-CB 4.19Å; N330-P404 PolarHBondContact ND2-O 2.99Å; E332-P404 HydrophobicContact CB-CG 3.88Å; E332-P404 HydrophobicContact CG-CG 4.17Å; S335-P404 VanDerWaalsContact CB-CG 3.45Å; S335-P404 VanDerWaalsContact OG-CG 3.28Å; S335-P404 WeakPolarHBondContact OG-CG 3.22Å; F402-P404 VanDerWaalsContact C-CD 3.47Å; F402-P404 VanDerWaalsContact O-CD 3.29Å; F402-P404 WeakPolarHBondContact O-CD 3.17Å
405	L	96.7	Very high	94.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-130.4	123.3	170.6	176.2	60.6	0	0	0	107.5	I294 Y302 M303 F313 I328 A329	I294-L405 HydrophobicContact CB-CD2 4.36Å; I294-L405 HydrophobicContact CB-CG 4.35Å; I294-L405 HydrophobicContact CD1-CD2 4.11Å; I294-L405 HydrophobicContact CG2-CB 4.07Å; I294-L405 HydrophobicContact CG2-CD2 3.97Å; I294-L405 HydrophobicContact CG2-CG 3.78Å; I294-L405 WeakPolarHBondContact CG2-O 3.17Å; Y302-L405 CarbonylContact C-O 3.58Å; Y302-L405 VanDerWaalsContact CA-O 3.25Å; Y302-L405 WeakPolarHBondContact CA-O 3.48Å; Y302-L405 VanDerWaalsContact CB-O 3.27Å; Y302-L405 WeakPolarHBondContact CB-O 3.3Å; M303-L405 HydrophobicContact CE-CB 4.05Å; M303-L405 HydrophobicContact CE-CD2 4.15Å; M303-L405 PolarHBondContact N-O 2.9Å; M303-L405 PolarHBondContact O-N 2.88Å; F313-L405 HydrophobicContact CE1-CD2 3.66Å; F313-L405 HydrophobicContact CE2-CD2 4.47Å; F313-L405 HydrophobicContact CZ-CD2 3.44Å; F313-L405 VanDerWaalsContact CZ-CD2 3.44Å; I328-L405 HydrophobicContact CD1-CD1 3.85Å; I328-L405 HydrophobicContact CG1-CD1 3.39Å; A329-L405 WeakPolarHBondContact O-CD1 3.42Å
406	S	96.3	Very high	93.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.242	C	C	.	.			trans	-90.3	-41.5	-177.9	-53.1	0	0	0	0	112.1	A329 Y331	A329-S406 WeakPolarHBondContact O-CB 3.44Å; A329-S406 PolarHBondContact O-N 3.47Å; Y331-S406 PolarHBondContact N-OG 3.4Å
407	L	96.5	Very high	93.1	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	142	-173	-176.7	62.6	0	0	0	111.9	E297 I328 A329 Y331 V368 R409	E297-L407 HydrophobicContact CB-CD1 4.44Å; E297-L407 HydrophobicContact CG-CD2 4.4Å; I328-L407 CarbonylContact C-O 3.6Å; I328-L407 WeakPolarHBondContact CA-O 3.28Å; A329-L407 HydrophobicContact CB-CB 4.03Å; A329-L407 PolarHBondContact N-O 2.98Å; A329-L407 PolarHBondContact O-N 3.05Å; Y331-L407 HydrophobicContact CE2-CB 4.45Å; V368-L407 HydrophobicContact CG2-CD2 4.47Å; L407-R409 HydrophobicContact CD1-CG 4.31Å; L407-R409 HydrophobicContact CD2-CG 4.21Å; L407-R409 HydrophobicContact CG-CG 4.17Å
408	I	97.3	Very high	92.4	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.026	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	135.1	159	-168.5	170.2	0	0	0	109.7	I294 L295 F313 I315 D327 V391	I294-I408 HydrophobicContact CB-CG2 4.16Å; I294-I408 HydrophobicContact CD1-CG2 3.91Å; I294-I408 HydrophobicContact CG1-CG2 3.81Å; I294-I408 PolarHBondContact O-N 3.49Å; L295-I408 HydrophobicContact CD2-CG2 3.98Å; F313-I408 HydrophobicContact CE2-CD1 4.08Å; F313-I408 HydrophobicContact CZ-CD1 4.32Å; I315-I408 HydrophobicContact CD1-CD1 4.03Å; I315-I408 HydrophobicContact CD1-CG2 3.75Å; D327-I408 WeakPolarHBondContact O-CA 3.4Å; D327-I408 WeakPolarHBondContact O-CG1 3.47Å; V391-I408 HydrophobicContact CG2-CD1 3.89Å
409	R	96.8	Very high	91.8	Very high	41 Å²	41	48.4 Å²	48.4	16%	0.155	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	149.9	169.1	-48.1	-168.4	-173.8	114.3	-8.8	110.9	N271 E297 F326 D327 L407 F411	N271-R409 HydrophobicContact CB-CB 4.43Å; N271-R409 VanDerWaalsContact OD1-CA 3.27Å; N271-R409 WeakPolarHBondContact OD1-CA 3.32Å; N271-R409 WeakPolarHBondContact OD1-CB 3.35Å; E297-R409 IonicContact OE1-CZ 3.85Å; E297-R409 IonicContact OE1-NE 2.81Å; E297-R409 IonicContact OE1-NH2 3.88Å; E297-R409 PolarHBondContact OE1-NH2 3.37Å; E297-R409 IonicContact OE2-CZ 2.98Å; E297-R409 VanDerWaalsContact OE2-CZ 3.27Å; E297-R409 IonicContact OE2-NE 3.24Å; E297-R409 PolarHBondContact OE2-NE 3.18Å; E297-R409 IonicContact OE2-NH2 2.77Å; E297-R409 PolarHBondContact OE2-NH2 2.99Å; F326-R409 WeakPolarHBondContact CA-O 3.2Å; D327-R409 HydrophobicContact CB-CB 3.94Å; D327-R409 HydrophobicContact CB-CG 4.15Å; D327-R409 PolarHBondContact N-O 2.94Å; D327-R409 PolarHBondContact O-N 3.42Å; D327-R409 IonicContact OD2-CZ 3.74Å; D327-R409 IonicContact OD2-NH1 2.72Å; D327-R409 PolarHBondContact OD2-NH1 3.5Å; L407-R409 HydrophobicContact CD1-CG 4.31Å; L407-R409 HydrophobicContact CD2-CG 4.21Å; L407-R409 HydrophobicContact CG-CG 4.17Å; R409-F411 HydrophobicContact CB-CE2 4.03Å; R409-F411 HydrophobicContact CB-CZ 3.95Å; R409-F411 HydrophobicContact CG-CZ 4.45Å
410	V	96.7	Very high	91.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	122.4	175.4	-174.6	0	0	0	0	108.8	N271 Y272 A273 L317 I321 V323 F326 I389	N271-V410 PolarHBondContact OD1-N 3.05Å; Y272-V410 PolarHBondContact N-O 2.83Å; A273-V410 HydrophobicContact CB-CB 3.99Å; A273-V410 HydrophobicContact CB-CG2 3.67Å; L317-V410 HydrophobicContact CD1-CG1 4.34Å; L317-V410 HydrophobicContact CD2-CB 3.99Å; L317-V410 HydrophobicContact CD2-CG1 4.22Å; L317-V410 HydrophobicContact CD2-CG2 4.1Å; I321-V410 HydrophobicContact CD1-CG1 3.83Å; V323-V410 HydrophobicContact CG1-CG1 3.87Å; V323-V410 HydrophobicContact CG2-CG1 4.24Å; F326-V410 HydrophobicContact CD1-CG1 4.4Å; F326-V410 HydrophobicContact CD1-CG2 4.03Å; F326-V410 HydrophobicContact CE1-CG1 4.18Å; F326-V410 HydrophobicContact CE1-CG2 4.25Å; I389-V410 HydrophobicContact CD1-CB 4.37Å; I389-V410 HydrophobicContact CD1-CG1 3.72Å; I389-V410 HydrophobicContact CD1-CG2 3.83Å
411	F	94.8	Very high	90.4	Very high	20 Å²	20	48.3 Å²	48.3	9%	0.088	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	140.8	178.4	-54.5	-68.2	0	0	0	110.4	R269 N270 N271 K324 Q325 D327 R409	R269-F411 HydrophobicContact CB-CB 4.3Å; R269-F411 HydrophobicContact CB-CD1 3.48Å; R269-F411 VanDerWaalsContact CB-CD1 3.48Å; R269-F411 HydrophobicContact CB-CE1 3.95Å; R269-F411 HydrophobicContact CB-CG 4.02Å; R269-F411 WeakPolarHBondContact O-CD1 3.17Å; R269-F411 WeakPolarHBondContact O-CE1 3.45Å; N270-F411 WeakPolarHBondContact O-CD1 3.02Å; N271-F411 HydrophobicContact CB-CE1 4.16Å; K324-F411 PolarHBondContact N-O 3.16Å; Q325-F411 HydrophobicContact CB-CB 4.33Å; Q325-F411 HydrophobicContact CB-CD2 4.24Å; Q325-F411 HydrophobicContact CG-CD2 4.04Å; Q325-F411 PolarHBondContact N-O 3.47Å; Q325-F411 PolarHBondContact O-N 3.25Å; D327-F411 WeakPolarHBondContact OD2-CE2 3.4Å; R409-F411 HydrophobicContact CB-CE2 4.03Å; R409-F411 HydrophobicContact CB-CZ 3.95Å; R409-F411 HydrophobicContact CG-CZ 4.45Å
412	G	92.4	Very high	89.7	Confident	12 Å²	12	44.4 Å²	44.4	12%	0.124	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	-158.6	-179.7	0	0	0	0	0	111.4	Q322	Q322-G412 CarbonylContact O-C 3.46Å; Q322-G412 WeakPolarHBondContact O-CA 3.17Å
413	T	89.6	Confident	88.7	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.012	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	133.7	161.3	11.3	0	0	0	0	108.4	I321 Q322 K324 E417	I321-T413 CarbonylContact C-O 3.58Å; I321-T413 VanDerWaalsContact CA-O 3.29Å; I321-T413 WeakPolarHBondContact CA-O 3.33Å; I321-T413 WeakPolarHBondContact CB-O 3.39Å; Q322-T413 PolarHBondContact N-O 2.98Å; Q322-T413 PolarHBondContact O-N 3.46Å; K324-T413 WeakPolarHBondContact CE-OG1 3.38Å; K324-T413 PolarHBondContact NZ-OG1 3.31Å; T413-E417 WeakPolarHBondContact CA-OE2 3.38Å; T413-E417 HydrophobicContact CG2-CB 3.98Å; T413-E417 HydrophobicContact CG2-CG 3.72Å; T413-E417 VanDerWaalsContact CG2-OE2 3.24Å; T413-E417 WeakPolarHBondContact CG2-OE2 3.46Å
414	S	91.6	Very high	87.6	Confident	8 Å²	8	46.3 Å²	46.3	6%	0.056	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	169.6	165.1	79.5	0	0	0	0	110.9	E319 V416 E417 E418	E319-S414 WeakPolarHBondContact OE2-CB 3.21Å; E319-S414 PolarHBondContact OE2-OG 3.25Å; S414-V416 VanDerWaalsContact C-N 3.26Å; S414-V416 PolarHBondContact O-N 2.96Å; S414-E417 PolarHBondContact O-N 3.45Å; S414-E418 PolarHBondContact O-N 3.15Å
415	M	84.6	Confident	86.5	Confident	96 Å²	96	49.4 Å²	49.4	47%	0.473	25%	0.253	S	S	.	.	H	α-helix	trans	-58.8	-40.2	-179.3	-70.7	-174.4	-64.1	0	0	111.6	P320 F385 E418 Y419	P320-M415 HydrophobicContact CG-CE 4.28Å; F385-M415 HydrophobicContact CD1-CG 3.62Å; F385-M415 HydrophobicContact CD2-CG 3.88Å; F385-M415 HydrophobicContact CD2-SD 4.39Å; F385-M415 HydrophobicContact CE1-CB 4.14Å; F385-M415 HydrophobicContact CE1-CG 3.42Å; F385-M415 VanDerWaalsContact CE1-CG 3.42Å; F385-M415 VanDerWaalsContact CE1-N 3.33Å; F385-M415 HydrophobicContact CE2-CG 3.68Å; F385-M415 HydrophobicContact CG-CG 3.86Å; F385-M415 HydrophobicContact CG-SD 4.49Å; F385-M415 HydrophobicContact CZ-CB 4.17Å; F385-M415 HydrophobicContact CZ-CG 3.44Å; F385-M415 VanDerWaalsContact CZ-CG 3.44Å; M415-E418 PolarHBondContact O-N 2.97Å; M415-Y419 WeakPolarHBondContact O-CD2 3.5Å; M415-Y419 PolarHBondContact O-N 2.66Å; M415-Y419 VanDerWaalsContact O-N 3.14Å
416	V	82.8	Confident	85.1	Confident	90 Å²	90	54.1 Å²	54.1	55%	0.545	28%	0.276	S	S	.	.	H	α-helix	trans	-63.4	-44.4	178.9	-176	0	0	0	0	110.5	S414 E418 Y419 E420	S414-V416 VanDerWaalsContact C-N 3.26Å; S414-V416 PolarHBondContact O-N 2.96Å; V416-E418 VanDerWaalsContact C-N 3.32Å; V416-E418 PolarHBondContact O-N 3.06Å; V416-Y419 PolarHBondContact O-N 2.66Å; V416-E420 WeakPolarHBondContact O-CG 3.37Å; V416-E420 PolarHBondContact O-N 3.42Å
417	E	82.4	Confident	83.4	Confident	32 Å²	32	62.3 Å²	62.3	15%	0.15	31%	0.307	C	S	.	.	H	α-helix	trans	-66.8	-30.8	178.7	-169.4	177.3	-146.7	0	0	112.6	K267 T413 S414 E420 E421	K267-E417 WeakPolarHBondContact CE-OE1 3.37Å; K267-E417 IonicContact NZ-OE1 3.95Å; K267-E417 PolarHBondContact NZ-OE1 3.23Å; T413-E417 WeakPolarHBondContact CA-OE2 3.38Å; T413-E417 HydrophobicContact CG2-CB 3.98Å; T413-E417 HydrophobicContact CG2-CG 3.72Å; T413-E417 VanDerWaalsContact CG2-OE2 3.24Å; T413-E417 WeakPolarHBondContact CG2-OE2 3.46Å; S414-E417 PolarHBondContact O-N 3.45Å; E417-E420 PolarHBondContact O-N 2.7Å; E417-E421 WeakPolarHBondContact O-CB 3.25Å; E417-E421 WeakPolarHBondContact O-CG 3.47Å; E417-E421 PolarHBondContact O-N 3.06Å
418	E	80.1	Confident	81.6	Confident	68 Å²	68	67.3 Å²	67.3	32%	0.318	33%	0.331	S	S	.	.	H	α-helix	trans	-67.2	-40.8	171.3	-176.4	170.1	-139.9	0	0	111.8	Q322 F385 S414 M415 V416 E421 I422	Q322-E418 PolarHBondContact NE2-OE1 2.89Å; Q322-E418 VanDerWaalsContact NE2-OE1 3.11Å; Q322-E418 PolarHBondContact NE2-OE2 2.98Å; F385-E418 VanDerWaalsContact CZ-OE2 3.26Å; F385-E418 WeakPolarHBondContact CZ-OE2 3.49Å; S414-E418 PolarHBondContact O-N 3.15Å; M415-E418 PolarHBondContact O-N 2.97Å; V416-E418 VanDerWaalsContact C-N 3.32Å; V416-E418 PolarHBondContact O-N 3.06Å; E418-E421 PolarHBondContact O-N 3.29Å; E418-I422 HydrophobicContact CG-CD1 3.92Å; E418-I422 WeakPolarHBondContact O-CB 3.41Å; E418-I422 WeakPolarHBondContact O-CD1 3.43Å; E418-I422 WeakPolarHBondContact O-CG1 3.42Å; E418-I422 PolarHBondContact O-N 3.32Å
419	Y	80.8	Confident	79.6	Confident	175 Å²	175	70.3 Å²	70.3	69%	0.686	35%	0.353	S	S	*	.	H	α-helix	trans	-64.6	-39.8	173.6	-75.7	-68.7	0	0	0	112.4	M415 V416 I422 A423	M415-Y419 WeakPolarHBondContact O-CD2 3.5Å; M415-Y419 PolarHBondContact O-N 2.66Å; M415-Y419 VanDerWaalsContact O-N 3.14Å; V416-Y419 PolarHBondContact O-N 2.66Å; Y419-I422 PolarHBondContact O-N 2.75Å; Y419-A423 WeakPolarHBondContact O-CB 3.24Å; Y419-A423 PolarHBondContact O-N 3Å
420	E	81.8	Confident	77.7	Confident	103 Å²	103	74.6 Å²	74.6	48%	0.481	37%	0.374	S	S	.	.	H	α-helix	trans	-62.7	-49.9	172.9	-71.5	177.4	179.1	0	0	111.8	V416 E417 I422 A423 D424	V416-E420 WeakPolarHBondContact O-CG 3.37Å; V416-E420 PolarHBondContact O-N 3.42Å; E417-E420 PolarHBondContact O-N 2.7Å; E420-I422 VanDerWaalsContact C-N 3.26Å; E420-I422 PolarHBondContact O-N 3.12Å; E420-A423 PolarHBondContact O-N 2.99Å; E420-D424 WeakPolarHBondContact O-CB 3.35Å; E420-D424 PolarHBondContact O-N 3.31Å
421	E	76.1	Confident	75.5	Confident	98 Å²	98	83 Å²	83	46%	0.458	41%	0.406	S	S	.	.	H	α-helix	trans	-59.6	-35.9	178.1	-77.6	-170.1	158.3	0	0	111.7	K324 E417 E418 S425	K324-E421 IonicContact NZ-OE2 2.68Å; E417-E421 WeakPolarHBondContact O-CB 3.25Å; E417-E421 WeakPolarHBondContact O-CG 3.47Å; E417-E421 PolarHBondContact O-N 3.06Å; E418-E421 PolarHBondContact O-N 3.29Å; E421-S425 VanDerWaalsContact O-CB 3.28Å; E421-S425 WeakPolarHBondContact O-CB 3.43Å; E421-S425 PolarHBondContact O-N 2.75Å; E421-S425 VanDerWaalsContact O-N 3.15Å; E421-S425 PolarHBondContact O-OG 2.8Å
422	I	78.7	Confident	73.3	Confident	75 Å²	75	88.5 Å²	88.5	39%	0.385	43%	0.432	S	S	.	.	H	α-helix	trans	-68.8	-50.3	175.1	-69.4	164.9	0	0	0	111.1	E418 Y419 E420 S425 Q426	E418-I422 HydrophobicContact CG-CD1 3.92Å; E418-I422 WeakPolarHBondContact O-CB 3.41Å; E418-I422 WeakPolarHBondContact O-CD1 3.43Å; E418-I422 WeakPolarHBondContact O-CG1 3.42Å; E418-I422 PolarHBondContact O-N 3.32Å; Y419-I422 PolarHBondContact O-N 2.75Å; E420-I422 VanDerWaalsContact C-N 3.26Å; E420-I422 PolarHBondContact O-N 3.12Å; I422-S425 PolarHBondContact O-N 3.02Å; I422-S425 VanDerWaalsContact O-N 3.15Å; I422-S425 PolarHBondContact O-OG 3.39Å; I422-Q426 PolarHBondContact O-N 2.86Å
423	A	73.9	Confident	71.3	Confident	41 Å²	41	95.4 Å²	95.4	34%	0.339	46%	0.461	S	S	.	.	H	α-helix	trans	-61.7	-46.6	-178.6	0	0	0	0	0	112.1	Y419 E420 S425 Q426 Y427	Y419-A423 WeakPolarHBondContact O-CB 3.24Å; Y419-A423 PolarHBondContact O-N 3Å; E420-A423 PolarHBondContact O-N 2.99Å; A423-S425 VanDerWaalsContact C-N 3.26Å; A423-S425 PolarHBondContact O-N 3.06Å; A423-Q426 PolarHBondContact O-N 3.41Å; A423-Y427 WeakPolarHBondContact O-CD2 3.25Å; A423-Y427 PolarHBondContact O-N 2.99Å
424	D	74.3	Confident	69.4	Low	102 Å²	102	102.2 Å²	102.2	55%	0.545	50%	0.496	S	S	.	.	H	α-helix	trans	-59.7	-36.9	174.6	-98.4	6	0	0	0	111.8	E420 Q428	E420-D424 WeakPolarHBondContact O-CB 3.35Å; E420-D424 PolarHBondContact O-N 3.31Å; D424-Q428 WeakPolarHBondContact O-CB 3.33Å; D424-Q428 VanDerWaalsContact O-CG 3.25Å; D424-Q428 WeakPolarHBondContact O-CG 3.47Å; D424-Q428 PolarHBondContact O-N 3.49Å
425	S	72.1	Confident	67.3	Low	67 Å²	67	109.1 Å²	109.1	47%	0.469	53%	0.526	S	S	.	.	H	α-helix	trans	-68.7	-36.5	178.6	77.7	0	0	0	0	112.7	E421 I422 A423 S429	E421-S425 VanDerWaalsContact O-CB 3.28Å; E421-S425 WeakPolarHBondContact O-CB 3.43Å; E421-S425 PolarHBondContact O-N 2.75Å; E421-S425 VanDerWaalsContact O-N 3.15Å; E421-S425 PolarHBondContact O-OG 2.8Å; I422-S425 PolarHBondContact O-N 3.02Å; I422-S425 VanDerWaalsContact O-N 3.15Å; I422-S425 PolarHBondContact O-OG 3.39Å; A423-S425 VanDerWaalsContact C-N 3.26Å; A423-S425 PolarHBondContact O-N 3.06Å; S425-S429 WeakPolarHBondContact O-CB 3.31Å; S425-S429 PolarHBondContact O-N 3.06Å
426	Q	67.6	Low	65.6	Low	100 Å²	100	111.5 Å²	111.5	47%	0.467	54%	0.541	S	S	.	.	H	α-helix	trans	-67.9	-50.1	175.9	-71.2	177.4	-24.4	0	0	110.5	I422 A423 Q428 S429 E430	I422-Q426 PolarHBondContact O-N 2.86Å; A423-Q426 PolarHBondContact O-N 3.41Å; Q426-Q428 VanDerWaalsContact C-N 3.28Å; Q426-Q428 PolarHBondContact O-N 3.37Å; Q426-S429 PolarHBondContact O-N 2.84Å; Q426-E430 PolarHBondContact O-N 3.38Å
427	Y	61.5	Low	64	Low	171 Å²	171	115.5 Å²	115.5	67%	0.671	55%	0.553	S	S	*	*	H	α-helix	trans	-60.9	-32	175.6	-86.6	-65.1	0	0	0	114	A423 R431	A423-Y427 WeakPolarHBondContact O-CD2 3.25Å; A423-Y427 PolarHBondContact O-N 2.99Å; Y427-R431 WeakPolarHBondContact O-CB 3.42Å; Y427-R431 PolarHBondContact O-N 2.82Å
428	Q	57.6	Low	62.4	Low	107 Å²	107	120.9 Å²	120.9	50%	0.5	58%	0.583	S	S	.	*	H	α-helix	trans	-73.3	-37.6	173.1	-75.9	172.1	36.9	0	0	112	D424 Q426 R431 Q432	D424-Q428 WeakPolarHBondContact O-CB 3.33Å; D424-Q428 VanDerWaalsContact O-CG 3.25Å; D424-Q428 WeakPolarHBondContact O-CG 3.47Å; D424-Q428 PolarHBondContact O-N 3.49Å; Q426-Q428 VanDerWaalsContact C-N 3.28Å; Q426-Q428 PolarHBondContact O-N 3.37Å; Q428-R431 PolarHBondContact O-N 2.85Å; Q428-Q432 PolarHBondContact O-N 3.48Å
429	S	55.9	Low	60.6	Low	69 Å²	69	128.2 Å²	128.2	48%	0.483	61%	0.609	S	S	.	*	H	α-helix	trans	-68	-46.1	178.5	-156	0	0	0	0	112.3	S425 Q426 R431 Q432	S425-S429 WeakPolarHBondContact O-CB 3.31Å; S425-S429 PolarHBondContact O-N 3.06Å; Q426-S429 PolarHBondContact O-N 2.84Å; S429-R431 PolarHBondContact O-N 2.87Å; S429-Q432 WeakPolarHBondContact O-CB 3.24Å; S429-Q432 PolarHBondContact O-N 2.71Å
430	E	56.1	Low	59.1	Low	130 Å²	130	127.9 Å²	127.9	61%	0.607	62%	0.619	S	S	*	*	H	α-helix	trans	-59.7	-35.6	175.8	-70.1	-178.1	165.4	0	0	112.3	Q426 Q432	Q426-E430 PolarHBondContact O-N 3.38Å; E430-Q432 VanDerWaalsContact C-N 3.26Å; E430-Q432 PolarHBondContact O-N 3.26Å
431	R	51.7	Low	57.1	Low	178 Å²	178	132.2 Å²	132.2	67%	0.672	63%	0.633	S	S	*	*	H	α-helix	trans	-71	-22.6	176.5	-160.9	-177.7	-165.5	89.2	8.6	112.9	Y427 Q428 S429 F435	Y427-R431 WeakPolarHBondContact O-CB 3.42Å; Y427-R431 PolarHBondContact O-N 2.82Å; Q428-R431 PolarHBondContact O-N 2.85Å; S429-R431 PolarHBondContact O-N 2.87Å; R431-F435 WeakPolarHBondContact O-CD2 3.31Å
432	Q	48.6	Very low	55.7	Low	134 Å²	134	132.8 Å²	132.8	63%	0.626	65%	0.645	S	S	*	*	H	α-helix	trans	-79.5	-34	-174.9	-146.6	69.9	55.3	0	0	111.9	Q428 S429 E430 L434	Q428-Q432 PolarHBondContact O-N 3.48Å; S429-Q432 WeakPolarHBondContact O-CB 3.24Å; S429-Q432 PolarHBondContact O-N 2.71Å; E430-Q432 VanDerWaalsContact C-N 3.26Å; E430-Q432 PolarHBondContact O-N 3.26Å; Q432-L434 VanDerWaalsContact C-N 3.29Å; Q432-L434 PolarHBondContact O-N 2.95Å
433	E	49.2	Very low	54.1	Low	158 Å²	158	137.4 Å²	137.4	74%	0.738	67%	0.669	S	S	*	*	H	α-helix	trans	-74.4	-16.4	-179.3	-62.6	-173.9	165.1	0	0	113.5	F435	E433-F435 VanDerWaalsContact C-N 3.3Å; E433-F435 PolarHBondContact O-N 3.46Å
434	L	49.6	Very low	52.1	Low	144 Å²	144	142.4 Å²	142.4	75%	0.754	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	8.1	-178.6	-91.7	164.8	0	0	0	115.6	Q432	Q432-L434 VanDerWaalsContact C-N 3.29Å; Q432-L434 PolarHBondContact O-N 2.95Å
435	F	47.6	Very low	50.3	Low	153 Å²	153	146.9 Å²	146.9	67%	0.671	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.4	-3.9	-173.5	-77.6	-75.6	0	0	0	116.3	R431 E433	R431-F435 WeakPolarHBondContact O-CD2 3.31Å; E433-F435 VanDerWaalsContact C-N 3.3Å; E433-F435 PolarHBondContact O-N 3.46Å
436	D	50.4	Low	48.4	Very low	147 Å²	147	149.2 Å²	149.2	79%	0.786	71%	0.708	S	S	*	*	S	Bend	trans	-107.7	1.7	-171.4	-85.3	-1.7	0	0	0	114.9
437	E	48.4	Very low	46.6	Very low	173 Å²	173	151 Å²	151	81%	0.808	73%	0.726	S	S	*	*	S	Bend	trans	-113	141.3	173.6	-68.9	-92.2	117.5	0	0	111.3
438	D	47.8	Very low	45.3	Very low	145 Å²	145	149.4 Å²	149.4	78%	0.775	73%	0.734	S	S	*	*			trans	53.6	101.5	176.6	-72.6	-22.8	0	0	0	119.2
439	Y	42.7	Very low	44.4	Very low	222 Å²	222	150.9 Å²	150.9	87%	0.871	74%	0.741	S	S	*	*				-175.8	117.9	101	-105.5	-70.9	0	0	0	112.2
440	D	49.9	Very low	43.5	Very low	168 Å²	168	155 Å²	155	90%	0.898	76%	0.757	S	S	*	*			trans	-116.2	96.6	169.4	-166.9	10.4	0	0	0	109.3
441	Y	40.3	Very low	43.2	Very low	195 Å²	195	156.7 Å²	156.7	77%	0.765	76%	0.763	S	S	*	*			trans	-148.1	141	179.1	-161.2	-93.9	0	0	0	112
442	P	46.9	Very low	43.2	Very low	109 Å²	109	152.5 Å²	152.5	71%	0.708	76%	0.761	S	S	*	*			trans	-72.5	151.9	-169.4	-20.2	34.5	0	0	0	115.8
443	L	45.1	Very low	43.5	Very low	172 Å²	172	151.6 Å²	151.6	90%	0.901	77%	0.769	S	S	*	*			trans	-83.4	127.9	178.1	-75.6	160.9	0	0	0	113.2
444	D	31.5	Very low	43.9	Very low	147 Å²	147	153.7 Å²	153.7	79%	0.786	78%	0.776	S	S	*	*			trans	-173.2	137.2	151.1	-107.9	5.3	0	0	0	107.3
445	Y	35.6	Very low	44.3	Very low	195 Å²	195	152.6 Å²	152.6	77%	0.765	77%	0.771	S	S	*	*			cis	-142.6	168.5	-1	-149.7	-96	0	0	0	110.3
446	N	31.9	Very low	44.8	Very low	117 Å²	117	152.2 Å²	152.2	63%	0.626	78%	0.775	S	S	*	*			trans	-52.4	151.6	-179.7	-55.3	-94.9	0	0	0	116
447	T	29.8	Very low	45.1	Very low	137 Å²	137	152.3 Å²	152.3	84%	0.84	78%	0.775	S	S	*	*				-179.5	153.2	113	27.4	0	0	0	0	115.9
448	V	34	Very low	45.7	Very low	137 Å²	137	146.1 Å²	146.1	83%	0.83	76%	0.757	S	S	*	*			trans	62.2	125.9	169.9	-164.8	0	0	0	0	118.5
449	E	40.1	Very low	46.5	Very low	139 Å²	139	143 Å²	143	65%	0.65	75%	0.747	S	S	*	*			trans	-86.9	145.9	164.7	-58	-168.6	140.5	0	0	111.5	K451	E449-K451 IonicContact OE1-NZ 2.7Å; E449-K451 PolarHBondContact OE1-NZ 3Å; E449-K451 IonicContact OE2-NZ 3.65Å; E449-K451 PolarHBondContact OE2-NZ 2.94Å
450	D	36.3	Very low	47.6	Very low	155 Å²	155	135 Å²	135	83%	0.829	73%	0.727	S	S	*	*			trans	-139.7	97.5	157.7	-134.2	-30.1	0	0	0	111.9	S452	D450-S452 PolarHBondContact O-N 3.03Å
451	K	49.6	Very low	48.7	Very low	165 Å²	165	130.8 Å²	130.8	72%	0.717	71%	0.707	S	S	*	*			trans	-91	70.1	-172.1	-64.6	-165.5	-178.9	96.3	0	112.6	E449	E449-K451 IonicContact OE1-NZ 2.7Å; E449-K451 PolarHBondContact OE1-NZ 3Å; E449-K451 IonicContact OE2-NZ 3.65Å; E449-K451 PolarHBondContact OE2-NZ 2.94Å
452	S	52	Low	49.7	Very low	90 Å²	90	126.6 Å²	126.6	63%	0.629	70%	0.698	S	S	*	*			trans	-146.1	75.3	-178.9	-163	0	0	0	0	116.4	D450	D450-S452 PolarHBondContact O-N 3.03Å
453	S	54.1	Low	50.8	Low	115 Å²	115	123.6 Å²	123.6	80%	0.804	68%	0.682	S	S	*	*			trans	-151.8	22.7	172	60	0	0	0	0	116.7
454	K	57.7	Low	52	Low	202 Å²	202	120.6 Å²	120.6	88%	0.878	67%	0.666	S	S	*	*	S	Bend	trans	-101	4.1	173.5	-71.8	-172.6	176.1	-179.6	0	115.3
455	N	58.1	Low	53.9	Low	122 Å²	122	118.6 Å²	118.6	65%	0.652	66%	0.655	S	S	*	*			trans	-97.4	-2.7	-170.3	-62.9	-26.4	0	0	0	115.1	G458 S459	N455-G458 PolarHBondContact O-N 2.87Å; N455-S459 PolarHBondContact O-N 2.89Å; N455-S459 VanDerWaalsContact O-N 3.09Å
456	L	59.8	Low	55.1	Low	145 Å²	145	114.4 Å²	114.4	76%	0.759	65%	0.646	S	S	*	*	H	α-helix	trans	-65.2	-46.2	-171	-166.2	67.3	0	0	0	113	G458 S459 A460	L456-G458 PolarHBondContact O-N 3.3Å; L456-S459 WeakPolarHBondContact O-CB 3.46Å; L456-S459 PolarHBondContact O-N 3.21Å; L456-A460 PolarHBondContact O-N 2.92Å; L456-A460 VanDerWaalsContact O-N 3.11Å
457	L	55.5	Low	56.6	Low	149 Å²	149	115.4 Å²	115.4	78%	0.78	65%	0.648	S	S	*	*	H	α-helix	trans	-65.3	-37.5	179.6	-74.8	153.7	0	0	0	112.8	T461	L457-T461 PolarHBondContact O-N 3.46Å; L457-T461 PolarHBondContact O-OG1 2.99Å
458	G	60.3	Low	58.4	Low	43 Å²	43	113.3 Å²	113.3	44%	0.443	64%	0.635	S	S	.	*	H	α-helix	trans	-68.1	-36.3	174.5	0	0	0	0	0	112.9	N455 L456 N462	N455-G458 PolarHBondContact O-N 2.87Å; L456-G458 PolarHBondContact O-N 3.3Å; G458-N462 PolarHBondContact O-N 2.89Å
459	S	65.9	Low	59.4	Low	79 Å²	79	111.5 Å²	111.5	55%	0.552	62%	0.621	S	S	*	*	H	α-helix	trans	-64.9	-47.1	176.3	-167	0	0	0	0	112	N455 L456 T461 N462 A463	N455-S459 PolarHBondContact O-N 2.89Å; N455-S459 VanDerWaalsContact O-N 3.09Å; L456-S459 WeakPolarHBondContact O-CB 3.46Å; L456-S459 PolarHBondContact O-N 3.21Å; S459-T461 PolarHBondContact O-N 2.78Å; S459-N462 PolarHBondContact O-N 3.05Å; S459-A463 PolarHBondContact O-N 3.09Å
460	A	65.2	Low	60.5	Low	54 Å²	54	109.7 Å²	109.7	45%	0.446	61%	0.614	S	S	.	*	H	α-helix	trans	-59.5	-43.9	178.3	0	0	0	0	0	112.6	L456 N462 A463 I464	L456-A460 PolarHBondContact O-N 2.92Å; L456-A460 VanDerWaalsContact O-N 3.11Å; A460-N462 PolarHBondContact O-N 2.95Å; A460-A463 WeakPolarHBondContact O-CB 3.42Å; A460-A463 PolarHBondContact O-N 3.37Å; A460-I464 WeakPolarHBondContact O-CG1 3.48Å; A460-I464 PolarHBondContact O-N 2.95Å; A460-I464 VanDerWaalsContact O-N 3.12Å
461	T	73.2	Confident	61.2	Low	80 Å²	80	104.7 Å²	104.7	49%	0.491	60%	0.595	S	S	.	*	H	α-helix	trans	-62.4	-42.6	179.2	-52.7	0	0	0	0	111.9	L457 S459 I464 L465	L457-T461 PolarHBondContact O-N 3.46Å; L457-T461 PolarHBondContact O-OG1 2.99Å; S459-T461 PolarHBondContact O-N 2.78Å; T461-I464 PolarHBondContact O-N 2.76Å; T461-L465 WeakPolarHBondContact O-CG 3.3Å; T461-L465 PolarHBondContact O-N 2.78Å; T461-L465 VanDerWaalsContact O-N 3.12Å
462	N	61.4	Low	61.4	Low	107 Å²	107	99.8 Å²	99.8	57%	0.572	59%	0.585	S	S	*	*	H	α-helix	trans	-68.3	-32.5	176.3	-80.2	-23.2	0	0	0	113.1	G458 S459 A460 N466	G458-N462 PolarHBondContact O-N 2.89Å; S459-N462 PolarHBondContact O-N 3.05Å; A460-N462 PolarHBondContact O-N 2.95Å; N462-N466 PolarHBondContact O-N 2.87Å; N462-N466 VanDerWaalsContact O-N 3.12Å
463	A	69.9	Low	61.4	Low	46 Å²	46	101.2 Å²	101.2	38%	0.38	59%	0.585	S	S	.	*	H	α-helix	trans	-64.7	-43.8	174.4	0	0	0	0	0	111.8	S459 A460 N466 M467	S459-A463 PolarHBondContact O-N 3.09Å; A460-A463 WeakPolarHBondContact O-CB 3.42Å; A460-A463 PolarHBondContact O-N 3.37Å; A463-N466 PolarHBondContact O-N 3.49Å; A463-M467 PolarHBondContact O-N 3.15Å; A463-M467 VanDerWaalsContact O-N 3.12Å
464	I	70	Confident	61.1	Low	109 Å²	109	102 Å²	102	56%	0.559	58%	0.579	S	S	*	*	H	α-helix	trans	-62.3	-47.7	177.1	-65.9	165	0	0	0	110.7	A460 T461 N466 M467 V468	A460-I464 WeakPolarHBondContact O-CG1 3.48Å; A460-I464 PolarHBondContact O-N 2.95Å; A460-I464 VanDerWaalsContact O-N 3.12Å; T461-I464 PolarHBondContact O-N 2.76Å; I464-N466 VanDerWaalsContact C-N 3.29Å; I464-N466 PolarHBondContact O-N 2.92Å; I464-M467 PolarHBondContact O-N 3Å; I464-M467 VanDerWaalsContact O-N 3.13Å; I464-V468 HydrophobicContact CG2-CG2 4.5Å; I464-V468 WeakPolarHBondContact O-CG2 3.09Å; I464-V468 PolarHBondContact O-N 3.05Å
465	L	71.2	Confident	60.7	Low	105 Å²	105	100 Å²	100	55%	0.55	58%	0.578	S	S	.	*	H	α-helix	trans	-58.9	-38.9	177.8	-74	170.9	0	0	0	112.5	T461 N469	T461-L465 WeakPolarHBondContact O-CG 3.3Å; T461-L465 PolarHBondContact O-N 2.78Å; T461-L465 VanDerWaalsContact O-N 3.12Å; L465-N469 WeakPolarHBondContact O-CB 3.29Å; L465-N469 PolarHBondContact O-N 3.39Å
466	N	61.3	Low	60.4	Low	107 Å²	107	97 Å²	97	57%	0.572	58%	0.575	S	S	*	*	H	α-helix	trans	-65.1	-42.3	174.7	-102.4	-22.3	0	0	0	112.6	N462 A463 I464 N469 I470	N462-N466 PolarHBondContact O-N 2.87Å; N462-N466 VanDerWaalsContact O-N 3.12Å; A463-N466 PolarHBondContact O-N 3.49Å; I464-N466 VanDerWaalsContact C-N 3.29Å; I464-N466 PolarHBondContact O-N 2.92Å; N466-N469 PolarHBondContact O-N 3.25Å; N466-I470 WeakPolarHBondContact O-CD1 3.46Å; N466-I470 VanDerWaalsContact O-CG1 3.28Å; N466-I470 WeakPolarHBondContact O-CG1 3.49Å; N466-I470 PolarHBondContact O-N 3.46Å
467	M	62.4	Low	59.2	Low	137 Å²	137	94.5 Å²	94.5	68%	0.675	58%	0.575	S	S	*	*	H	α-helix	trans	-64.1	-41.6	177.3	-66.4	-166.2	-153.6	0	0	112.3	A463 I464 N469 I470 A471	A463-M467 PolarHBondContact O-N 3.15Å; A463-M467 VanDerWaalsContact O-N 3.12Å; I464-M467 PolarHBondContact O-N 3Å; I464-M467 VanDerWaalsContact O-N 3.13Å; M467-N469 VanDerWaalsContact C-N 3.32Å; M467-N469 PolarHBondContact O-N 3.43Å; M467-I470 PolarHBondContact O-N 3.34Å; M467-A471 PolarHBondContact O-N 3.42Å
468	V	68.4	Low	58.3	Low	93 Å²	93	94.7 Å²	94.7	56%	0.564	57%	0.57	S	S	*	*	H	α-helix	trans	-61.5	-42.2	175.8	173.4	0	0	0	0	111	I464 I470 A471 A472	I464-V468 HydrophobicContact CG2-CG2 4.5Å; I464-V468 WeakPolarHBondContact O-CG2 3.09Å; I464-V468 PolarHBondContact O-N 3.05Å; V468-I470 VanDerWaalsContact C-N 3.35Å; V468-I470 PolarHBondContact O-N 2.94Å; V468-A471 PolarHBondContact O-N 2.76Å; V468-A472 WeakPolarHBondContact O-CB 3.08Å; V468-A472 PolarHBondContact O-N 2.91Å
469	N	54.7	Low	56.8	Low	100 Å²	100	99.4 Å²	99.4	54%	0.535	59%	0.59	S	S	.	*	H	α-helix	trans	-68	-33.8	178.3	-141.5	0.8	0	0	0	112.1	L465 N466 M467 N473	L465-N469 WeakPolarHBondContact O-CB 3.29Å; L465-N469 PolarHBondContact O-N 3.39Å; N466-N469 PolarHBondContact O-N 3.25Å; M467-N469 VanDerWaalsContact C-N 3.32Å; M467-N469 PolarHBondContact O-N 3.43Å; N469-N473 PolarHBondContact O-N 3.22Å; N469-N473 PolarHBondContact O-ND2 3Å
470	I	62.5	Low	55.2	Low	100 Å²	100	102.2 Å²	102.2	51%	0.513	59%	0.594	S	S	.	*	H	α-helix	trans	-67.2	-45.5	172.9	-70.1	163.2	0	0	0	110.8	N466 M467 V468 A472 N473 I474	N466-I470 WeakPolarHBondContact O-CD1 3.46Å; N466-I470 VanDerWaalsContact O-CG1 3.28Å; N466-I470 WeakPolarHBondContact O-CG1 3.49Å; N466-I470 PolarHBondContact O-N 3.46Å; M467-I470 PolarHBondContact O-N 3.34Å; V468-I470 VanDerWaalsContact C-N 3.35Å; V468-I470 PolarHBondContact O-N 2.94Å; I470-A472 PolarHBondContact O-N 3.4Å; I470-N473 PolarHBondContact O-N 3.34Å; I470-I474 HydrophobicContact CG2-CD1 3.82Å; I470-I474 WeakPolarHBondContact O-CG1 3.34Å; I470-I474 PolarHBondContact O-N 3.48Å; I470-I474 VanDerWaalsContact O-N 3.14Å
471	A	51.8	Low	53.5	Low	51 Å²	51	105.5 Å²	105.5	42%	0.421	61%	0.605	S	S	.	*	H	α-helix	trans	-61.1	-42.3	177.5	0	0	0	0	0	112.4	M467 V468 N473 I474 L475	M467-A471 PolarHBondContact O-N 3.42Å; V468-A471 PolarHBondContact O-N 2.76Å; A471-N473 VanDerWaalsContact C-N 3.31Å; A471-N473 PolarHBondContact O-N 2.89Å; A471-I474 PolarHBondContact O-N 2.99Å; A471-L475 PolarHBondContact O-N 2.88Å
472	A	53.2	Low	51.6	Low	61 Å²	61	108.4 Å²	108.4	50%	0.504	62%	0.616	S	S	.	*	H	α-helix	trans	-60.9	-37.4	176.2	0	0	0	0	0	112.9	V468 I470	V468-A472 WeakPolarHBondContact O-CB 3.08Å; V468-A472 PolarHBondContact O-N 2.91Å; I470-A472 PolarHBondContact O-N 3.4Å
473	N	52.7	Low	50	Low	120 Å²	120	108.7 Å²	108.7	64%	0.642	62%	0.622	S	S	*	*	H	α-helix	trans	-75.8	-24.1	177.9	-78.1	-69	0	0	0	113.6	N469 I470 A471	N469-N473 PolarHBondContact O-N 3.22Å; N469-N473 PolarHBondContact O-ND2 3Å; I470-N473 PolarHBondContact O-N 3.34Å; A471-N473 VanDerWaalsContact C-N 3.31Å; A471-N473 PolarHBondContact O-N 2.89Å
474	I	48.9	Very low	47.9	Very low	132 Å²	132	115.5 Å²	115.5	68%	0.677	65%	0.646	S	S	*	*	H	α-helix	trans	-77.5	-26.3	177.7	-71	168.6	0	0	0	112.1	I470 A471 G476	I470-I474 HydrophobicContact CG2-CD1 3.82Å; I470-I474 WeakPolarHBondContact O-CG1 3.34Å; I470-I474 PolarHBondContact O-N 3.48Å; I470-I474 VanDerWaalsContact O-N 3.14Å; A471-I474 PolarHBondContact O-N 2.99Å; I474-G476 VanDerWaalsContact C-N 3.29Å; I474-G476 PolarHBondContact O-N 3.11Å
475	L	49	Very low	45.8	Very low	161 Å²	161	113.6 Å²	113.6	84%	0.843	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	9.2	175.7	-69.7	163.8	0	0	0	113.5	A471	A471-L475 PolarHBondContact O-N 2.88Å
476	G	50.8	Low	43.9	Very low	58 Å²	58	115.7 Å²	115.7	60%	0.598	67%	0.665	S	S	*	*			trans	-113.8	5.1	-158.5	0	0	0	0	0	119.4	I474	I474-G476 VanDerWaalsContact C-N 3.29Å; I474-G476 PolarHBondContact O-N 3.11Å
477	A	35.7	Very low	42.4	Very low	92 Å²	92	120 Å²	120	76%	0.76	68%	0.679	S	S	*	*			trans	-152.9	111.2	173.9	0	0	0	0	0	110.7
478	K	34.8	Very low	40.8	Very low	154 Å²	154	117.4 Å²	117.4	67%	0.67	67%	0.674	S	S	*	*				86.6	114.6	55.6	-167.6	-158.6	-169.9	-153.9	0	113.2	E480	K478-E480 WeakPolarHBondContact CE-OE1 3.3Å; K478-E480 WeakPolarHBondContact CE-OE2 3.39Å; K478-E480 IonicContact NZ-OE1 2.68Å; K478-E480 PolarHBondContact NZ-OE1 2.04Å; K478-E480 IonicContact NZ-OE2 2.66Å; K478-E480 PolarHBondContact NZ-OE2 3.45Å
479	T	30.8	Very low	38.9	Very low	142 Å²	142	119.9 Å²	119.9	87%	0.871	68%	0.683	S	S	*	*			trans	-125	139.7	156.7	35.9	0	0	0	0	110.1
480	E	31.4	Very low	37.6	Very low	137 Å²	137	119.3 Å²	119.3	64%	0.64	69%	0.687	S	S	*	*			trans	-99.2	179	162.9	-66.6	159.8	137.9	0	0	106.3	K478	K478-E480 WeakPolarHBondContact CE-OE1 3.3Å; K478-E480 WeakPolarHBondContact CE-OE2 3.39Å; K478-E480 IonicContact NZ-OE1 2.68Å; K478-E480 PolarHBondContact NZ-OE1 2.04Å; K478-E480 IonicContact NZ-OE2 2.66Å; K478-E480 PolarHBondContact NZ-OE2 3.45Å
481	D	30.3	Very low	35.9	Very low	124 Å²	124	123 Å²	123	66%	0.663	70%	0.702	S	S	*	*			cis	-169.5	162.6	22.6	-148.9	-11.1	0	0	0	110.9
482	L	31.4	Very low	34.6	Very low	140 Å²	140	128 Å²	128	73%	0.733	72%	0.722	S	S	*	*			trans	60.1	156.1	159.3	-49.5	179.3	0	0	0	119.9
483	T	28.5	Very low	33.3	Very low	113 Å²	113	130 Å²	130	69%	0.693	74%	0.738	S	S	*	*			cis	-163.4	165.7	-19.2	21.2	0	0	0	0	110
484	E	26	Very low	32	Very low	189 Å²	189	131.2 Å²	131.2	88%	0.883	75%	0.75	S	S	*	*			trans	71	126.1	161.3	-140.5	145.8	-144.2	0	0	114
485	G	26	Very low	31.1	Very low	69 Å²	69	129 Å²	129	71%	0.711	75%	0.751	S	S	*	*				105	134.2	51.7	0	0	0	0	0	107.8
486	N	30.8	Very low	29.9	Very low	150 Å²	150	127 Å²	127	80%	0.802	75%	0.746	S	S	*	*			cis	-163.9	171.6	3.5	50.1	36.7	0	0	0	109.6
487	K	30.8	Very low	28.8	Very low	196 Å²	196	130.3 Å²	130.3	85%	0.852	76%	0.755	S	S	*	*			trans	34.3	148	155.8	-94.7	-173.2	175.6	-175.6	0	121.5
488	S	29.2	Very low	28.2	Very low	83 Å²	83	134.6 Å²	134.6	58%	0.58	76%	0.759	S	S	*	*			cis	178.6	168	23	38.7	0	0	0	0	112.1
489	I	28.3	Very low	28.7	Very low	145 Å²	145	132.4 Å²	132.4	74%	0.744	76%	0.76	S	S	*	*			trans	69.4	117.9	148.3	-75.5	158.8	0	0	0	114.9
490	S	25.8	Very low	28.3	Very low	89 Å²	89	135.6 Å²	135.6	62%	0.622	76%	0.762	S	S	*	*				63.2	146.9	59.4	81.2	0	0	0	0	112.8
491	E	27.4	Very low	28	Very low	177 Å²	177	136.4 Å²	136.4	83%	0.827	77%	0.768	S	S	*	*			cis	-158.2	-178.1	17.5	-152.7	159.6	-165.7	0	0	110.6
492	N	25.5	Very low	28.7	Very low	157 Å²	157	134.9 Å²	134.9	84%	0.84	76%	0.764	S	S	*	*			trans	-69.1	155.7	-177.2	-58.4	-40.7	0	0	0	114.4
493	A	25	Very low	28.3	Very low	103 Å²	103	136.4 Å²	136.4	85%	0.851	77%	0.768	S	S	*	*			trans	-149.4	141	146.5	0	0	0	0	0	111.6
494	T	26	Very low	28.3	Very low	144 Å²	144	136.1 Å²	136.1	88%	0.883	77%	0.77	S	S	*	*			trans	-133	139.3	175.7	-58.7	0	0	0	0	108.5
495	A	29.1	Very low	28.1	Very low	85 Å²	85	134.1 Å²	134.1	70%	0.702	77%	0.772	S	S	*	*			trans	174.7	161.9	145	0	0	0	0	0	114.1
496	T	23.4	Very low	28.1	Very low	121 Å²	121	133.8 Å²	133.8	74%	0.742	77%	0.768	S	S	*	*			trans	79.4	104.3	155.3	-32.1	0	0	0	0	115.8
497	T	28.2	Very low	27.8	Very low	126 Å²	126	133.3 Å²	133.3	77%	0.773	77%	0.77	S	S	*	*				69.9	152	56	74.3	0	0	0	0	114.7
498	E	24.6	Very low	27.6	Very low	183 Å²	183	129.4 Å²	129.4	86%	0.855	77%	0.767	S	S	*	*			cis	-146.5	-178	14.6	-108.9	-149.3	127	0	0	112.2
499	P	45.1	Very low	27.5	Very low	107 Å²	107	132 Å²	132	70%	0.695	78%	0.78	S	S	*	*			trans	-127.4	-175.4	-160.3	45.3	-33.5	0	0	0	118
500	K	22.5	Very low	27.8	Very low	209 Å²	209	131 Å²	131	91%	0.909	78%	0.782	S	S	*	*			trans	-163.5	163.3	146.4	-122.5	173.6	-177.8	175.1	0	116.7
501	M	24.3	Very low	27.9	Very low	155 Å²	155	133.4 Å²	133.4	76%	0.764	79%	0.793	S	S	*	*			trans	-132.2	173.2	176.5	-103.8	-98.3	92.9	0	0	108.3
502	P	44.3	Very low	28.4	Very low	91 Å²	91	130.5 Å²	130.5	59%	0.591	79%	0.79	S	S	*	*			cis	-124.8	-155.6	31.8	37.4	-15	0	0	0	112.9
503	E	23.5	Very low	28.3	Very low	173 Å²	173	128.4 Å²	128.4	81%	0.808	79%	0.787	S	S	*	*			cis	-155.4	-155.9	12.5	-152.6	138.7	84.8	0	0	113
504	S	28	Very low	29.4	Very low	106 Å²	106	128.4 Å²	128.4	74%	0.741	78%	0.779	S	S	*	*			trans	-145.3	156.4	-163.8	69.1	0	0	0	0	118.7
505	T	22.5	Very low	29.4	Very low	148 Å²	148	129.8 Å²	129.8	91%	0.908	78%	0.775	S	S	*	*			trans	-178.9	149.1	153.7	-78.7	0	0	0	0	109.6
506	G	26.8	Very low	29.3	Very low	61 Å²	61	135 Å²	135	63%	0.629	78%	0.778	S	S	*	*			cis	161.4	109.4	-13.5	0	0	0	0	0	116.1
507	V	24.1	Very low	29.3	Very low	141 Å²	141	136.1 Å²	136.1	86%	0.855	78%	0.778	S	S	*	*			trans	61.2	122.2	153.3	-167.8	0	0	0	0	121.9
508	S	25.3	Very low	29.1	Very low	114 Å²	114	136.5 Å²	136.5	80%	0.797	77%	0.774	S	S	*	*				171.2	159	127.7	-77	0	0	0	0	114.8
509	T	27	Very low	29.2	Very low	136 Å²	136	135.7 Å²	135.7	83%	0.834	77%	0.767	S	S	*	*			trans	-128.8	159.4	172.8	54.6	0	0	0	0	109.5
510	P	36.4	Very low	28.4	Very low	124 Å²	124	137.1 Å²	137.1	81%	0.805	77%	0.765	S	S	*	*				-148.6	-165.2	75.7	38.5	-15.8	0	0	0	114.5
511	V	26.7	Very low	28.5	Very low	140 Å²	140	133 Å²	133	85%	0.848	76%	0.757	S	S	*	*			trans	-140.6	137.6	-170.6	177.1	0	0	0	0	113.9
512	P	38.2	Very low	28.5	Very low	116 Å²	116	133 Å²	133	75%	0.753	76%	0.755	S	S	*	*			trans	-128	-164.6	166.8	41.4	-27.5	0	0	0	114.8
513	S	23.9	Very low	27.6	Very low	113 Å²	113	132.7 Å²	132.7	79%	0.79	75%	0.751	S	S	*	*			trans	-147.1	-164.8	169.1	-37.6	0	0	0	0	107.4
514	P	47.6	Very low	27.8	Very low	103 Å²	103	133 Å²	133	67%	0.669	75%	0.752	S	S	*	*			cis	-133.2	-150.5	-28.2	33.8	-10.3	0	0	0	111.8
515	E	26.1	Very low	27.5	Very low	174 Å²	174	133.9 Å²	133.9	81%	0.813	75%	0.749	S	S	*	*			trans	70.7	167.7	153.9	-75.9	177.4	-176.3	0	0	120.9
516	Y	27.2	Very low	27.8	Very low	195 Å²	195	133.8 Å²	133.8	77%	0.765	75%	0.748	S	S	*	*			cis	-170.3	178.2	-47.1	-135	-91.6	0	0	0	108.8
517	I	23.2	Very low	27.6	Very low	143 Å²	143	138.9 Å²	138.9	73%	0.733	76%	0.755	S	S	*	*			trans	71.7	126.9	165.3	-62.5	158.6	0	0	0	115.4
518	I	24.8	Very low	28.3	Very low	134 Å²	134	137 Å²	137	69%	0.687	75%	0.746	S	S	*	*			cis	91.6	141.4	29.6	-48.2	158.8	0	0	0	114.5
519	K	26.1	Very low	29.1	Very low	166 Å²	166	136.4 Å²	136.4	72%	0.722	74%	0.74	S	S	*	*			trans	89.6	144.9	171.1	-60.5	-168.3	171.8	-109.5	0	117.3
520	E	27.1	Very low	29	Very low	138 Å²	138	135.8 Å²	135.8	65%	0.645	74%	0.736	S	S	*	*			cis	-168.1	172.1	-10.1	-121.8	168.9	-144.1	0	0	112.5
521	V	25.1	Very low	28.7	Very low	121 Å²	121	134.4 Å²	134.4	73%	0.733	73%	0.729	S	S	*	*			trans	72	144.7	147.6	158.2	0	0	0	0	117.7
522	H	24.7	Very low	28.8	Very low	157 Å²	157	135.3 Å²	135.3	73%	0.727	73%	0.729	S	S	*	*			cis	-145.2	168.7	7.2	-152.4	56.4	0	0	0	115.3
523	T	25.1	Very low	29	Very low	83 Å²	83	135.3 Å²	135.3	51%	0.509	73%	0.729	S	S	.	*			trans	-55.8	153.9	172.3	-17.3	0	0	0	0	117.8
524	H	27.4	Very low	29.7	Very low	180 Å²	180	135.3 Å²	135.3	83%	0.833	73%	0.727	S	S	*	*				-165.7	143.6	119.3	-134.2	-73.3	0	0	0	114.9
525	D	22.8	Very low	28.8	Very low	124 Å²	124	140.6 Å²	140.6	66%	0.663	74%	0.739	S	S	*	*			trans	-99.6	164.8	-176.9	-46	-94.9	0	0	0	114.9
526	T	27.3	Very low	29.1	Very low	147 Å²	147	141 Å²	141	90%	0.902	74%	0.741	S	S	*	*			trans	-172.1	143.4	133.1	-71.8	0	0	0	0	112.2
527	E	23	Very low	29.5	Very low	167 Å²	167	136.4 Å²	136.4	78%	0.78	74%	0.737	S	S	*	*			trans	-89.6	-165.6	-175.3	-125.1	-165.9	110.7	0	0	113.4
528	P	39.4	Very low	30.5	Very low	101 Å²	101	135.3 Å²	135.3	66%	0.656	74%	0.739	S	S	*	*			cis	-137.3	-157.7	-11.3	37.2	-14.3	0	0	0	113.7
529	P	41.7	Very low	30.7	Very low	102 Å²	102	135.1 Å²	135.1	66%	0.662	74%	0.738	S	S	*	*				-132.9	177.3	-50.9	31.8	-12.6	0	0	0	116.4
530	T	26.1	Very low	30.8	Very low	123 Å²	123	134.4 Å²	134.4	76%	0.755	75%	0.748	S	S	*	*			trans	108.5	120.5	141.7	-18.8	0	0	0	0	121.7
531	S	30.2	Very low	30.9	Very low	95 Å²	95	135.7 Å²	135.7	66%	0.664	75%	0.754	S	S	*	*			trans	61.4	97	149.3	61.8	0	0	0	0	123.2
532	D	28.9	Very low	31.2	Very low	160 Å²	160	137.6 Å²	137.6	86%	0.856	76%	0.759	S	S	*	*				68.8	153	113.8	-64.5	-3.7	0	0	0	123.8
533	P	42.2	Very low	31.5	Very low	115 Å²	115	136 Å²	136	75%	0.747	76%	0.76	S	S	*	*			trans	-130	-157.5	-146.2	47.1	-31.3	0	0	0	113.3
534	P	38.2	Very low	31.8	Very low	114 Å²	114	140.1 Å²	140.1	74%	0.74	77%	0.773	S	S	*	*			cis	-118.3	149.6	-29.6	33.8	-20.8	0	0	0	112.4
535	K	29.3	Very low	31.9	Very low	214 Å²	214	140 Å²	140	93%	0.93	77%	0.773	S	S	*	*			trans	-146.6	147.1	165.9	-71.2	-164.7	177.2	-178.8	0	113.9
536	E	30.5	Very low	32.3	Very low	183 Å²	183	142.7 Å²	142.7	86%	0.855	78%	0.782	S	S	*	*			trans	-96.5	-179.9	177.8	-55.9	169.9	118.1	0	0	112.1
537	S	36.7	Very low	32.7	Very low	98 Å²	98	145 Å²	145	69%	0.685	78%	0.783	S	S	*	*			trans	71.2	159.1	179.7	84.4	0	0	0	0	114.4
538	P	44	Very low	33	Very low	119 Å²	119	146.5 Å²	146.5	77%	0.773	79%	0.789	S	S	*	*			cis	-97.2	153.5	33.3	0	22.5	0	0	0	113.3
539	I	28.7	Very low	32.7	Very low	130 Å²	130	150.8 Å²	150.8	67%	0.667	80%	0.801	S	S	*	*				68.5	108.5	53.4	-55.8	160.6	0	0	0	113	Q541	I539-Q541 HydrophobicContact CG2-CB 4.28Å
540	V	28.3	Very low	32	Very low	152 Å²	152	150.9 Å²	150.9	92%	0.921	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-98.2	118.9	151.6	175.9	0	0	0	0	106.6
541	Q	30.1	Very low	32.4	Very low	164 Å²	164	150.5 Å²	150.5	77%	0.766	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-88.8	146.8	-175	-168.3	172.2	-60.5	0	0	111.3	I539 V543	I539-Q541 HydrophobicContact CG2-CB 4.28Å; Q541-V543 PolarHBondContact O-N 3.17Å
542	L	30.9	Very low	33.2	Very low	162 Å²	162	151.9 Å²	151.9	85%	0.848	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-58.9	132.3	168.5	-73	141.8	0	0	0	110.3
543	V	30.4	Very low	33.2	Very low	123 Å²	123	149.1 Å²	149.1	75%	0.745	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-95.3	125.2	157.7	175.9	0	0	0	0	107.4	Q541 E545	Q541-V543 PolarHBondContact O-N 3.17Å; V543-E545 HydrophobicContact CG1-CG 3.98Å
544	Q	31.9	Very low	32.7	Very low	169 Å²	169	149.6 Å²	149.6	79%	0.79	81%	0.813	S	S	*	*			trans	-117	119.6	173.4	173	-179.5	-16.3	0	0	105.3
545	E	29.8	Very low	32.4	Very low	179 Å²	179	149.8 Å²	149.8	84%	0.836	81%	0.812	S	S	*	*			trans	-118.8	150.2	172.7	-74	-176	152	0	0	109.2	V543	V543-E545 HydrophobicContact CG1-CG 3.98Å
546	E	31.1	Very low	32.7	Very low	179 Å²	179	145.2 Å²	145.2	84%	0.836	80%	0.802	S	S	*	*			trans	-110	172.2	-157	-61	177.2	112.5	0	0	112.5
547	E	35.8	Very low	32.9	Very low	197 Å²	197	144.5 Å²	144.5	92%	0.921	80%	0.803	S	S	*	*			trans	-80.2	131.2	174.9	-62.1	176.6	107.7	0	0	111.6
548	E	29	Very low	33.2	Very low	197 Å²	197	148.1 Å²	148.1	92%	0.921	81%	0.814	S	S	*	*			trans	-155.6	147.6	144.9	-142.4	176	-168.2	0	0	112.6
549	E	32.1	Very low	32.8	Very low	192 Å²	192	146.1 Å²	146.1	90%	0.897	82%	0.815	S	S	*	*			trans	-98.7	137.1	171.3	-75.8	-163.6	131.6	0	0	111.7
550	A	28.4	Very low	33.4	Very low	103 Å²	103	146.3 Å²	146.3	85%	0.851	83%	0.828	S	S	*	*			trans	-169.6	135.3	138.5	0	0	0	0	0	112.5
551	S	33.7	Very low	33.8	Very low	116 Å²	116	142.6 Å²	142.6	81%	0.811	82%	0.82	S	S	*	*			trans	-93	168.4	171.2	-35.1	0	0	0	0	111.1
552	P	47.3	Very low	34.7	Very low	123 Å²	123	144.4 Å²	144.4	80%	0.799	83%	0.829	S	S	*	*				-157.8	171	73.1	42.1	-21.5	0	0	0	119.7
553	S	28.8	Very low	35.5	Very low	102 Å²	102	145.8 Å²	145.8	71%	0.713	83%	0.831	S	S	*	*			trans	90	110.3	140.9	-164.4	0	0	0	0	121.2
554	T	32.2	Very low	36.2	Very low	126 Å²	126	148.2 Å²	148.2	77%	0.773	83%	0.834	S	S	*	*				-171.2	107.2	102.6	-73.2	0	0	0	0	113.7
555	V	31.9	Very low	37.2	Very low	118 Å²	118	146.5 Å²	146.5	72%	0.715	83%	0.831	S	S	*	*			trans	53.4	94.7	137.4	-171.2	0	0	0	0	120.9
556	T	35.3	Very low	38.3	Very low	118 Å²	118	146.2 Å²	146.2	72%	0.724	83%	0.829	S	S	*	*				67.6	114.9	122.1	-49.9	0	0	0	0	122.2
557	L	33.9	Very low	39.1	Very low	167 Å²	167	141.4 Å²	141.4	87%	0.874	82%	0.815	S	S	*	*				-156.7	153	109.8	-111.3	173.7	0	0	0	112.8
558	L	42.6	Very low	40.3	Very low	175 Å²	175	134.1 Å²	134.1	92%	0.916	79%	0.786	S	S	*	*			trans	-90.5	133.7	178.6	-83.8	153.4	0	0	0	110.9
559	G	36.1	Very low	41.7	Very low	77 Å²	77	128 Å²	128	79%	0.794	77%	0.765	S	S	*	*			trans	-169.4	112	173.6	0	0	0	0	0	112.1
560	S	41.1	Very low	43.6	Very low	133 Å²	133	124.8 Å²	124.8	93%	0.93	75%	0.745	S	S	*	*			trans	-64.3	136.5	-178.9	49.8	0	0	0	0	114
561	G	37.2	Very low	45.7	Very low	74 Å²	74	127.3 Å²	127.3	76%	0.763	73%	0.733	S	S	*	*			trans	-178	80.2	173.3	0	0	0	0	0	114.4	Q563	G561-Q563 PolarHBondContact O-N 3.32Å
562	E	50	Low	48	Very low	203 Å²	203	128.6 Å²	128.6	95%	0.949	72%	0.72	S	S	*	*			trans	-76.5	76.8	179.8	-64.1	167.3	99.9	0	0	112.5
563	Q	46.3	Very low	49.7	Very low	190 Å²	190	128.6 Å²	128.6	89%	0.888	71%	0.708	S	S	*	*			trans	-153.8	16.2	175	-133.4	177.6	-11.2	0	0	120.8	G561	G561-Q563 PolarHBondContact O-N 3.32Å
564	E	45.8	Very low	52.1	Low	175 Å²	175	128.6 Å²	128.6	82%	0.818	70%	0.696	S	S	*	*	S	Bend	trans	-120.2	-21.2	178.1	-64.7	-165.1	158.1	0	0	116.3	E566 S567	E564-E566 PolarHBondContact O-N 3.32Å; E564-S567 PolarHBondContact O-N 2.88Å
565	D	53.7	Low	54.4	Low	133 Å²	133	128.2 Å²	128.2	71%	0.711	69%	0.687	S	S	*	*	H	α-helix	trans	-65.1	-36.1	-170.7	-96.5	-51.1	0	0	0	115.5	S567 S568 S569	D565-S567 PolarHBondContact O-N 3.13Å; D565-S568 PolarHBondContact O-N 3.25Å; D565-S568 VanDerWaalsContact O-N 3.09Å; D565-S568 PolarHBondContact O-OG 3.32Å; D565-S569 PolarHBondContact O-N 2.85Å
566	E	53	Low	57.1	Low	172 Å²	172	129 Å²	129	80%	0.804	68%	0.683	S	S	*	*	H	α-helix	trans	-57.9	-36.4	-179.8	-77.5	-167.8	94.5	0	0	111.8	E564 S568 S569 W570	E564-E566 PolarHBondContact O-N 3.32Å; E566-S568 PolarHBondContact O-N 3.1Å; E566-S569 PolarHBondContact O-N 3.44Å; E566-S569 PolarHBondContact O-OG 3.18Å; E566-W570 PolarHBondContact O-N 3.47Å
567	S	47.6	Very low	59.4	Low	79 Å²	79	128 Å²	128	55%	0.552	67%	0.671	S	S	*	*	H	α-helix	trans	-71.2	-26.3	179.4	-79.4	0	0	0	0	114.3	E564 D565 W570	E564-S567 PolarHBondContact O-N 2.88Å; D565-S567 PolarHBondContact O-N 3.13Å; S567-W570 PolarHBondContact O-NE1 2.91Å
568	S	61.3	Low	61.7	Low	44 Å²	44	126.2 Å²	126.2	31%	0.308	66%	0.659	S	S	.	*	H	α-helix	trans	-79.4	-25.4	175.7	88.6	0	0	0	0	112.8	D565 E566 R572	D565-S568 PolarHBondContact O-N 3.25Å; D565-S568 VanDerWaalsContact O-N 3.09Å; D565-S568 PolarHBondContact O-OG 3.32Å; E566-S568 PolarHBondContact O-N 3.1Å; S568-R572 PolarHBondContact O-N 3.43Å; S568-R572 PolarHBondContact O-NE 3.01Å; S568-R572 PolarHBondContact OG-NH2 2.04Å
569	S	57.3	Low	63.8	Low	67 Å²	67	122.6 Å²	122.6	47%	0.469	64%	0.637	S	S	.	*	H	α-helix	trans	-77	-44.9	-175.5	76.1	0	0	0	0	112.3	D565 E566 Y571 R572 K573	D565-S569 PolarHBondContact O-N 2.85Å; E566-S569 PolarHBondContact O-N 3.44Å; E566-S569 PolarHBondContact O-OG 3.18Å; S569-Y571 PolarHBondContact O-N 2.97Å; S569-R572 PolarHBondContact O-N 3.42Å; S569-K573 PolarHBondContact O-N 3.45Å; S569-K573 VanDerWaalsContact O-N 3.12Å
570	W	71.4	Confident	66.4	Low	126 Å²	126	126.7 Å²	126.7	48%	0.477	63%	0.633	S	S	.	*	H	α-helix	trans	-69.1	-35.1	-179.8	76.7	-102.5	0	0	0	111.8	E566 S567 K573 Q574	E566-W570 PolarHBondContact O-N 3.47Å; S567-W570 PolarHBondContact O-NE1 2.91Å; W570-K573 PolarHBondContact O-N 2.66Å; W570-Q574 HydrophobicContact CE3-CB 4.47Å; W570-Q574 HydrophobicContact CE3-CG 3.9Å; W570-Q574 HydrophobicContact CZ3-CG 4.3Å; W570-Q574 WeakPolarHBondContact O-CB 3.3Å; W570-Q574 WeakPolarHBondContact O-CG 3.49Å; W570-Q574 PolarHBondContact O-N 2.86Å
571	Y	73.8	Confident	68.6	Low	155 Å²	155	122.9 Å²	122.9	61%	0.608	61%	0.61	S	S	*	*	H	α-helix	trans	-63.3	-46	177.8	-116.8	-66.8	0	0	0	112.1	S569 Q574 M575	S569-Y571 PolarHBondContact O-N 2.97Å; Y571-Q574 PolarHBondContact O-N 2.92Å; Y571-M575 WeakPolarHBondContact O-CB 3.46Å; Y571-M575 PolarHBondContact O-N 3.06Å
572	R	81.1	Confident	71.1	Confident	144 Å²	144	124.9 Å²	124.9	54%	0.543	60%	0.598	S	S	.	*	H	α-helix	trans	-60.4	-47.1	174.3	-81.2	-179	-84.6	-171.5	-5.1	111.5	S568 S569 Q574 M575 E576	S568-R572 PolarHBondContact O-N 3.43Å; S568-R572 PolarHBondContact O-NE 3.01Å; S568-R572 PolarHBondContact OG-NH2 2.04Å; S569-R572 PolarHBondContact O-N 3.42Å; R572-Q574 PolarHBondContact O-N 2.97Å; R572-M575 WeakPolarHBondContact O-CB 3.07Å; R572-M575 PolarHBondContact O-N 3.12Å; R572-M575 VanDerWaalsContact O-N 3.17Å; R572-E576 PolarHBondContact O-N 3.44Å
573	K	83.3	Confident	73	Confident	123 Å²	123	119 Å²	119	54%	0.535	57%	0.573	S	S	.	*	H	α-helix	trans	-63	-40.2	178.6	-171.5	174.1	179.2	-179.3	0	113.3	S569 W570 E576 E577	S569-K573 PolarHBondContact O-N 3.45Å; S569-K573 VanDerWaalsContact O-N 3.12Å; W570-K573 PolarHBondContact O-N 2.66Å; K573-E576 PolarHBondContact O-N 3.22Å; K573-E577 WeakPolarHBondContact CE-OE1 3.47Å; K573-E577 WeakPolarHBondContact O-CB 2.95Å; K573-E577 WeakPolarHBondContact O-CG 3.45Å; K573-E577 PolarHBondContact O-N 3.45Å
574	Q	78.9	Confident	75.2	Confident	101 Å²	101	117.9 Å²	117.9	47%	0.472	57%	0.565	S	S	.	*	H	α-helix	trans	-66.9	-36.8	174.1	-76.1	-59	-80.6	0	0	112.2	W570 Y571 R572 E577 M578	W570-Q574 HydrophobicContact CE3-CB 4.47Å; W570-Q574 HydrophobicContact CE3-CG 3.9Å; W570-Q574 HydrophobicContact CZ3-CG 4.3Å; W570-Q574 WeakPolarHBondContact O-CB 3.3Å; W570-Q574 WeakPolarHBondContact O-CG 3.49Å; W570-Q574 PolarHBondContact O-N 2.86Å; Y571-Q574 PolarHBondContact O-N 2.92Å; R572-Q574 PolarHBondContact O-N 2.97Å; Q574-E577 PolarHBondContact NE2-OE2 2.96Å; Q574-E577 PolarHBondContact O-N 2.92Å; Q574-M578 VanDerWaalsContact O-CB 3.22Å; Q574-M578 WeakPolarHBondContact O-CB 3.29Å; Q574-M578 PolarHBondContact O-N 2.94Å
575	M	80.8	Confident	77.3	Confident	119 Å²	119	113.8 Å²	113.8	59%	0.586	55%	0.552	S	S	*	*	H	α-helix	trans	-66.2	-39.8	174.6	-172.1	166.8	60.9	0	0	112.1	Y571 R572 Q579	Y571-M575 WeakPolarHBondContact O-CB 3.46Å; Y571-M575 PolarHBondContact O-N 3.06Å; R572-M575 WeakPolarHBondContact O-CB 3.07Å; R572-M575 PolarHBondContact O-N 3.12Å; R572-M575 VanDerWaalsContact O-N 3.17Å; M575-Q579 VanDerWaalsContact O-CB 3.26Å; M575-Q579 WeakPolarHBondContact O-CB 3.35Å; M575-Q579 PolarHBondContact O-N 3.08Å
576	E	87.9	Confident	79.1	Confident	135 Å²	135	110.4 Å²	110.4	63%	0.631	53%	0.533	S	S	*	.	H	α-helix	trans	-64.2	-45.4	172	-73.9	173.5	-157.2	0	0	112.6	R572 K573 M578 Q579 K580	R572-E576 PolarHBondContact O-N 3.44Å; K573-E576 PolarHBondContact O-N 3.22Å; E576-M578 VanDerWaalsContact C-N 3.35Å; E576-Q579 PolarHBondContact O-N 3.31Å; E576-K580 WeakPolarHBondContact O-CB 3.04Å; E576-K580 PolarHBondContact O-N 3.13Å
577	E	85.2	Confident	81.1	Confident	97 Å²	97	106.7 Å²	106.7	45%	0.453	52%	0.522	S	S	.	.	H	α-helix	trans	-64.2	-39.3	177.2	-75	176	-173.8	0	0	111.6	K573 Q574 K580 A581	K573-E577 WeakPolarHBondContact CE-OE1 3.47Å; K573-E577 WeakPolarHBondContact O-CB 2.95Å; K573-E577 WeakPolarHBondContact O-CG 3.45Å; K573-E577 PolarHBondContact O-N 3.45Å; Q574-E577 PolarHBondContact NE2-OE2 2.96Å; Q574-E577 PolarHBondContact O-N 2.92Å; E577-K580 PolarHBondContact O-N 2.86Å; E577-A581 WeakPolarHBondContact O-CB 3.33Å; E577-A581 PolarHBondContact O-N 2.88Å
578	M	81.7	Confident	83.2	Confident	129 Å²	129	110.2 Å²	110.2	64%	0.635	53%	0.528	S	S	*	.	H	α-helix	trans	-65.5	-47	173.5	-172.6	-177.4	74.9	0	0	111.8	Q574 E576 K580 A581 F582	Q574-M578 VanDerWaalsContact O-CB 3.22Å; Q574-M578 WeakPolarHBondContact O-CB 3.29Å; Q574-M578 PolarHBondContact O-N 2.94Å; E576-M578 VanDerWaalsContact C-N 3.35Å; M578-K580 VanDerWaalsContact C-N 3.29Å; M578-K580 PolarHBondContact O-N 2.86Å; M578-A581 CarbonylContact O-C 3.57Å; M578-A581 WeakPolarHBondContact O-CB 3.42Å; M578-A581 PolarHBondContact O-N 2.8Å; M578-A581 VanDerWaalsContact O-N 3.14Å; M578-F582 WeakPolarHBondContact O-CB 3.45Å; M578-F582 PolarHBondContact O-N 2.95Å
579	Q	86.3	Confident	84.6	Confident	98 Å²	98	113.9 Å²	113.9	46%	0.458	54%	0.543	S	S	.	.	H	α-helix	trans	-64.5	-35.2	178.3	-171.9	69.3	-17.2	0	0	111.5	M575 E576 F582 N583	M575-Q579 VanDerWaalsContact O-CB 3.26Å; M575-Q579 WeakPolarHBondContact O-CB 3.35Å; M575-Q579 PolarHBondContact O-N 3.08Å; E576-Q579 PolarHBondContact O-N 3.31Å; Q579-F582 PolarHBondContact O-N 2.84Å; Q579-N583 WeakPolarHBondContact O-CB 3.09Å; Q579-N583 VanDerWaalsContact O-CG 3.31Å; Q579-N583 PolarHBondContact O-N 3.32Å
580	K	90.2	Very high	86.1	Confident	163 Å²	163	116.6 Å²	116.6	71%	0.709	55%	0.548	S	S	*	.	H	α-helix	trans	-68	-37.2	173.1	-169.7	171.4	-171.7	169.3	0	112.2	E576 E577 M578 K584	E576-K580 WeakPolarHBondContact O-CB 3.04Å; E576-K580 PolarHBondContact O-N 3.13Å; E577-K580 PolarHBondContact O-N 2.86Å; M578-K580 VanDerWaalsContact C-N 3.29Å; M578-K580 PolarHBondContact O-N 2.86Å; K580-K584 WeakPolarHBondContact O-CB 3.4Å; K580-K584 PolarHBondContact O-N 2.8Å
581	A	87.4	Confident	87	Confident	54 Å²	54	115.1 Å²	115.1	45%	0.446	55%	0.55	S	S	.	.	H	α-helix	trans	-67.8	-39.2	171.7	0	0	0	0	0	112	E577 M578 K584 T585	E577-A581 WeakPolarHBondContact O-CB 3.33Å; E577-A581 PolarHBondContact O-N 2.88Å; M578-A581 CarbonylContact O-C 3.57Å; M578-A581 WeakPolarHBondContact O-CB 3.42Å; M578-A581 PolarHBondContact O-N 2.8Å; M578-A581 VanDerWaalsContact O-N 3.14Å; A581-K584 PolarHBondContact O-N 2.68Å; A581-T585 WeakPolarHBondContact O-CB 3.47Å; A581-T585 PolarHBondContact O-N 2.96Å; A581-T585 PolarHBondContact O-OG1 2.73Å
582	F	89.4	Confident	87.9	Confident	116 Å²	116	111.1 Å²	111.1	51%	0.509	54%	0.542	S	S	.	.	H	α-helix	trans	-65.1	-51.4	176.6	-173.6	-115.2	0	0	0	111.6	M578 Q579 K584 T585 I586	M578-F582 WeakPolarHBondContact O-CB 3.45Å; M578-F582 PolarHBondContact O-N 2.95Å; Q579-F582 PolarHBondContact O-N 2.84Å; F582-K584 VanDerWaalsContact C-N 3.32Å; F582-K584 PolarHBondContact O-N 3.32Å; F582-T585 CarbonylContact O-C 3.55Å; F582-T585 WeakPolarHBondContact O-CA 3.38Å; F582-T585 VanDerWaalsContact O-CB 3.32Å; F582-T585 WeakPolarHBondContact O-CB 3.27Å; F582-T585 PolarHBondContact O-N 2.81Å; F582-I586 HydrophobicContact CD1-CD1 3.87Å; F582-I586 HydrophobicContact CE1-CD1 3.53Å; F582-I586 HydrophobicContact CE1-CG1 4.44Å; F582-I586 HydrophobicContact CZ-CD1 3.94Å; F582-I586 HydrophobicContact CZ-CG1 4.47Å; F582-I586 PolarHBondContact O-N 2.63Å
583	N	90.5	Very high	88.3	Confident	80 Å²	80	107.1 Å²	107.1	43%	0.428	54%	0.536	S	S	.	.	H	α-helix	trans	-59.3	-40.5	175.5	-72.4	-11.4	0	0	0	112.2	Q579 T585 I586 V587	Q579-N583 WeakPolarHBondContact O-CB 3.09Å; Q579-N583 VanDerWaalsContact O-CG 3.31Å; Q579-N583 PolarHBondContact O-N 3.32Å; N583-T585 VanDerWaalsContact C-N 3.25Å; N583-T585 PolarHBondContact O-N 2.7Å; N583-I586 PolarHBondContact O-N 3.26Å; N583-V587 WeakPolarHBondContact O-CG2 3.47Å; N583-V587 PolarHBondContact O-N 2.96Å
584	K	92.1	Very high	88.7	Confident	166 Å²	166	108.3 Å²	108.3	72%	0.722	54%	0.537	S	S	*	.	H	α-helix	trans	-63.6	-31	173.2	-174.6	177.2	-179.4	-178.4	0	112.5	K580 A581 F582 K588	K580-K584 WeakPolarHBondContact O-CB 3.4Å; K580-K584 PolarHBondContact O-N 2.8Å; A581-K584 PolarHBondContact O-N 2.68Å; F582-K584 VanDerWaalsContact C-N 3.32Å; F582-K584 PolarHBondContact O-N 3.32Å; K584-K588 WeakPolarHBondContact O-CB 3.25Å; K584-K588 PolarHBondContact O-N 3.25Å; K584-K588 VanDerWaalsContact O-N 3.14Å
585	T	90	Very high	89.3	Confident	88 Å²	88	107.8 Å²	107.8	54%	0.54	54%	0.537	S	S	.	.	H	α-helix	trans	-74.9	-42	175.7	-56.9	0	0	0	0	111.3	A581 F582 N583 K588 L589	A581-T585 WeakPolarHBondContact O-CB 3.47Å; A581-T585 PolarHBondContact O-N 2.96Å; A581-T585 PolarHBondContact O-OG1 2.73Å; F582-T585 CarbonylContact O-C 3.55Å; F582-T585 WeakPolarHBondContact O-CA 3.38Å; F582-T585 VanDerWaalsContact O-CB 3.32Å; F582-T585 WeakPolarHBondContact O-CB 3.27Å; F582-T585 PolarHBondContact O-N 2.81Å; N583-T585 VanDerWaalsContact C-N 3.25Å; N583-T585 PolarHBondContact O-N 2.7Å; T585-K588 PolarHBondContact O-N 3.22Å; T585-L589 WeakPolarHBondContact O-CB 3.47Å; T585-L589 PolarHBondContact O-N 2.84Å
586	I	93.1	Very high	89.5	Confident	62 Å²	62	105 Å²	105	32%	0.318	53%	0.532	S	S	.	.	H	α-helix	trans	-58	-52.6	173.1	-69	171.1	0	0	0	110.7	F582 N583 K588 L589 Q590	F582-I586 HydrophobicContact CD1-CD1 3.87Å; F582-I586 HydrophobicContact CE1-CD1 3.53Å; F582-I586 HydrophobicContact CE1-CG1 4.44Å; F582-I586 HydrophobicContact CZ-CD1 3.94Å; F582-I586 HydrophobicContact CZ-CG1 4.47Å; F582-I586 PolarHBondContact O-N 2.63Å; N583-I586 PolarHBondContact O-N 3.26Å; I586-K588 VanDerWaalsContact C-N 3.27Å; I586-K588 PolarHBondContact O-N 2.7Å; I586-L589 PolarHBondContact O-N 3.45Å; I586-L589 VanDerWaalsContact O-N 3.08Å; I586-Q590 HydrophobicContact CG2-CG 4.27Å; I586-Q590 WeakPolarHBondContact O-CB 3.46Å; I586-Q590 WeakPolarHBondContact O-CG 3.26Å; I586-Q590 PolarHBondContact O-N 2.95Å
587	V	93.4	Very high	89.7	Confident	94 Å²	94	103.8 Å²	103.8	57%	0.57	53%	0.526	S	S	*	.	H	α-helix	trans	-61.1	-37.1	179.7	172.7	0	0	0	0	111.4	N583 N591	N583-V587 WeakPolarHBondContact O-CG2 3.47Å; N583-V587 PolarHBondContact O-N 2.96Å; V587-N591 VanDerWaalsContact O-CB 3.31Å; V587-N591 WeakPolarHBondContact O-CB 3.49Å; V587-N591 PolarHBondContact O-N 2.83Å
588	K	92.7	Very high	90	Very high	154 Å²	154	102.1 Å²	102.1	67%	0.67	52%	0.519	S	S	*	.	H	α-helix	trans	-66.2	-43.2	174.3	-170.3	-179.7	178.9	-170.7	0	111.7	K584 T585 I586 N591 T592	K584-K588 WeakPolarHBondContact O-CB 3.25Å; K584-K588 PolarHBondContact O-N 3.25Å; K584-K588 VanDerWaalsContact O-N 3.14Å; T585-K588 PolarHBondContact O-N 3.22Å; I586-K588 VanDerWaalsContact C-N 3.27Å; I586-K588 PolarHBondContact O-N 2.7Å; K588-N591 PolarHBondContact O-N 3.23Å; K588-T592 PolarHBondContact O-N 2.83Å; K588-T592 PolarHBondContact O-OG1 2.96Å; K588-T592 VanDerWaalsContact O-OG1 3.07Å
589	L	90.4	Very high	90.2	Very high	120 Å²	120	100.5 Å²	100.5	63%	0.628	51%	0.509	S	S	*	.	H	α-helix	trans	-65.5	-45.7	-179.7	-172.9	66.1	0	0	0	111.6	T585 I586 N591 T592 S593	T585-L589 WeakPolarHBondContact O-CB 3.47Å; T585-L589 PolarHBondContact O-N 2.84Å; I586-L589 PolarHBondContact O-N 3.45Å; I586-L589 VanDerWaalsContact O-N 3.08Å; L589-N591 PolarHBondContact O-N 3.11Å; L589-T592 WeakPolarHBondContact CA-OG1 3.48Å; L589-T592 PolarHBondContact O-N 3.19Å; L589-T592 PolarHBondContact O-OG1 3.22Å; L589-S593 PolarHBondContact O-N 3.4Å
590	Q	88.8	Confident	90.3	Very high	124 Å²	124	100.6 Å²	100.6	58%	0.579	51%	0.513	S	S	*	.	H	α-helix	trans	-59.9	-43.7	174.2	-72.7	175.6	-39.6	0	0	111.7	I586 T592 S593 R594	I586-Q590 HydrophobicContact CG2-CG 4.27Å; I586-Q590 WeakPolarHBondContact O-CB 3.46Å; I586-Q590 WeakPolarHBondContact O-CG 3.26Å; I586-Q590 PolarHBondContact O-N 2.95Å; Q590-T592 PolarHBondContact O-N 2.58Å; Q590-S593 WeakPolarHBondContact O-CB 3.22Å; Q590-S593 PolarHBondContact O-N 3.08Å; Q590-R594 PolarHBondContact O-N 3.1Å
591	N	91.1	Very high	90.5	Very high	95 Å²	95	97.9 Å²	97.9	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-66.3	-36.9	176.7	-165.5	30.9	0	0	0	112	V587 K588 L589 I595	V587-N591 VanDerWaalsContact O-CB 3.31Å; V587-N591 WeakPolarHBondContact O-CB 3.49Å; V587-N591 PolarHBondContact O-N 2.83Å; K588-N591 PolarHBondContact O-N 3.23Å; L589-N591 PolarHBondContact O-N 3.11Å; N591-I595 WeakPolarHBondContact O-CB 3.45Å; N591-I595 WeakPolarHBondContact O-CD1 3.38Å; N591-I595 WeakPolarHBondContact O-CG1 3.34Å; N591-I595 PolarHBondContact O-N 3.49Å
592	T	90.9	Very high	90.7	Very high	71 Å²	71	102 Å²	102	44%	0.436	51%	0.507	S	S	.	.	H	α-helix	trans	-70.7	-33.2	172.9	46.7	0	0	0	0	113.5	K588 L589 Q590 I595 A596	K588-T592 PolarHBondContact O-N 2.83Å; K588-T592 PolarHBondContact O-OG1 2.96Å; K588-T592 VanDerWaalsContact O-OG1 3.07Å; L589-T592 WeakPolarHBondContact CA-OG1 3.48Å; L589-T592 PolarHBondContact O-N 3.19Å; L589-T592 PolarHBondContact O-OG1 3.22Å; Q590-T592 PolarHBondContact O-N 2.58Å; T592-I595 PolarHBondContact O-N 2.93Å; T592-A596 PolarHBondContact O-N 2.95Å
593	S	89.9	Confident	90.5	Very high	60 Å²	60	102 Å²	102	42%	0.42	51%	0.509	S	S	.	.	H	α-helix	trans	-61.7	-54.5	172.9	-162.3	0	0	0	0	109.8	L589 Q590 I595 A596 E597	L589-S593 PolarHBondContact O-N 3.4Å; Q590-S593 WeakPolarHBondContact O-CB 3.22Å; Q590-S593 PolarHBondContact O-N 3.08Å; S593-I595 VanDerWaalsContact C-N 3.29Å; S593-I595 PolarHBondContact O-N 2.93Å; S593-A596 CarbonylContact O-C 3.49Å; S593-A596 WeakPolarHBondContact O-CA 3.38Å; S593-A596 WeakPolarHBondContact O-CB 3.21Å; S593-A596 PolarHBondContact O-N 3.45Å; S593-E597 VanDerWaalsContact CB-OE1 3.29Å; S593-E597 WeakPolarHBondContact CB-OE1 3.32Å; S593-E597 WeakPolarHBondContact O-CG 3.41Å; S593-E597 PolarHBondContact O-N 3.5Å; S593-E597 PolarHBondContact OG-OE1 2.97Å
594	R	92.2	Very high	90.4	Very high	149 Å²	149	101.2 Å²	101.2	56%	0.562	51%	0.507	S	S	*	.	H	α-helix	trans	-54.1	-42.8	176	-178.6	-174.3	165.9	124.2	12.5	112.7	Q590 A596 E597 E598	Q590-R594 PolarHBondContact O-N 3.1Å; R594-A596 VanDerWaalsContact C-N 3.33Å; R594-E597 PolarHBondContact N-OE1 3.43Å; R594-E597 PolarHBondContact O-N 2.78Å; R594-E598 IonicContact CZ-OE1 2.65Å; R594-E598 VanDerWaalsContact CZ-OE1 3.24Å; R594-E598 IonicContact NE-OE1 2.75Å; R594-E598 PolarHBondContact NE-OE1 3.01Å; R594-E598 IonicContact NH2-OE1 2.63Å; R594-E598 PolarHBondContact NH2-OE1 3.21Å; R594-E598 WeakPolarHBondContact O-CB 3.36Å; R594-E598 WeakPolarHBondContact O-CG 3.26Å; R594-E598 PolarHBondContact O-N 3.39Å
595	I	90.6	Very high	90.5	Very high	90 Å²	90	98.5 Å²	98.5	46%	0.462	50%	0.497	S	S	.	.	H	α-helix	trans	-66.9	-35.6	178.5	-70.6	165	0	0	0	111.1	N591 T592 S593 Q599	N591-I595 WeakPolarHBondContact O-CB 3.45Å; N591-I595 WeakPolarHBondContact O-CD1 3.38Å; N591-I595 WeakPolarHBondContact O-CG1 3.34Å; N591-I595 PolarHBondContact O-N 3.49Å; T592-I595 PolarHBondContact O-N 2.93Å; S593-I595 VanDerWaalsContact C-N 3.29Å; S593-I595 PolarHBondContact O-N 2.93Å; I595-Q599 WeakPolarHBondContact O-CG 3.28Å; I595-Q599 PolarHBondContact O-N 2.95Å; I595-Q599 VanDerWaalsContact O-N 3.13Å
596	A	86.2	Confident	90.6	Very high	59 Å²	59	96.6 Å²	96.6	49%	0.488	49%	0.49	S	S	.	.	H	α-helix	trans	-68.5	-44.8	173.8	0	0	0	0	0	111.9	T592 S593 R594 E598 Q599 D600	T592-A596 PolarHBondContact O-N 2.95Å; S593-A596 CarbonylContact O-C 3.49Å; S593-A596 WeakPolarHBondContact O-CA 3.38Å; S593-A596 WeakPolarHBondContact O-CB 3.21Å; S593-A596 PolarHBondContact O-N 3.45Å; R594-A596 VanDerWaalsContact C-N 3.33Å; A596-E598 VanDerWaalsContact C-N 3.32Å; A596-E598 PolarHBondContact O-N 2.96Å; A596-Q599 WeakPolarHBondContact O-CA 3.47Å; A596-Q599 WeakPolarHBondContact O-CB 3.38Å; A596-Q599 PolarHBondContact O-N 3.23Å; A596-D600 PolarHBondContact O-N 3.29Å
597	E	91.2	Very high	90.5	Very high	110 Å²	110	98 Å²	98	51%	0.514	50%	0.497	S	S	.	.	H	α-helix	trans	-57.1	-43.6	172.8	-66.2	151	-138	0	0	111.1	S593 R594 Q599 D600 Q601	S593-E597 VanDerWaalsContact CB-OE1 3.29Å; S593-E597 WeakPolarHBondContact CB-OE1 3.32Å; S593-E597 WeakPolarHBondContact O-CG 3.41Å; S593-E597 PolarHBondContact O-N 3.5Å; S593-E597 PolarHBondContact OG-OE1 2.97Å; R594-E597 PolarHBondContact N-OE1 3.43Å; R594-E597 PolarHBondContact O-N 2.78Å; E597-Q599 VanDerWaalsContact C-N 3.25Å; E597-Q599 PolarHBondContact O-N 2.92Å; E597-D600 PolarHBondContact O-N 2.89Å; E597-Q601 WeakPolarHBondContact O-CB 3.27Å; E597-Q601 PolarHBondContact O-N 3.06Å
598	E	92.4	Very high	90.4	Very high	63 Å²	63	99.8 Å²	99.8	29%	0.294	50%	0.499	S	S	.	.	H	α-helix	trans	-69.3	-14.6	174	-77.9	-170.4	-148.2	0	0	114.1	R594 A596 R602	R594-E598 IonicContact CZ-OE1 2.65Å; R594-E598 VanDerWaalsContact CZ-OE1 3.24Å; R594-E598 IonicContact NE-OE1 2.75Å; R594-E598 PolarHBondContact NE-OE1 3.01Å; R594-E598 IonicContact NH2-OE1 2.63Å; R594-E598 PolarHBondContact NH2-OE1 3.21Å; R594-E598 WeakPolarHBondContact O-CB 3.36Å; R594-E598 WeakPolarHBondContact O-CG 3.26Å; R594-E598 PolarHBondContact O-N 3.39Å; A596-E598 VanDerWaalsContact C-N 3.32Å; A596-E598 PolarHBondContact O-N 2.96Å; E598-R602 VanDerWaalsContact O-CD 3.26Å; E598-R602 WeakPolarHBondContact O-CD 3.41Å; E598-R602 VanDerWaalsContact O-CG 3.25Å; E598-R602 WeakPolarHBondContact O-CG 3.19Å; E598-R602 PolarHBondContact O-NE 2.94Å; E598-R602 IonicContact OE2-NH2 3.36Å; E598-R602 PolarHBondContact OE2-NH2 2.81Å
599	Q	86.3	Confident	90.4	Very high	94 Å²	94	97.8 Å²	97.8	44%	0.439	50%	0.495	S	S	.	.	H	α-helix	trans	-86.1	-44.3	167.5	-68.4	-56.2	-92.9	0	0	111.4	I595 A596 E597 Q601 R602 Q603	I595-Q599 WeakPolarHBondContact O-CG 3.28Å; I595-Q599 PolarHBondContact O-N 2.95Å; I595-Q599 VanDerWaalsContact O-N 3.13Å; A596-Q599 WeakPolarHBondContact O-CA 3.47Å; A596-Q599 WeakPolarHBondContact O-CB 3.38Å; A596-Q599 PolarHBondContact O-N 3.23Å; E597-Q599 VanDerWaalsContact C-N 3.25Å; E597-Q599 PolarHBondContact O-N 2.92Å; Q599-Q601 VanDerWaalsContact C-N 3.35Å; Q599-Q601 PolarHBondContact O-N 2.97Å; Q599-R602 PolarHBondContact O-N 2.74Å; Q599-R602 VanDerWaalsContact O-N 3.08Å; Q599-Q603 WeakPolarHBondContact O-CG 3.44Å; Q599-Q603 PolarHBondContact O-N 3.03Å
600	D	88.1	Confident	90.5	Very high	101 Å²	101	97.4 Å²	97.4	54%	0.54	49%	0.493	S	S	.	.	H	α-helix	trans	-62.3	-41.4	-179.3	-164.2	57.7	0	0	0	111.6	A596 E597 R602 Q603 T604	A596-D600 PolarHBondContact O-N 3.29Å; E597-D600 PolarHBondContact O-N 2.89Å; D600-R602 VanDerWaalsContact C-N 3.32Å; D600-R602 PolarHBondContact O-N 2.99Å; D600-Q603 PolarHBondContact O-N 2.72Å; D600-T604 PolarHBondContact O-N 2.77Å; D600-T604 PolarHBondContact O-OG1 3.09Å
601	Q	93.4	Very high	90.6	Very high	106 Å²	106	96.6 Å²	96.6	50%	0.495	49%	0.489	S	S	.	.	H	α-helix	trans	-58.9	-40.1	171.6	-177	60.8	33.8	0	0	112.4	E597 Q599 T604 E605	E597-Q601 WeakPolarHBondContact O-CB 3.27Å; E597-Q601 PolarHBondContact O-N 3.06Å; Q599-Q601 VanDerWaalsContact C-N 3.35Å; Q599-Q601 PolarHBondContact O-N 2.97Å; Q601-T604 WeakPolarHBondContact CA-OG1 3.47Å; Q601-T604 PolarHBondContact O-OG1 3.13Å; Q601-E605 PolarHBondContact NE2-OE1 3.29Å; Q601-E605 WeakPolarHBondContact O-CB 3.41Å; Q601-E605 VanDerWaalsContact O-CG 3.25Å; Q601-E605 WeakPolarHBondContact O-CG 3.25Å; Q601-E605 PolarHBondContact O-N 2.85Å
602	R	91.8	Very high	90.7	Very high	139 Å²	139	94.3 Å²	94.3	53%	0.525	48%	0.484	S	S	.	.	H	α-helix	trans	-74.6	-30.5	178.7	-66.3	175.4	-147.6	-173.8	6.6	112.2	E598 Q599 D600 A606	E598-R602 VanDerWaalsContact O-CD 3.26Å; E598-R602 WeakPolarHBondContact O-CD 3.41Å; E598-R602 VanDerWaalsContact O-CG 3.25Å; E598-R602 WeakPolarHBondContact O-CG 3.19Å; E598-R602 PolarHBondContact O-NE 2.94Å; E598-R602 IonicContact OE2-NH2 3.36Å; E598-R602 PolarHBondContact OE2-NH2 2.81Å; Q599-R602 PolarHBondContact O-N 2.74Å; Q599-R602 VanDerWaalsContact O-N 3.08Å; D600-R602 VanDerWaalsContact C-N 3.32Å; D600-R602 PolarHBondContact O-N 2.99Å; R602-A606 WeakPolarHBondContact O-CB 3.39Å; R602-A606 PolarHBondContact O-N 3.35Å; R602-A606 VanDerWaalsContact O-N 3.09Å
603	Q	85.4	Confident	90.7	Very high	117 Å²	117	96.8 Å²	96.8	55%	0.547	49%	0.49	S	S	.	.	H	α-helix	trans	-72.1	-42.8	174.3	-71.1	-175	12.6	0	0	111.3	Q599 D600 A606 I607	Q599-Q603 WeakPolarHBondContact O-CG 3.44Å; Q599-Q603 PolarHBondContact O-N 3.03Å; D600-Q603 PolarHBondContact O-N 2.72Å; Q603-A606 PolarHBondContact O-N 3.32Å; Q603-I607 WeakPolarHBondContact O-CB 3.44Å; Q603-I607 WeakPolarHBondContact O-CD1 3.46Å; Q603-I607 VanDerWaalsContact O-CG1 3.23Å; Q603-I607 WeakPolarHBondContact O-CG1 3.48Å; Q603-I607 PolarHBondContact O-N 2.98Å
604	T	88.3	Confident	90.8	Very high	63 Å²	63	99.6 Å²	99.6	39%	0.387	50%	0.5	S	S	.	.	H	α-helix	trans	-66.1	-40	175.6	49.7	0	0	0	0	112.4	D600 Q601 I607 H608	D600-T604 PolarHBondContact O-N 2.77Å; D600-T604 PolarHBondContact O-OG1 3.09Å; Q601-T604 WeakPolarHBondContact CA-OG1 3.47Å; Q601-T604 PolarHBondContact O-OG1 3.13Å; T604-I607 PolarHBondContact O-N 2.94Å; T604-H608 WeakPolarHBondContact O-CB 3.49Å; T604-H608 PolarHBondContact O-N 3.27Å
605	E	93.8	Very high	90.7	Very high	110 Å²	110	97 Å²	97	51%	0.514	50%	0.5	S	S	.	.	H	α-helix	trans	-59.9	-43.8	170.7	-77.1	170.5	-166.5	0	0	112.6	Q601 H608 L609	Q601-E605 PolarHBondContact NE2-OE1 3.29Å; Q601-E605 WeakPolarHBondContact O-CB 3.41Å; Q601-E605 VanDerWaalsContact O-CG 3.25Å; Q601-E605 WeakPolarHBondContact O-CG 3.25Å; Q601-E605 PolarHBondContact O-N 2.85Å; E605-H608 PolarHBondContact O-N 3.07Å; E605-L609 WeakPolarHBondContact O-CB 3.39Å; E605-L609 PolarHBondContact O-N 3.41Å
606	A	92.8	Very high	90.8	Very high	48 Å²	48	97 Å²	97	40%	0.397	50%	0.502	S	S	.	.	H	α-helix	trans	-65.9	-40.7	176.7	0	0	0	0	0	112.6	R602 Q603 L609 L610	R602-A606 WeakPolarHBondContact O-CB 3.39Å; R602-A606 PolarHBondContact O-N 3.35Å; R602-A606 VanDerWaalsContact O-N 3.09Å; Q603-A606 PolarHBondContact O-N 3.32Å; A606-L609 PolarHBondContact O-N 3.07Å; A606-L610 WeakPolarHBondContact O-CG 3.14Å; A606-L610 PolarHBondContact O-N 2.83Å
607	I	91.3	Very high	91	Very high	91 Å²	91	99.2 Å²	99.2	47%	0.467	50%	0.503	S	S	.	.	H	α-helix	trans	-62	-45.7	175.1	-71.1	162.2	0	0	0	110.4	Q603 T604 L609 L610 Q611	Q603-I607 WeakPolarHBondContact O-CB 3.44Å; Q603-I607 WeakPolarHBondContact O-CD1 3.46Å; Q603-I607 VanDerWaalsContact O-CG1 3.23Å; Q603-I607 WeakPolarHBondContact O-CG1 3.48Å; Q603-I607 PolarHBondContact O-N 2.98Å; T604-I607 PolarHBondContact O-N 2.94Å; I607-L609 PolarHBondContact O-N 3.08Å; I607-L610 PolarHBondContact O-N 2.85Å; I607-Q611 HydrophobicContact CG2-CG 4.49Å; I607-Q611 WeakPolarHBondContact O-CG 3.41Å; I607-Q611 PolarHBondContact O-N 3.34Å
608	H	91	Very high	91.1	Very high	132 Å²	132	98 Å²	98	61%	0.611	50%	0.504	S	S	*	.	H	α-helix	trans	-65.1	-37.8	179.1	-170.7	-98.3	0	0	0	112.2	T604 E605 Q611 A612	T604-H608 WeakPolarHBondContact O-CB 3.49Å; T604-H608 PolarHBondContact O-N 3.27Å; E605-H608 PolarHBondContact O-N 3.07Å; H608-Q611 PolarHBondContact O-N 3.29Å; H608-A612 WeakPolarHBondContact O-CB 3.39Å; H608-A612 PolarHBondContact O-N 2.95Å
609	L	93.3	Very high	91	Very high	111 Å²	111	101.7 Å²	101.7	58%	0.581	52%	0.521	S	S	*	.	H	α-helix	trans	-63.3	-42.6	172.9	-179.3	61.9	0	0	0	112.1	E605 A606 I607 A612 Q613	E605-L609 WeakPolarHBondContact O-CB 3.39Å; E605-L609 PolarHBondContact O-N 3.41Å; A606-L609 PolarHBondContact O-N 3.07Å; I607-L609 PolarHBondContact O-N 3.08Å; L609-A612 PolarHBondContact O-N 3.03Å; L609-Q613 PolarHBondContact O-N 3.41Å
610	L	91.4	Very high	91.4	Very high	112 Å²	112	102 Å²	102	59%	0.586	53%	0.525	S	S	*	.	H	α-helix	trans	-65.6	-37.8	175.9	-71.6	168.9	0	0	0	112	A606 I607 Q613 L614	A606-L610 WeakPolarHBondContact O-CG 3.14Å; A606-L610 PolarHBondContact O-N 2.83Å; I607-L610 PolarHBondContact O-N 2.85Å; L610-Q613 PolarHBondContact O-N 2.99Å; L610-L614 VanDerWaalsContact O-CB 3.31Å; L610-L614 WeakPolarHBondContact O-CB 3.38Å; L610-L614 PolarHBondContact O-N 3.31Å
611	Q	91.4	Very high	91.6	Very high	108 Å²	108	101.7 Å²	101.7	51%	0.505	53%	0.526	S	S	.	.	H	α-helix	trans	-64.2	-39.2	172.6	-72.5	171	-20.7	0	0	112	I607 H608 L614 T615	I607-Q611 HydrophobicContact CG2-CG 4.49Å; I607-Q611 WeakPolarHBondContact O-CG 3.41Å; I607-Q611 PolarHBondContact O-N 3.34Å; H608-Q611 PolarHBondContact O-N 3.29Å; Q611-L614 PolarHBondContact O-N 2.96Å; Q611-T615 WeakPolarHBondContact O-CB 3.43Å; Q611-T615 WeakPolarHBondContact O-CG2 3.33Å; Q611-T615 PolarHBondContact O-N 3.26Å; Q611-T615 PolarHBondContact O-OG1 2.92Å
612	A	93.1	Very high	91.3	Very high	47 Å²	47	100 Å²	100	39%	0.388	53%	0.525	S	S	.	.	H	α-helix	trans	-66	-38.4	174.1	0	0	0	0	0	112.7	H608 L609 T615 N616	H608-A612 WeakPolarHBondContact O-CB 3.39Å; H608-A612 PolarHBondContact O-N 2.95Å; L609-A612 PolarHBondContact O-N 3.03Å; A612-T615 WeakPolarHBondContact CA-OG1 3.34Å; A612-T615 PolarHBondContact O-OG1 2.92Å; A612-T615 VanDerWaalsContact O-OG1 3.05Å; A612-N616 WeakPolarHBondContact O-CB 3.33Å; A612-N616 PolarHBondContact O-N 2.86Å
613	Q	91.9	Very high	91.3	Very high	122 Å²	122	98.4 Å²	98.4	57%	0.57	53%	0.527	S	S	*	.	H	α-helix	trans	-69.7	-41.9	173.1	-72	-160.7	-45.6	0	0	112.4	L609 L610 T615 N616 M617	L609-Q613 PolarHBondContact O-N 3.41Å; L610-Q613 PolarHBondContact O-N 2.99Å; Q613-T615 PolarHBondContact O-N 2.74Å; Q613-N616 PolarHBondContact O-N 3.34Å; Q613-M617 WeakPolarHBondContact O-CG 3.49Å; Q613-M617 PolarHBondContact O-N 3.49Å
614	L	91	Very high	91.5	Very high	120 Å²	120	97.8 Å²	97.8	63%	0.628	53%	0.527	S	S	*	.	H	α-helix	trans	-63.1	-41.6	179	-172.9	69.5	0	0	0	112	L610 Q611 T618	L610-L614 VanDerWaalsContact O-CB 3.31Å; L610-L614 WeakPolarHBondContact O-CB 3.38Å; L610-L614 PolarHBondContact O-N 3.31Å; Q611-L614 PolarHBondContact O-N 2.96Å; L614-T618 VanDerWaalsContact O-CB 3.28Å; L614-T618 WeakPolarHBondContact O-CB 3.47Å; L614-T618 PolarHBondContact O-N 3.06Å; L614-T618 PolarHBondContact O-OG1 3.07Å
615	T	90.2	Very high	91.7	Very high	93 Å²	93	98.4 Å²	98.4	57%	0.571	53%	0.534	S	S	*	.	H	α-helix	trans	-66.3	-41.6	175.6	45.4	0	0	0	0	111.9	Q611 A612 Q613 T618 Q619	Q611-T615 WeakPolarHBondContact O-CB 3.43Å; Q611-T615 WeakPolarHBondContact O-CG2 3.33Å; Q611-T615 PolarHBondContact O-N 3.26Å; Q611-T615 PolarHBondContact O-OG1 2.92Å; A612-T615 WeakPolarHBondContact CA-OG1 3.34Å; A612-T615 PolarHBondContact O-OG1 2.92Å; A612-T615 VanDerWaalsContact O-OG1 3.05Å; Q613-T615 PolarHBondContact O-N 2.74Å; T615-T618 PolarHBondContact O-N 2.87Å; T615-Q619 PolarHBondContact O-N 2.9Å
616	N	92.3	Very high	91.6	Very high	92 Å²	92	96 Å²	96	49%	0.492	53%	0.534	S	S	.	.	H	α-helix	trans	-61.4	-50	174.4	-169.6	-32.3	0	0	0	111.9	A612 Q613 T618 Q619 I620	A612-N616 WeakPolarHBondContact O-CB 3.33Å; A612-N616 PolarHBondContact O-N 2.86Å; Q613-N616 PolarHBondContact O-N 3.34Å; N616-T618 VanDerWaalsContact C-N 3.3Å; N616-T618 PolarHBondContact O-N 3.38Å; N616-Q619 WeakPolarHBondContact O-CB 3.45Å; N616-Q619 PolarHBondContact O-N 3.14Å; N616-Q619 VanDerWaalsContact O-N 3.12Å; N616-I620 WeakPolarHBondContact O-CG1 3.41Å; N616-I620 PolarHBondContact O-N 2.96Å; N616-I620 WeakPolarHBondContact OD1-CD1 3.4Å
617	M	91.4	Very high	91.5	Very high	105 Å²	105	96.8 Å²	96.8	52%	0.517	53%	0.533	S	S	.	.	H	α-helix	trans	-60.6	-38.2	174.7	-68.9	-160.6	91.7	0	0	112.4	Q613 Q619 I620 V621	Q613-M617 WeakPolarHBondContact O-CG 3.49Å; Q613-M617 PolarHBondContact O-N 3.49Å; M617-Q619 VanDerWaalsContact C-N 3.33Å; M617-Q619 PolarHBondContact O-N 3.36Å; M617-I620 PolarHBondContact O-N 2.82Å; M617-V621 WeakPolarHBondContact O-CB 3.21Å; M617-V621 VanDerWaalsContact O-CG2 3.3Å; M617-V621 WeakPolarHBondContact O-CG2 3.47Å; M617-V621 PolarHBondContact O-N 2.95Å
618	T	91.6	Very high	91.5	Very high	85 Å²	85	96.3 Å²	96.3	52%	0.521	54%	0.535	S	S	.	.	H	α-helix	trans	-63.4	-39.1	175.8	-59.8	0	0	0	0	111.5	L614 T615 N616 V621 S622	L614-T618 VanDerWaalsContact O-CB 3.28Å; L614-T618 WeakPolarHBondContact O-CB 3.47Å; L614-T618 PolarHBondContact O-N 3.06Å; L614-T618 PolarHBondContact O-OG1 3.07Å; T615-T618 PolarHBondContact O-N 2.87Å; N616-T618 VanDerWaalsContact C-N 3.3Å; N616-T618 PolarHBondContact O-N 3.38Å; T618-V621 PolarHBondContact O-N 3.14Å; T618-S622 WeakPolarHBondContact O-CB 3.31Å; T618-S622 PolarHBondContact O-N 3.4Å; T618-S622 PolarHBondContact O-OG 3.39Å
619	Q	91.8	Very high	91.4	Very high	139 Å²	139	92 Å²	92	65%	0.65	52%	0.522	S	S	*	.	H	α-helix	trans	-64.2	-44.9	173.8	-173.7	176.2	-8.5	0	0	111.5	T615 N616 M617 S622 N623	T615-Q619 PolarHBondContact O-N 2.9Å; N616-Q619 WeakPolarHBondContact O-CB 3.45Å; N616-Q619 PolarHBondContact O-N 3.14Å; N616-Q619 VanDerWaalsContact O-N 3.12Å; M617-Q619 VanDerWaalsContact C-N 3.33Å; M617-Q619 PolarHBondContact O-N 3.36Å; Q619-S622 PolarHBondContact O-N 3.5Å; Q619-S622 PolarHBondContact O-OG 2.86Å; Q619-N623 WeakPolarHBondContact O-CB 3.41Å; Q619-N623 PolarHBondContact O-N 3.43Å
620	I	93.8	Very high	91.3	Very high	102 Å²	102	91.7 Å²	91.7	52%	0.523	52%	0.517	S	S	.	.	H	α-helix	trans	-60.1	-47.5	175.2	-65.8	169.2	0	0	0	110.8	N616 M617 S622 N623 L624	N616-I620 WeakPolarHBondContact O-CG1 3.41Å; N616-I620 PolarHBondContact O-N 2.96Å; N616-I620 WeakPolarHBondContact OD1-CD1 3.4Å; M617-I620 PolarHBondContact O-N 2.82Å; I620-S622 PolarHBondContact O-N 2.87Å; I620-N623 PolarHBondContact O-N 2.92Å; I620-L624 WeakPolarHBondContact O-CB 3.38Å; I620-L624 PolarHBondContact O-N 3.46Å
621	V	92.2	Very high	91.1	Very high	93 Å²	93	91.1 Å²	91.1	56%	0.564	52%	0.515	S	S	*	.	H	α-helix	trans	-64.2	-38.4	178.8	170	0	0	0	0	111.6	M617 T618 S625	M617-V621 WeakPolarHBondContact O-CB 3.21Å; M617-V621 VanDerWaalsContact O-CG2 3.3Å; M617-V621 WeakPolarHBondContact O-CG2 3.47Å; M617-V621 PolarHBondContact O-N 2.95Å; T618-V621 PolarHBondContact O-N 3.14Å; V621-S625 WeakPolarHBondContact O-CB 3.32Å; V621-S625 PolarHBondContact O-N 3.31Å
622	S	87.7	Confident	90.8	Very high	70 Å²	70	93.6 Å²	93.6	49%	0.49	52%	0.524	S	S	.	.	H	α-helix	trans	-66.8	-41.6	177	73.9	0	0	0	0	112.6	T618 Q619 I620 S625 A626	T618-S622 WeakPolarHBondContact O-CB 3.31Å; T618-S622 PolarHBondContact O-N 3.4Å; T618-S622 PolarHBondContact O-OG 3.39Å; Q619-S622 PolarHBondContact O-N 3.5Å; Q619-S622 PolarHBondContact O-OG 2.86Å; I620-S622 PolarHBondContact O-N 2.87Å; S622-S625 WeakPolarHBondContact O-CB 3.43Å; S622-S625 PolarHBondContact O-N 3.24Å; S622-A626 PolarHBondContact O-N 3.23Å
623	N	91.8	Very high	90.4	Very high	106 Å²	106	99 Å²	99	57%	0.567	53%	0.534	S	S	*	.	H	α-helix	trans	-66.2	-45.8	175.4	-172.4	4.5	0	0	0	111.3	Q619 I620 S625 A626 T627	Q619-N623 WeakPolarHBondContact O-CB 3.41Å; Q619-N623 PolarHBondContact O-N 3.43Å; I620-N623 PolarHBondContact O-N 2.92Å; N623-S625 VanDerWaalsContact C-N 3.31Å; N623-S625 PolarHBondContact O-N 3.41Å; N623-A626 WeakPolarHBondContact O-CB 3.37Å; N623-A626 PolarHBondContact O-N 3.12Å; N623-T627 PolarHBondContact O-N 3.27Å; N623-T627 PolarHBondContact O-OG1 3.11Å
624	L	90.2	Very high	90.2	Very high	104 Å²	104	97.4 Å²	97.4	55%	0.545	53%	0.526	S	S	.	.	H	α-helix	trans	-61.7	-39.7	174.6	-173.3	62.1	0	0	0	111.6	I620 A626 T627 V628	I620-L624 WeakPolarHBondContact O-CB 3.38Å; I620-L624 PolarHBondContact O-N 3.46Å; L624-A626 PolarHBondContact O-N 2.76Å; L624-T627 PolarHBondContact O-N 3.18Å; L624-T627 PolarHBondContact O-OG1 2.74Å; L624-V628 HydrophobicContact CD1-CG2 4.36Å; L624-V628 HydrophobicContact CG-CG2 4.41Å; L624-V628 WeakPolarHBondContact O-CB 3.34Å; L624-V628 VanDerWaalsContact O-CG2 3.24Å; L624-V628 WeakPolarHBondContact O-CG2 3.43Å; L624-V628 PolarHBondContact O-N 3.05Å
625	S	91.8	Very high	90.2	Very high	77 Å²	77	95.4 Å²	95.4	54%	0.538	52%	0.519	S	S	.	.	H	α-helix	trans	-60.9	-42.2	174.3	-172.9	0	0	0	0	112	V621 S622 N623 V628 A629	V621-S625 WeakPolarHBondContact O-CB 3.32Å; V621-S625 PolarHBondContact O-N 3.31Å; S622-S625 WeakPolarHBondContact O-CB 3.43Å; S622-S625 PolarHBondContact O-N 3.24Å; N623-S625 VanDerWaalsContact C-N 3.31Å; N623-S625 PolarHBondContact O-N 3.41Å; S625-V628 PolarHBondContact O-N 3.42Å; S625-A629 WeakPolarHBondContact O-CB 3.22Å; S625-A629 PolarHBondContact O-N 3.27Å
626	A	90.8	Very high	90	Very high	60 Å²	60	94.6 Å²	94.6	50%	0.496	52%	0.517	S	S	.	.	H	α-helix	trans	-63.3	-47.2	175.4	0	0	0	0	0	112.4	S622 N623 L624 V628 A629 E630	S622-A626 PolarHBondContact O-N 3.23Å; N623-A626 WeakPolarHBondContact O-CB 3.37Å; N623-A626 PolarHBondContact O-N 3.12Å; L624-A626 PolarHBondContact O-N 2.76Å; A626-V628 PolarHBondContact O-N 3.11Å; A626-A629 PolarHBondContact O-N 3.26Å; A626-E630 PolarHBondContact O-N 3.49Å
627	T	91.1	Very high	89.9	Confident	63 Å²	63	93.8 Å²	93.8	39%	0.387	51%	0.513	S	S	.	.	H	α-helix	trans	-65.2	-37.6	177.1	59.4	0	0	0	0	112.5	N623 L624 E630 L631	N623-T627 PolarHBondContact O-N 3.27Å; N623-T627 PolarHBondContact O-OG1 3.11Å; L624-T627 PolarHBondContact O-N 3.18Å; L624-T627 PolarHBondContact O-OG1 2.74Å; T627-E630 PolarHBondContact O-N 3.47Å; T627-L631 WeakPolarHBondContact O-CB 3.45Å; T627-L631 WeakPolarHBondContact O-CG 3.39Å; T627-L631 PolarHBondContact O-N 3.26Å
628	V	91.6	Very high	89.8	Confident	82 Å²	82	95.1 Å²	95.1	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-67	-37.3	173.8	168.8	0	0	0	0	111.7	L624 S625 A626 E630 K632	L624-V628 HydrophobicContact CD1-CG2 4.36Å; L624-V628 HydrophobicContact CG-CG2 4.41Å; L624-V628 WeakPolarHBondContact O-CB 3.34Å; L624-V628 VanDerWaalsContact O-CG2 3.24Å; L624-V628 WeakPolarHBondContact O-CG2 3.43Å; L624-V628 PolarHBondContact O-N 3.05Å; S625-V628 PolarHBondContact O-N 3.42Å; A626-V628 PolarHBondContact O-N 3.11Å; V628-E630 VanDerWaalsContact C-N 3.33Å; V628-K632 WeakPolarHBondContact O-CB 3.45Å; V628-K632 PolarHBondContact O-N 2.65Å
629	A	89	Confident	89.5	Confident	42 Å²	42	96.5 Å²	96.5	35%	0.347	51%	0.513	S	S	.	.	H	α-helix	trans	-63.8	-38.8	173.9	0	0	0	0	0	111.7	S625 A626 K632 R633	S625-A629 WeakPolarHBondContact O-CB 3.22Å; S625-A629 PolarHBondContact O-N 3.27Å; A626-A629 PolarHBondContact O-N 3.26Å; A629-K632 WeakPolarHBondContact O-CB 3.5Å; A629-K632 PolarHBondContact O-N 3.09Å; A629-R633 PolarHBondContact O-N 3.48Å
630	E	90.8	Very high	89.4	Confident	103 Å²	103	92.7 Å²	92.7	48%	0.481	50%	0.501	S	S	.	.	H	α-helix	trans	-75.4	-42.6	179.2	-161.4	53.9	-148	0	0	112.6	A626 T627 V628 K632 R633 E634	A626-E630 PolarHBondContact O-N 3.49Å; T627-E630 PolarHBondContact O-N 3.47Å; V628-E630 VanDerWaalsContact C-N 3.33Å; E630-K632 PolarHBondContact O-N 3.34Å; E630-R633 WeakPolarHBondContact O-CA 3.45Å; E630-R633 WeakPolarHBondContact O-CB 3.26Å; E630-R633 PolarHBondContact O-N 3.48Å; E630-R633 IonicContact OE2-CZ 3.78Å; E630-R633 IonicContact OE2-NH1 2.76Å; E630-R633 PolarHBondContact OE2-NH1 2.85Å; E630-E634 PolarHBondContact O-N 3.43Å
631	L	87.4	Confident	89.3	Confident	101 Å²	101	94.9 Å²	94.9	53%	0.529	50%	0.504	S	S	.	.	H	α-helix	trans	-56.6	-37.2	168.3	-77	163.6	0	0	0	111.7	T627 E634 V635	T627-L631 WeakPolarHBondContact O-CB 3.45Å; T627-L631 WeakPolarHBondContact O-CG 3.39Å; T627-L631 PolarHBondContact O-N 3.26Å; L631-E634 PolarHBondContact O-N 3.17Å; L631-V635 WeakPolarHBondContact O-CB 3.19Å; L631-V635 VanDerWaalsContact O-CG2 3.27Å; L631-V635 WeakPolarHBondContact O-CG2 3.4Å; L631-V635 PolarHBondContact O-N 2.63Å
632	K	84.7	Confident	89.2	Confident	160 Å²	160	95.7 Å²	95.7	70%	0.696	51%	0.505	S	S	*	.	H	α-helix	trans	-67.7	-36.7	174.6	-176.4	-178	177.3	-173.2	0	112	V628 A629 E630 S636	V628-K632 WeakPolarHBondContact O-CB 3.45Å; V628-K632 PolarHBondContact O-N 2.65Å; A629-K632 WeakPolarHBondContact O-CB 3.5Å; A629-K632 PolarHBondContact O-N 3.09Å; E630-K632 PolarHBondContact O-N 3.34Å; K632-S636 WeakPolarHBondContact O-CB 3.22Å; K632-S636 PolarHBondContact O-N 3.43Å
633	R	85.1	Confident	89.5	Confident	159 Å²	159	96.5 Å²	96.5	60%	0.6	51%	0.506	S	S	*	.	H	α-helix	trans	-63.9	-51.6	170.6	-72.5	-168.7	-176.5	100	1.9	111.3	A629 E630 V635 S636 D637	A629-R633 PolarHBondContact O-N 3.48Å; E630-R633 WeakPolarHBondContact O-CA 3.45Å; E630-R633 WeakPolarHBondContact O-CB 3.26Å; E630-R633 PolarHBondContact O-N 3.48Å; E630-R633 IonicContact OE2-CZ 3.78Å; E630-R633 IonicContact OE2-NH1 2.76Å; E630-R633 PolarHBondContact OE2-NH1 2.85Å; R633-V635 VanDerWaalsContact C-N 3.32Å; R633-V635 PolarHBondContact O-N 3.23Å; R633-S636 CarbonylContact O-C 3.54Å; R633-S636 WeakPolarHBondContact O-CB 3.46Å; R633-S636 PolarHBondContact O-N 2.83Å; R633-D637 PolarHBondContact O-N 3.36Å
634	E	89.1	Confident	89.6	Confident	89 Å²	89	97.2 Å²	97.2	42%	0.416	51%	0.508	S	S	.	.	H	α-helix	trans	-60.2	-40.5	-178.3	-161.1	-155.5	-160.6	0	0	112.1	E630 L631 R638	E630-E634 PolarHBondContact O-N 3.43Å; L631-E634 PolarHBondContact O-N 3.17Å; E634-R638 VanDerWaalsContact CD-CZ 3.42Å; E634-R638 VanDerWaalsContact CD-NH2 3.27Å; E634-R638 WeakPolarHBondContact O-CG 3.44Å; E634-R638 PolarHBondContact O-N 2.92Å; E634-R638 VanDerWaalsContact O-N 3.11Å; E634-R638 IonicContact OE1-CZ 3.52Å; E634-R638 VanDerWaalsContact OE1-CZ 3.27Å; E634-R638 IonicContact OE1-NH1 2.68Å; E634-R638 PolarHBondContact OE1-NH1 3.5Å; E634-R638 IonicContact OE1-NH2 3.63Å; E634-R638 PolarHBondContact OE1-NH2 2.93Å; E634-R638 IonicContact OE2-CZ 3.69Å; E634-R638 IonicContact OE2-NH1 2.73Å; E634-R638 PolarHBondContact OE2-NH1 2.96Å; E634-R638 IonicContact OE2-NH2 3.22Å
635	V	89.3	Confident	89.7	Confident	78 Å²	78	95.3 Å²	95.3	47%	0.473	50%	0.503	S	S	.	.	H	α-helix	trans	-68.4	-41.7	173	171.1	0	0	0	0	111.5	L631 R633 D637 R638 Q639	L631-V635 WeakPolarHBondContact O-CB 3.19Å; L631-V635 VanDerWaalsContact O-CG2 3.27Å; L631-V635 WeakPolarHBondContact O-CG2 3.4Å; L631-V635 PolarHBondContact O-N 2.63Å; R633-V635 VanDerWaalsContact C-N 3.32Å; R633-V635 PolarHBondContact O-N 3.23Å; V635-D637 VanDerWaalsContact C-N 3.34Å; V635-D637 PolarHBondContact O-N 3.12Å; V635-R638 PolarHBondContact O-N 3.44Å; V635-Q639 WeakPolarHBondContact O-CG 3.5Å; V635-Q639 PolarHBondContact O-N 3.45Å
636	S	87.3	Confident	89.8	Confident	77 Å²	77	97.2 Å²	97.2	54%	0.538	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-39.5	177.4	-170.2	0	0	0	0	112.2	K632 R633 Q639 S640	K632-S636 WeakPolarHBondContact O-CB 3.22Å; K632-S636 PolarHBondContact O-N 3.43Å; R633-S636 CarbonylContact O-C 3.54Å; R633-S636 WeakPolarHBondContact O-CB 3.46Å; R633-S636 PolarHBondContact O-N 2.83Å; S636-Q639 PolarHBondContact O-N 2.98Å; S636-S640 WeakPolarHBondContact O-CB 3.38Å; S636-S640 PolarHBondContact O-N 3.4Å
637	D	88.9	Confident	90	Very high	75 Å²	75	97.9 Å²	97.9	40%	0.401	51%	0.505	S	S	.	.	H	α-helix	trans	-69.9	-41.9	178.9	-159.5	35.8	0	0	0	110.8	R633 V635 Q639 S640 Y641	R633-D637 PolarHBondContact O-N 3.36Å; V635-D637 VanDerWaalsContact C-N 3.34Å; V635-D637 PolarHBondContact O-N 3.12Å; D637-Q639 VanDerWaalsContact C-N 3.31Å; D637-Q639 PolarHBondContact O-N 3.35Å; D637-S640 WeakPolarHBondContact O-CA 3.12Å; D637-S640 VanDerWaalsContact O-CB 3.26Å; D637-S640 WeakPolarHBondContact O-CB 3.47Å; D637-S640 PolarHBondContact O-N 3.06Å; D637-Y641 HydrophobicContact CB-CE2 4.39Å; D637-Y641 VanDerWaalsContact CG-CE2 3.44Å; D637-Y641 WeakPolarHBondContact O-CD2 3.46Å; D637-Y641 PolarHBondContact O-N 3.34Å; D637-Y641 WeakPolarHBondContact OD2-CE2 3.42Å; D637-Y641 PolarHBondContact OD2-OH 2.94Å
638	R	89.1	Confident	90.2	Very high	133 Å²	133	99.7 Å²	99.7	50%	0.502	51%	0.511	S	S	.	.	H	α-helix	trans	-58	-39.1	169.9	-75	-178	-178.8	122.7	7.7	113.2	E634 V635 L642	E634-R638 VanDerWaalsContact CD-CZ 3.42Å; E634-R638 VanDerWaalsContact CD-NH2 3.27Å; E634-R638 WeakPolarHBondContact O-CG 3.44Å; E634-R638 PolarHBondContact O-N 2.92Å; E634-R638 VanDerWaalsContact O-N 3.11Å; E634-R638 IonicContact OE1-CZ 3.52Å; E634-R638 VanDerWaalsContact OE1-CZ 3.27Å; E634-R638 IonicContact OE1-NH1 2.68Å; E634-R638 PolarHBondContact OE1-NH1 3.5Å; E634-R638 IonicContact OE1-NH2 3.63Å; E634-R638 PolarHBondContact OE1-NH2 2.93Å; E634-R638 IonicContact OE2-CZ 3.69Å; E634-R638 IonicContact OE2-NH1 2.73Å; E634-R638 PolarHBondContact OE2-NH1 2.96Å; E634-R638 IonicContact OE2-NH2 3.22Å; V635-R638 PolarHBondContact O-N 3.44Å; R638-L642 WeakPolarHBondContact O-CG 3.42Å; R638-L642 PolarHBondContact O-N 3.48Å
639	Q	86.3	Confident	90.3	Very high	113 Å²	113	99.6 Å²	99.6	53%	0.528	51%	0.514	S	S	.	.	H	α-helix	trans	-68.4	-39	173.2	-66.9	-62.4	-33.2	0	0	111.5	V635 S636 D637 L642 V643	V635-Q639 WeakPolarHBondContact O-CG 3.5Å; V635-Q639 PolarHBondContact O-N 3.45Å; S636-Q639 PolarHBondContact O-N 2.98Å; D637-Q639 VanDerWaalsContact C-N 3.31Å; D637-Q639 PolarHBondContact O-N 3.35Å; Q639-L642 PolarHBondContact O-N 3.23Å; Q639-V643 WeakPolarHBondContact O-CG2 3.39Å; Q639-V643 PolarHBondContact O-N 3.02Å
640	S	89.5	Confident	90.6	Very high	59 Å²	59	101.7 Å²	101.7	41%	0.413	52%	0.522	S	S	.	.	H	α-helix	trans	-57.2	-50.9	175	-168.5	0	0	0	0	111.8	S636 D637 L642 V643 M644	S636-S640 WeakPolarHBondContact O-CB 3.38Å; S636-S640 PolarHBondContact O-N 3.4Å; D637-S640 WeakPolarHBondContact O-CA 3.12Å; D637-S640 VanDerWaalsContact O-CB 3.26Å; D637-S640 WeakPolarHBondContact O-CB 3.47Å; D637-S640 PolarHBondContact O-N 3.06Å; S640-L642 VanDerWaalsContact C-N 3.3Å; S640-L642 PolarHBondContact O-N 3.32Å; S640-V643 PolarHBondContact O-N 3.46Å; S640-V643 VanDerWaalsContact O-N 3.16Å; S640-M644 WeakPolarHBondContact O-CG 3.45Å; S640-M644 PolarHBondContact O-N 3.12Å
641	Y	92.3	Very high	90.8	Very high	149 Å²	149	100.2 Å²	100.2	58%	0.584	52%	0.52	S	S	*	.	H	α-helix	trans	-60.3	-36	176.4	-67.1	-62.8	0	0	0	113.3	D637 S645	D637-Y641 HydrophobicContact CB-CE2 4.39Å; D637-Y641 VanDerWaalsContact CG-CE2 3.44Å; D637-Y641 WeakPolarHBondContact O-CD2 3.46Å; D637-Y641 PolarHBondContact O-N 3.34Å; D637-Y641 WeakPolarHBondContact OD2-CE2 3.42Å; D637-Y641 PolarHBondContact OD2-OH 2.94Å; Y641-S645 WeakPolarHBondContact O-CB 3.5Å; Y641-S645 PolarHBondContact O-N 3.34Å
642	L	90.6	Very high	91.1	Very high	110 Å²	110	100 Å²	100	58%	0.576	52%	0.519	S	S	*	.	H	α-helix	trans	-67.3	-40.5	176.1	-71.4	172.1	0	0	0	111.9	R638 Q639 S640 L646	R638-L642 WeakPolarHBondContact O-CG 3.42Å; R638-L642 PolarHBondContact O-N 3.48Å; Q639-L642 PolarHBondContact O-N 3.23Å; S640-L642 VanDerWaalsContact C-N 3.3Å; S640-L642 PolarHBondContact O-N 3.32Å; L642-L646 WeakPolarHBondContact O-CB 3.5Å; L642-L646 PolarHBondContact O-N 3.12Å
643	V	93.5	Very high	91.6	Very high	86 Å²	86	93.9 Å²	93.9	52%	0.521	50%	0.501	S	S	.	.	H	α-helix	trans	-66.8	-45.7	174.7	173.8	0	0	0	0	111	Q639 S640 S645 L646 V647	Q639-V643 WeakPolarHBondContact O-CG2 3.39Å; Q639-V643 PolarHBondContact O-N 3.02Å; S640-V643 PolarHBondContact O-N 3.46Å; S640-V643 VanDerWaalsContact O-N 3.16Å; V643-S645 VanDerWaalsContact C-N 3.32Å; V643-S645 PolarHBondContact O-N 3.26Å; V643-L646 WeakPolarHBondContact O-CB 3.28Å; V643-L646 PolarHBondContact O-N 3.33Å; V643-V647 WeakPolarHBondContact O-CG2 3.42Å; V643-V647 PolarHBondContact O-N 2.84Å
644	M	92.4	Very high	91.9	Very high	121 Å²	121	91.4 Å²	91.4	60%	0.596	50%	0.499	S	S	*	.	H	α-helix	trans	-63.2	-37.8	177.5	-68.5	-59.5	-69.3	0	0	112.1	S640 V647 L648	S640-M644 WeakPolarHBondContact O-CG 3.45Å; S640-M644 PolarHBondContact O-N 3.12Å; M644-V647 PolarHBondContact O-N 3.03Å; M644-L648 WeakPolarHBondContact O-CB 3.5Å; M644-L648 PolarHBondContact O-N 3.15Å
645	S	92.4	Very high	91.9	Very high	64 Å²	64	93.1 Å²	93.1	45%	0.448	51%	0.508	S	S	.	.	H	α-helix	trans	-64.5	-42.3	172.9	-175.5	0	0	0	0	112.1	Y641 V643 L648 C649	Y641-S645 WeakPolarHBondContact O-CB 3.5Å; Y641-S645 PolarHBondContact O-N 3.34Å; V643-S645 VanDerWaalsContact C-N 3.32Å; V643-S645 PolarHBondContact O-N 3.26Å; S645-L648 PolarHBondContact O-N 3.41Å; S645-C649 PolarHBondContact O-N 2.94Å; S645-C649 PolarHBondContact O-SG 3.47Å
646	L	94.6	Very high	92.1	Very high	118 Å²	118	94.5 Å²	94.5	62%	0.618	51%	0.513	S	S	*	.	H	α-helix	trans	-60.8	-46.7	174	-170.4	84.3	0	0	0	111.5	L642 V643 L648 C649 V650	L642-L646 WeakPolarHBondContact O-CB 3.5Å; L642-L646 PolarHBondContact O-N 3.12Å; V643-L646 WeakPolarHBondContact O-CB 3.28Å; V643-L646 PolarHBondContact O-N 3.33Å; L646-L648 PolarHBondContact O-N 2.83Å; L646-C649 WeakPolarHBondContact O-CB 3.31Å; L646-C649 PolarHBondContact O-N 3.13Å; L646-V650 WeakPolarHBondContact O-CG2 3.42Å; L646-V650 PolarHBondContact O-N 3.12Å
647	V	95.5	Very high	92.1	Very high	74 Å²	74	94.4 Å²	94.4	45%	0.448	51%	0.511	S	S	.	.	H	α-helix	trans	-61	-44.4	177.2	171.6	0	0	0	0	110.8	V643 M644 C649 V650 V651	V643-V647 WeakPolarHBondContact O-CG2 3.42Å; V643-V647 PolarHBondContact O-N 2.84Å; M644-V647 PolarHBondContact O-N 3.03Å; V647-C649 VanDerWaalsContact C-N 3.33Å; V647-C649 PolarHBondContact O-N 2.84Å; V647-V650 PolarHBondContact O-N 3Å; V647-V651 HydrophobicContact CG1-CG2 4.4Å; V647-V651 WeakPolarHBondContact O-CG2 3.42Å; V647-V651 PolarHBondContact O-N 3.4Å
648	L	94.8	Very high	92	Very high	101 Å²	101	97.1 Å²	97.1	53%	0.529	52%	0.523	S	S	.	.	H	α-helix	trans	-60	-42.1	175.1	-175.5	65.8	0	0	0	111.8	M644 S645 L646 V650 V651 L652	M644-L648 WeakPolarHBondContact O-CB 3.5Å; M644-L648 PolarHBondContact O-N 3.15Å; S645-L648 PolarHBondContact O-N 3.41Å; L646-L648 PolarHBondContact O-N 2.83Å; L648-V650 VanDerWaalsContact C-N 3.35Å; L648-V650 PolarHBondContact O-N 2.98Å; L648-V651 PolarHBondContact O-N 3.34Å; L648-L652 HydrophobicContact CD1-CD1 4.46Å; L648-L652 HydrophobicContact CD1-CG 4.47Å; L648-L652 HydrophobicContact CG-CD1 4.09Å; L648-L652 WeakPolarHBondContact O-CB 3.16Å; L648-L652 VanDerWaalsContact O-CG 3.29Å; L648-L652 WeakPolarHBondContact O-CG 3.22Å; L648-L652 PolarHBondContact O-N 3.21Å
649	C	94.6	Very high	91.8	Very high	80 Å²	80	96.3 Å²	96.3	54%	0.541	53%	0.525	S	S	.	.	H	α-helix	trans	-62	-40.4	175.2	-67.5	0	0	0	0	112.3	S645 L646 V647 G653	S645-C649 PolarHBondContact O-N 2.94Å; S645-C649 PolarHBondContact O-SG 3.47Å; L646-C649 WeakPolarHBondContact O-CB 3.31Å; L646-C649 PolarHBondContact O-N 3.13Å; V647-C649 VanDerWaalsContact C-N 3.33Å; V647-C649 PolarHBondContact O-N 2.84Å; C649-G653 PolarHBondContact O-N 3.32Å
650	V	94.9	Very high	91.6	Very high	85 Å²	85	100.9 Å²	100.9	52%	0.515	54%	0.537	S	S	.	.	H	α-helix	trans	-66.3	-44.8	175.5	172.6	0	0	0	0	111.1	L646 V647 L648 G653 L654	L646-V650 WeakPolarHBondContact O-CG2 3.42Å; L646-V650 PolarHBondContact O-N 3.12Å; V647-V650 PolarHBondContact O-N 3Å; L648-V650 VanDerWaalsContact C-N 3.35Å; L648-V650 PolarHBondContact O-N 2.98Å; V650-G653 PolarHBondContact O-N 3.31Å; V650-L654 HydrophobicContact CG1-CD1 4.13Å; V650-L654 HydrophobicContact CG1-CG 4.47Å; V650-L654 WeakPolarHBondContact O-CG 3.4Å; V650-L654 PolarHBondContact O-N 3.46Å
651	V	94.9	Very high	91	Very high	73 Å²	73	101.7 Å²	101.7	44%	0.442	54%	0.542	S	S	.	.	H	α-helix	trans	-61.9	-45.2	177	171.3	0	0	0	0	111.2	V647 L648 G653 L654 M655	V647-V651 HydrophobicContact CG1-CG2 4.4Å; V647-V651 WeakPolarHBondContact O-CG2 3.42Å; V647-V651 PolarHBondContact O-N 3.4Å; L648-V651 PolarHBondContact O-N 3.34Å; V651-G653 VanDerWaalsContact C-N 3.34Å; V651-G653 PolarHBondContact O-N 3.3Å; V651-L654 PolarHBondContact O-N 3.46Å; V651-M655 HydrophobicContact CG1-CG 4.43Å; V651-M655 WeakPolarHBondContact O-CB 3.37Å; V651-M655 VanDerWaalsContact O-CG 3.3Å; V651-M655 WeakPolarHBondContact O-CG 3.33Å; V651-M655 PolarHBondContact O-N 3.09Å
652	L	93.9	Very high	90.2	Very high	97 Å²	97	103.9 Å²	103.9	51%	0.508	55%	0.549	S	S	.	.	H	α-helix	trans	-63	-39.7	175	-70.4	171.8	0	0	0	111.8	L648 M655 L656	L648-L652 HydrophobicContact CD1-CD1 4.46Å; L648-L652 HydrophobicContact CD1-CG 4.47Å; L648-L652 HydrophobicContact CG-CD1 4.09Å; L648-L652 WeakPolarHBondContact O-CB 3.16Å; L648-L652 VanDerWaalsContact O-CG 3.29Å; L648-L652 WeakPolarHBondContact O-CG 3.22Å; L648-L652 PolarHBondContact O-N 3.21Å; L652-M655 PolarHBondContact O-N 2.91Å; L652-L656 WeakPolarHBondContact O-CB 3.42Å; L652-L656 VanDerWaalsContact O-CG 3.3Å; L652-L656 WeakPolarHBondContact O-CG 3.49Å; L652-L656 PolarHBondContact O-N 3.36Å
653	G	93.8	Very high	88.9	Confident	31 Å²	31	103.4 Å²	103.4	32%	0.32	55%	0.547	S	S	.	.	H	α-helix	trans	-60.1	-45.6	173	0	0	0	0	0	112.8	C649 V650 V651 L656 C657	C649-G653 PolarHBondContact O-N 3.32Å; V650-G653 PolarHBondContact O-N 3.31Å; V651-G653 VanDerWaalsContact C-N 3.34Å; V651-G653 PolarHBondContact O-N 3.3Å; G653-L656 PolarHBondContact O-N 2.86Å; G653-C657 PolarHBondContact O-N 3.47Å; G653-C657 PolarHBondContact O-SG 3.14Å
654	L	92.3	Very high	87	Confident	107 Å²	107	104.5 Å²	104.5	56%	0.56	56%	0.555	S	S	*	*	H	α-helix	trans	-64.4	-43	175.6	-71.4	172.5	0	0	0	111.9	V650 V651 L656 C657 M658	V650-L654 HydrophobicContact CG1-CD1 4.13Å; V650-L654 HydrophobicContact CG1-CG 4.47Å; V650-L654 WeakPolarHBondContact O-CG 3.4Å; V650-L654 PolarHBondContact O-N 3.46Å; V651-L654 PolarHBondContact O-N 3.46Å; L654-L656 PolarHBondContact O-N 2.82Å; L654-C657 WeakPolarHBondContact O-CB 3.48Å; L654-C657 PolarHBondContact O-N 3.17Å; L654-M658 WeakPolarHBondContact O-CB 3.23Å; L654-M658 WeakPolarHBondContact O-CG 3.5Å; L654-M658 PolarHBondContact O-N 3.23Å
655	M	90.1	Very high	85.1	Confident	125 Å²	125	102.8 Å²	102.8	62%	0.616	55%	0.554	S	S	*	*	H	α-helix	trans	-63.2	-40.7	176.4	-71.3	-62.4	-71.9	0	0	111.9	V651 L652 M658 Q659	V651-M655 HydrophobicContact CG1-CG 4.43Å; V651-M655 WeakPolarHBondContact O-CB 3.37Å; V651-M655 VanDerWaalsContact O-CG 3.3Å; V651-M655 WeakPolarHBondContact O-CG 3.33Å; V651-M655 PolarHBondContact O-N 3.09Å; L652-M655 PolarHBondContact O-N 2.91Å; M655-M658 PolarHBondContact O-N 3.25Å; M655-Q659 VanDerWaalsContact O-CB 3.32Å; M655-Q659 WeakPolarHBondContact O-CB 3.24Å; M655-Q659 PolarHBondContact O-N 2.77Å
656	L	91.5	Very high	83.1	Confident	107 Å²	107	107.6 Å²	107.6	56%	0.56	57%	0.57	S	S	*	*	H	α-helix	trans	-65.8	-38.1	173.2	-72.5	170.8	0	0	0	112.2	L652 G653 L654 Q659 R660	L652-L656 WeakPolarHBondContact O-CB 3.42Å; L652-L656 VanDerWaalsContact O-CG 3.3Å; L652-L656 WeakPolarHBondContact O-CG 3.49Å; L652-L656 PolarHBondContact O-N 3.36Å; G653-L656 PolarHBondContact O-N 2.86Å; L654-L656 PolarHBondContact O-N 2.82Å; L656-Q659 PolarHBondContact O-N 2.96Å; L656-R660 WeakPolarHBondContact O-CB 3.2Å; L656-R660 WeakPolarHBondContact O-CG 3.38Å; L656-R660 PolarHBondContact O-N 3.2Å
657	C	89.1	Confident	80.8	Confident	75 Å²	75	111.4 Å²	111.4	51%	0.507	58%	0.582	S	S	.	*	H	α-helix	trans	-64.2	-46.2	173.4	-68.8	0	0	0	0	111.5	G653 L654 Q659 R660 C661	G653-C657 PolarHBondContact O-N 3.47Å; G653-C657 PolarHBondContact O-SG 3.14Å; L654-C657 WeakPolarHBondContact O-CB 3.48Å; L654-C657 PolarHBondContact O-N 3.17Å; C657-Q659 VanDerWaalsContact C-N 3.34Å; C657-Q659 PolarHBondContact O-N 3.43Å; C657-R660 WeakPolarHBondContact O-CB 3.28Å; C657-R660 PolarHBondContact O-N 3.15Å; C657-C661 PolarHBondContact O-N 3.28Å; C657-C661 PolarHBondContact O-SG 2.84Å
658	M	86.7	Confident	78.5	Confident	131 Å²	131	115.5 Å²	115.5	65%	0.645	60%	0.601	S	S	*	*	H	α-helix	trans	-62.8	-39.4	176.4	-71.5	-60.9	-73	0	0	111.8	L654 M655 C661 R662	L654-M658 WeakPolarHBondContact O-CB 3.23Å; L654-M658 WeakPolarHBondContact O-CG 3.5Å; L654-M658 PolarHBondContact O-N 3.23Å; M655-M658 PolarHBondContact O-N 3.25Å; M658-C661 PolarHBondContact O-N 2.8Å; M658-R662 WeakPolarHBondContact O-CB 3.33Å; M658-R662 PolarHBondContact O-N 2.86Å
659	Q	84.7	Confident	76.2	Confident	117 Å²	117	113.8 Å²	113.8	55%	0.547	61%	0.608	S	S	.	*	H	α-helix	trans	-69.8	-36.3	175.9	-167	172.6	13.7	0	0	112.2	M655 L656 C657 R662 N663	M655-Q659 VanDerWaalsContact O-CB 3.32Å; M655-Q659 WeakPolarHBondContact O-CB 3.24Å; M655-Q659 PolarHBondContact O-N 2.77Å; L656-Q659 PolarHBondContact O-N 2.96Å; C657-Q659 VanDerWaalsContact C-N 3.34Å; C657-Q659 PolarHBondContact O-N 3.43Å; Q659-R662 PolarHBondContact O-N 3.44Å; Q659-N663 WeakPolarHBondContact O-CB 3.19Å; Q659-N663 VanDerWaalsContact O-CG 3.29Å; Q659-N663 PolarHBondContact O-N 3.13Å; Q659-N663 PolarHBondContact O-OD1 2.87Å
660	R	81	Confident	73.8	Confident	208 Å²	208	117.6 Å²	117.6	79%	0.785	62%	0.623	S	S	*	*	H	α-helix	trans	-61.4	-45.9	170.1	-73.4	-80.3	-178.3	134.9	1.2	111.4	L656 C657 N663 T664	L656-R660 WeakPolarHBondContact O-CB 3.2Å; L656-R660 WeakPolarHBondContact O-CG 3.38Å; L656-R660 PolarHBondContact O-N 3.2Å; C657-R660 WeakPolarHBondContact O-CB 3.28Å; C657-R660 PolarHBondContact O-N 3.15Å; R660-N663 PolarHBondContact O-N 3.33Å; R660-T664 PolarHBondContact O-N 2.81Å
661	C	77.8	Confident	71.2	Confident	77 Å²	77	124.7 Å²	124.7	52%	0.52	64%	0.642	S	S	.	*	H	α-helix	trans	-63.5	-42.7	176.6	-63.4	0	0	0	0	111.7	C657 M658 N663 T664 S665	C657-C661 PolarHBondContact O-N 3.28Å; C657-C661 PolarHBondContact O-SG 2.84Å; M658-C661 PolarHBondContact O-N 2.8Å; C661-N663 PolarHBondContact O-N 3.04Å; C661-T664 WeakPolarHBondContact O-CG2 3.41Å; C661-T664 PolarHBondContact O-N 2.83Å; C661-S665 PolarHBondContact O-N 2.87Å; C661-S665 PolarHBondContact O-OG 2.69Å
662	R	74.7	Confident	68.5	Low	194 Å²	194	128.2 Å²	128.2	73%	0.732	66%	0.664	S	S	*	*	H	α-helix	trans	-72.3	-28.9	-179.7	-151.1	173.4	86.5	164	7.2	113.6	M658 Q659 S665	M658-R662 WeakPolarHBondContact O-CB 3.33Å; M658-R662 PolarHBondContact O-N 2.86Å; Q659-R662 PolarHBondContact O-N 3.44Å; R662-S665 WeakPolarHBondContact CA-OG 3.43Å; R662-S665 PolarHBondContact O-OG 3.03Å
663	N	63	Low	66.1	Low	100 Å²	100	128.8 Å²	128.8	54%	0.535	68%	0.676	S	S	.	*	H	α-helix	trans	-73.6	-32.7	171.6	-74.4	18	0	0	0	111.7	Q659 R660 C661 S665 Q666	Q659-N663 WeakPolarHBondContact O-CB 3.19Å; Q659-N663 VanDerWaalsContact O-CG 3.29Å; Q659-N663 PolarHBondContact O-N 3.13Å; Q659-N663 PolarHBondContact O-OD1 2.87Å; R660-N663 PolarHBondContact O-N 3.33Å; C661-N663 PolarHBondContact O-N 3.04Å; N663-S665 VanDerWaalsContact C-N 3.34Å; N663-Q666 PolarHBondContact O-N 2.66Å
664	T	55.2	Low	63.3	Low	110 Å²	110	137.3 Å²	137.3	68%	0.675	70%	0.704	S	S	*	*	H	α-helix	trans	-70.5	-30.5	175.9	-139.4	0	0	0	0	112.4	R660 C661 Q666	R660-T664 PolarHBondContact O-N 2.81Å; C661-T664 WeakPolarHBondContact O-CG2 3.41Å; C661-T664 PolarHBondContact O-N 2.83Å; T664-Q666 PolarHBondContact O-N 3.37Å
665	S	52.1	Low	60.6	Low	85 Å²	85	139.5 Å²	139.5	59%	0.594	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	0.4	175	58.2	0	0	0	0	114.7	C661 R662 N663	C661-S665 PolarHBondContact O-N 2.87Å; C661-S665 PolarHBondContact O-OG 2.69Å; R662-S665 WeakPolarHBondContact CA-OG 3.43Å; R662-S665 PolarHBondContact O-OG 3.03Å; N663-S665 VanDerWaalsContact C-N 3.34Å
666	Q	50.7	Low	58.5	Low	165 Å²	165	139 Å²	139	77%	0.771	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	7.7	178.6	-151.2	175.4	25.6	0	0	113.1	N663 T664	N663-Q666 PolarHBondContact O-N 2.66Å; T664-Q666 PolarHBondContact O-N 3.37Å
667	F	46.8	Very low	55.6	Low	197 Å²	197	142.8 Å²	142.8	86%	0.864	73%	0.734	S	S	*	*	S	Bend	trans	-118.9	9.6	-176.7	-142	-92.4	0	0	0	114.1
668	D	45.8	Very low	52.7	Low	160 Å²	160	145 Å²	145	86%	0.856	75%	0.75	S	S	*	*	S	Bend	trans	-129.1	81.9	177.7	-159.1	5.1	0	0	0	109.9
669	G	46.2	Very low	50.1	Low	66 Å²	66	145.2 Å²	145.2	68%	0.68	75%	0.754	S	S	*	*	S	Bend	trans	177.2	137.3	-176.1	0	0	0	0	0	111
670	D	43.9	Very low	47.7	Very low	159 Å²	159	148.2 Å²	148.2	85%	0.85	77%	0.768	S	S	*	*	S	Bend	trans	52.7	71.9	173.4	-65.5	-23.9	0	0	0	118.1
671	Y	41	Very low	45.2	Very low	234 Å²	234	148.1 Å²	148.1	92%	0.918	77%	0.769	S	S	*	*			trans	-158.4	39.9	143.5	-111.3	-61.1	0	0	0	117.4
672	T	38.4	Very low	43.5	Very low	148 Å²	148	149.9 Å²	149.9	91%	0.908	78%	0.78	S	S	*	*			trans	-147.8	79.6	166.5	34.3	0	0	0	0	114.9
673	S	43	Very low	41.7	Very low	109 Å²	109	145.2 Å²	145.2	76%	0.762	78%	0.777	S	S	*	*			trans	-152.2	92.4	158.8	60	0	0	0	0	115.2
674	K	35.2	Very low	41	Very low	209 Å²	209	145.3 Å²	145.3	91%	0.909	78%	0.783	S	S	*	*			trans	171.9	126.3	136.3	-93	151.1	-170.5	170.7	0	112.2
675	L	36.3	Very low	40	Very low	153 Å²	153	148.6 Å²	148.6	80%	0.801	79%	0.788	S	S	*	*			trans	-84.6	167	162.5	-136.9	80.4	0	0	0	108.8
676	P	44.5	Very low	39.2	Very low	116 Å²	116	155.5 Å²	155.5	75%	0.753	80%	0.801	S	S	*	*				-150.5	146.4	68.1	37	-15.9	0	0	0	119
677	K	32.4	Very low	38.3	Very low	186 Å²	186	153.3 Å²	153.3	81%	0.809	80%	0.803	S	S	*	*			trans	49.1	123.6	141.4	-64.9	-179.7	176.3	178.3	0	121.9
678	S	27.9	Very low	37.5	Very low	120 Å²	120	153.5 Å²	153.5	84%	0.839	80%	0.803	S	S	*	*				-153.5	170.4	113.2	-161.1	0	0	0	0	110.8
679	N	32.3	Very low	36.8	Very low	137 Å²	137	151.3 Å²	151.3	73%	0.733	80%	0.801	S	S	*	*			trans	-109.8	151.5	-168	-45.6	-51.8	0	0	0	113.2
680	Q	33.6	Very low	36.4	Very low	179 Å²	179	153.1 Å²	153.1	84%	0.836	80%	0.803	S	S	*	*				-175.7	155.1	112.6	-150.8	60.1	3.6	0	0	112.9
681	Y	27.9	Very low	35.9	Very low	207 Å²	207	154.9 Å²	154.9	81%	0.812	80%	0.799	S	S	*	*			trans	-77.7	174.5	169.3	-116.5	-125.4	0	0	0	111.9
682	P	43	Very low	35.7	Very low	114 Å²	114	150.3 Å²	150.3	74%	0.74	79%	0.79	S	S	*	*			cis	-135.6	175.9	10.8	43.3	-26.7	0	0	0	117.1
683	S	37.6	Very low	35.4	Very low	95 Å²	95	149.7 Å²	149.7	66%	0.664	78%	0.782	S	S	*	*			trans	-98.6	169.6	160.6	65	0	0	0	0	111.2
684	P	46.9	Very low	35	Very low	103 Å²	103	151.7 Å²	151.7	67%	0.669	78%	0.781	S	S	*	*				-162.5	174	93.9	42.3	-22.1	0	0	0	119.3
685	K	35.2	Very low	34.9	Very low	178 Å²	178	148.9 Å²	148.9	77%	0.774	78%	0.775	S	S	*	*			trans	102.5	108.5	152.5	-63.2	169.8	-174.6	173.1	0	120.5
686	R	34.6	Very low	34.8	Very low	230 Å²	230	148.7 Å²	148.7	87%	0.868	77%	0.774	S	S	*	*				51.2	141.8	123.8	-68	178	-178.9	150.9	1.6	119.9
687	C	32.3	Very low	34.4	Very low	120 Å²	120	152.1 Å²	152.1	81%	0.811	78%	0.778	S	S	*	*			cis	-145.6	-177.8	17.8	-124	0	0	0	0	114.4
688	F	29.1	Very low	34.7	Very low	200 Å²	200	155.4 Å²	155.4	88%	0.877	79%	0.785	S	S	*	*			trans	-86	157.7	-171.2	-94.1	-104.2	0	0	0	116.1
689	S	31.5	Very low	35	Very low	114 Å²	114	160.8 Å²	160.8	80%	0.797	79%	0.787	S	S	*	*			trans	61.7	156.9	154.2	-98.8	0	0	0	0	118.9
690	S	38.5	Very low	35.1	Very low	104 Å²	104	160.7 Å²	160.7	73%	0.727	79%	0.791	S	S	*	*			cis	-143.8	163.6	9.9	-170.7	0	0	0	0	112
691	Y	33.2	Very low	35.2	Very low	196 Å²	196	157 Å²	157	77%	0.769	79%	0.785	S	S	*	*			trans	-58.7	159	151.5	-86.5	-126.3	0	0	0	109.6
692	D	35.6	Very low	35.7	Very low	138 Å²	138	156.2 Å²	156.2	74%	0.738	79%	0.787	S	S	*	*			cis	-155.8	177.3	30.4	-137.4	-37.2	0	0	0	114.7
693	D	33.4	Very low	36.2	Very low	136 Å²	136	155.9 Å²	155.9	73%	0.727	78%	0.784	S	S	*	*			trans	94.7	137.3	147.4	-146	34	0	0	0	123.7
694	M	35.2	Very low	35.9	Very low	151 Å²	151	158.5 Å²	158.5	74%	0.744	79%	0.79	S	S	*	*			trans	31.6	114.3	171.9	-71.6	-49.2	-65.7	0	0	124.5
695	N	32.7	Very low	35.2	Very low	149 Å²	149	160.1 Å²	160.1	80%	0.797	79%	0.792	S	S	*	*			trans	-51.6	136.3	158.8	-84.2	-91.7	0	0	0	115.1
696	L	34	Very low	35	Very low	149 Å²	149	162.6 Å²	162.6	78%	0.78	80%	0.796	S	S	*	*			trans	-154.5	145.9	144.6	-147	76.6	0	0	0	113.4
697	K	35.7	Very low	34.9	Very low	188 Å²	188	157.1 Å²	157.1	82%	0.817	79%	0.793	S	S	*	*			trans	63.7	105.1	169.1	-64.7	164	-175.9	163	0	117.4
698	R	37.8	Very low	35	Very low	256 Å²	256	161 Å²	161	97%	0.966	80%	0.796	S	S	*	*			trans	-93.6	129.7	147.4	-151.7	-176.7	-61.5	167.3	1.6	108.3
699	R	34.1	Very low	35.2	Very low	232 Å²	232	156.8 Å²	156.8	88%	0.875	79%	0.792	S	S	*	*			trans	-148.6	136.1	177.6	-163.5	-173.4	-161.2	-166.6	7.1	109.8
700	T	35	Very low	35.2	Very low	135 Å²	135	158.6 Å²	158.6	83%	0.828	79%	0.791	S	S	*	*			trans	-132.9	163.5	179.1	40.5	0	0	0	0	112
701	S	37	Very low	35	Very low	101 Å²	101	161.2 Å²	161.2	71%	0.706	79%	0.792	S	S	*	*			trans	-62.2	142.1	-171.4	24.3	0	0	0	0	115.2
702	F	37.6	Very low	34.8	Very low	192 Å²	192	160.9 Å²	160.9	84%	0.842	80%	0.795	S	S	*	*				68.9	150.7	67.6	-69.7	-60.5	0	0	0	114.3
703	P	53.5	Low	34.5	Very low	107 Å²	107	160 Å²	160	70%	0.695	80%	0.795	S	S	*	*			cis	-141.3	160.6	-9.5	36	-15.1	0	0	0	119.1
704	L	32.2	Very low	34.3	Very low	149 Å²	149	156.5 Å²	156.5	78%	0.78	79%	0.791	S	S	*	*			trans	44.5	121.8	135.8	-57.2	173	0	0	0	126.5
705	I	31.8	Very low	34.1	Very low	137 Å²	137	157.7 Å²	157.7	70%	0.703	79%	0.792	S	S	*	*				87.3	136.8	125.2	-70.4	174.1	0	0	0	123.3
706	R	29.5	Very low	34	Very low	231 Å²	231	157.7 Å²	157.7	87%	0.872	79%	0.788	S	S	*	*			trans	74.2	150.3	165.7	-100.1	175.6	165.9	90.8	-5.3	116.5
707	S	34.3	Very low	33.9	Very low	114 Å²	114	157.2 Å²	157.2	80%	0.797	79%	0.791	S	S	*	*			cis	-140.1	-172.8	12.1	-54.1	0	0	0	0	114.4
708	K	33.8	Very low	33.4	Very low	201 Å²	201	155 Å²	155	87%	0.874	79%	0.788	S	S	*	*			trans	-83.1	177.8	-177.7	-63.2	-177.9	175.1	-178.1	0	115.2
709	S	32.1	Very low	34	Very low	113 Å²	113	147.2 Å²	147.2	79%	0.79	77%	0.77	S	S	*	*			trans	95.4	155.9	157.7	83.9	0	0	0	0	116.1
710	L	32.2	Very low	33.8	Very low	151 Å²	151	142.8 Å²	142.8	79%	0.791	76%	0.764	S	S	*	*			cis	-140.9	174.6	12.4	-135.4	159.6	0	0	0	111.3
711	Q	34.7	Very low	33.6	Very low	160 Å²	160	142.7 Å²	142.7	75%	0.748	76%	0.758	S	S	*	*			trans	-120.1	159	176	-70.9	179.6	-28.3	0	0	111.2
712	F	28.6	Very low	33.6	Very low	189 Å²	189	144.8 Å²	144.8	83%	0.829	76%	0.761	S	S	*	*			trans	-135.7	109.5	147	-81.8	-91.7	0	0	0	105.9
713	T	28.9	Very low	33.2	Very low	118 Å²	118	145.3 Å²	145.3	72%	0.724	76%	0.759	S	S	*	*				59.9	129.9	83.7	63.8	0	0	0	0	114
714	G	30	Very low	32.3	Very low	64 Å²	64	146.9 Å²	146.9	66%	0.66	76%	0.76	S	S	*	*			cis	133.4	163.4	0.9	0	0	0	0	0	112.3
715	K	31.5	Very low	32.2	Very low	175 Å²	175	146.2 Å²	146.2	76%	0.761	76%	0.762	S	S	*	*			trans	76.5	151.2	-175.7	-52.1	-179.2	145.3	-70.4	0	114
716	E	30.2	Very low	32.3	Very low	150 Å²	150	146.1 Å²	146.1	70%	0.701	76%	0.758	S	S	*	*			cis	-167.7	171.2	-18.8	-109.1	143.5	-153.7	0	0	106.3
717	V	31.8	Very low	33	Very low	139 Å²	139	140.7 Å²	140.7	84%	0.842	75%	0.753	S	S	*	*			cis	-141.9	-145	14	70.8	0	0	0	0	111
718	D	25.1	Very low	33	Very low	141 Å²	141	140.8 Å²	140.8	75%	0.754	74%	0.744	S	S	*	*			trans	-158.4	169.9	-172.5	-155.7	33.2	0	0	0	107
719	P	49.4	Very low	32.8	Very low	92 Å²	92	139.1 Å²	139.1	60%	0.597	74%	0.737	S	S	*	*			cis	-139.6	-146.2	6.4	41.2	-17.2	0	0	0	114.7
720	N	29.9	Very low	32.4	Very low	139 Å²	139	142.7 Å²	142.7	74%	0.743	74%	0.738	S	S	*	*			trans	79.3	129	172	-58.8	-7.2	0	0	0	116.9
721	D	32.2	Very low	32.4	Very low	133 Å²	133	139.9 Å²	139.9	71%	0.711	73%	0.731	S	S	*	*			cis	-149.3	157.7	14.2	-117.5	-33.3	0	0	0	115.7
722	L	35.4	Very low	33.1	Very low	146 Å²	146	138 Å²	138	76%	0.764	73%	0.733	S	S	*	*			trans	61.2	72.9	150.3	-64.1	167.7	0	0	0	124.3
723	Y	30.5	Very low	33.3	Very low	203 Å²	203	135.4 Å²	135.4	80%	0.796	72%	0.723	S	S	*	*				49.5	118.6	115.3	-86	-107.5	0	0	0	125.8
724	I	34.1	Very low	33.4	Very low	140 Å²	140	137 Å²	137	72%	0.718	72%	0.72	S	S	*	*			trans	68.4	131.6	131.9	-67.9	-167.9	0	0	0	118.8
725	V	29.8	Very low	33.5	Very low	135 Å²	135	143.6 Å²	143.6	82%	0.818	73%	0.731	S	S	*	*				-143	149	67.7	175.2	0	0	0	0	114.6
726	E	34.2	Very low	33.7	Very low	134 Å²	134	144.9 Å²	144.9	63%	0.626	74%	0.736	S	S	*	*			trans	-124.5	159	167.9	-153.4	-140.6	145.2	0	0	109.4	L728	E726-L728 VanDerWaalsContact OE1-CA 3.31Å; E726-L728 WeakPolarHBondContact OE1-CA 3.35Å; E726-L728 VanDerWaalsContact OE1-CB 3.24Å; E726-L728 WeakPolarHBondContact OE1-CB 3.41Å; E726-L728 VanDerWaalsContact OE1-CG 3.31Å; E726-L728 WeakPolarHBondContact OE1-CG 3.13Å; E726-L728 PolarHBondContact OE1-N 2.68Å
727	P	44.9	Very low	33.9	Very low	118 Å²	118	147.5 Å²	147.5	77%	0.766	75%	0.745	S	S	*	*				-158.5	128.2	92.6	37.4	-15.5	0	0	0	119.3
728	L	33	Very low	33.6	Very low	116 Å²	116	152.3 Å²	152.3	61%	0.607	75%	0.748	S	S	*	*				45.2	128.6	112.4	-118.1	173.1	0	0	0	122.8	E726	E726-L728 VanDerWaalsContact OE1-CA 3.31Å; E726-L728 WeakPolarHBondContact OE1-CA 3.35Å; E726-L728 VanDerWaalsContact OE1-CB 3.24Å; E726-L728 WeakPolarHBondContact OE1-CB 3.41Å; E726-L728 VanDerWaalsContact OE1-CG 3.31Å; E726-L728 WeakPolarHBondContact OE1-CG 3.13Å; E726-L728 PolarHBondContact OE1-N 2.68Å
729	K	30.6	Very low	33.7	Very low	166 Å²	166	151 Å²	151	72%	0.722	75%	0.749	S	S	*	*			trans	139.9	151.7	135.7	-76.9	161.2	-175.5	167.3	0	113.6
730	F	24.3	Very low	32.8	Very low	187 Å²	187	155 Å²	155	82%	0.82	76%	0.757	S	S	*	*			cis	-154.4	173.1	-4.5	-122	-46.5	0	0	0	110.7
731	S	32.2	Very low	32.7	Very low	93 Å²	93	158.8 Å²	158.8	65%	0.65	76%	0.762	S	S	*	*			trans	-131.3	152.5	169.6	178.6	0	0	0	0	109.5
732	P	48.7	Very low	32.4	Very low	119 Å²	119	159.8 Å²	159.8	77%	0.773	76%	0.76	S	S	*	*				-158.4	133.7	116.3	36.7	-16.2	0	0	0	119.5
733	E	31.9	Very low	32.1	Very low	136 Å²	136	158.8 Å²	158.8	64%	0.636	76%	0.76	S	S	*	*				34	127.9	119.7	-60	-153.5	140.2	0	0	126.9
734	K	31.3	Very low	31.9	Very low	150 Å²	150	156.4 Å²	156.4	65%	0.652	76%	0.756	S	S	*	*			trans	59.7	133.4	130.6	-52.6	163.5	-175.8	153.9	0	122.6
735	K	31.5	Very low	31.8	Very low	204 Å²	204	158.6 Å²	158.6	89%	0.887	76%	0.761	S	S	*	*				164.7	129.9	108.1	-88.1	167	-168.8	166.8	0	118.5
736	K	36.2	Very low	31.9	Very low	202 Å²	202	159 Å²	159	88%	0.878	76%	0.757	S	S	*	*			trans	-18.1	140.7	161.1	-53.6	172.4	178.6	179.8	0	122.7
737	K	33.9	Very low	31.6	Very low	204 Å²	204	160.7 Å²	160.7	89%	0.887	77%	0.765	S	S	*	*			trans	-146.7	135.3	137.1	-64.4	-173.6	-174.8	172.7	0	107
738	R	26.5	Very low	31	Very low	240 Å²	240	161.2 Å²	161.2	91%	0.906	77%	0.766	S	S	*	*				72.2	122.7	59.6	-166.4	174.7	-174.6	-174.6	1.7	111.2
739	C	27.9	Very low	30.9	Very low	113 Å²	113	163.2 Å²	163.2	76%	0.764	78%	0.776	S	S	*	*			cis	-148.2	-168.3	17	-145.3	0	0	0	0	116
740	K	28.9	Very low	30.8	Very low	177 Å²	177	164.6 Å²	164.6	77%	0.77	78%	0.782	S	S	*	*			trans	-73.4	154.3	-165.1	-69.1	-178.1	175.8	-175.6	0	119.6
741	Y	29.2	Very low	31.9	Very low	218 Å²	218	161.4 Å²	161.4	86%	0.855	78%	0.78	S	S	*	*			trans	31.4	134.7	134.9	-72	-102.5	0	0	0	122
742	K	25.2	Very low	31.5	Very low	155 Å²	155	162 Å²	162	67%	0.674	79%	0.79	S	S	*	*				-155	154.7	100.2	-146.9	-172.5	172.5	-163.8	0	111.6	E744	K742-E744 WeakPolarHBondContact CE-OE1 3.38Å; K742-E744 WeakPolarHBondContact CE-OE2 3.4Å; K742-E744 IonicContact NZ-OE1 3.63Å; K742-E744 PolarHBondContact NZ-OE1 2.86Å; K742-E744 IonicContact NZ-OE2 2.81Å; K742-E744 PolarHBondContact NZ-OE2 2.73Å
743	T	30.3	Very low	30.5	Very low	124 Å²	124	163.9 Å²	163.9	76%	0.761	79%	0.794	S	S	*	*			trans	-120.9	140.1	163.3	-56.7	0	0	0	0	107.1
744	E	26	Very low	31.3	Very low	153 Å²	153	162.2 Å²	162.2	72%	0.715	80%	0.795	S	S	*	*			trans	-139.8	146.8	173.3	-148.8	112.9	-120.1	0	0	107.8	K742	K742-E744 WeakPolarHBondContact CE-OE1 3.38Å; K742-E744 WeakPolarHBondContact CE-OE2 3.4Å; K742-E744 IonicContact NZ-OE1 3.63Å; K742-E744 PolarHBondContact NZ-OE1 2.86Å; K742-E744 IonicContact NZ-OE2 2.81Å; K742-E744 PolarHBondContact NZ-OE2 2.73Å
745	K	31.1	Very low	31	Very low	186 Å²	186	163.1 Å²	163.1	81%	0.809	81%	0.806	S	S	*	*			trans	-151.9	155.6	-176.4	-165.3	-163.6	175.1	-175.1	0	108.9
746	I	32.6	Very low	31.2	Very low	143 Å²	143	161.2 Å²	161.2	73%	0.733	80%	0.8	S	S	*	*			trans	93	113.5	165.9	-52.5	160.4	0	0	0	113.2
747	E	27.3	Very low	31.6	Very low	170 Å²	170	157 Å²	157	79%	0.794	79%	0.793	S	S	*	*				-154.5	161.4	111.4	-113.1	175.5	-166.5	0	0	111.4
748	T	32.3	Very low	31.4	Very low	130 Å²	130	153.9 Å²	153.9	80%	0.798	79%	0.785	S	S	*	*			trans	-156.9	118.6	-178.5	-62.1	0	0	0	0	108.6
749	I	31.1	Very low	31.6	Very low	158 Å²	158	146.8 Å²	146.8	81%	0.81	78%	0.777	S	S	*	*			trans	-128.6	156.7	174.7	-62.4	-176.7	0	0	0	108.6
750	K	29.4	Very low	31.9	Very low	194 Å²	194	148.7 Å²	148.7	84%	0.843	78%	0.78	S	S	*	*			trans	-100.2	-177.9	-160.1	-110.3	-165.1	174.6	-176.9	0	113.2
751	P	46.9	Very low	31.9	Very low	121 Å²	121	143.7 Å²	143.7	79%	0.786	78%	0.779	S	S	*	*			trans	-93.4	170	-149	39.3	-39.6	0	0	0	115.3
752	A	24.2	Very low	31.9	Very low	104 Å²	104	141 Å²	141	86%	0.86	78%	0.779	S	S	*	*			trans	-150	148	159	0	0	0	0	0	111.8
753	D	27.3	Very low	32.3	Very low	159 Å²	159	141.7 Å²	141.7	85%	0.85	79%	0.788	S	S	*	*			trans	-146.3	162.5	169.3	-149.2	9.2	0	0	0	103.9
754	P	48.9	Very low	32.5	Very low	101 Å²	101	145.5 Å²	145.5	66%	0.656	79%	0.794	S	S	*	*			cis	-130	-170.6	-4.9	43.3	-27.4	0	0	0	113.4
755	L	23.6	Very low	32.7	Very low	170 Å²	170	141.5 Å²	141.5	89%	0.89	79%	0.794	S	S	*	*			trans	176.3	146.3	131.8	-98.3	164.2	0	0	0	115.2
756	H	35.5	Very low	32.7	Very low	163 Å²	163	144.8 Å²	144.8	76%	0.755	80%	0.802	S	S	*	*			trans	-112.2	154.5	164.8	-108.9	-65.5	0	0	0	109.8
757	P	46.3	Very low	32.5	Very low	114 Å²	114	147.2 Å²	147.2	74%	0.74	81%	0.807	S	S	*	*				-134.6	154.7	106.9	11.6	10.7	0	0	0	112
758	I	29.7	Very low	33.2	Very low	139 Å²	139	144.7 Å²	144.7	71%	0.713	81%	0.805	S	S	*	*			cis	91.2	110.4	37.2	-62.2	163.1	0	0	0	114.6
759	A	30.9	Very low	33	Very low	90 Å²	90	147.7 Å²	147.7	74%	0.744	81%	0.808	S	S	*	*			trans	177.2	113.3	139.5	0	0	0	0	0	108.7
760	N	33.8	Very low	32.9	Very low	154 Å²	154	146.1 Å²	146.1	82%	0.824	81%	0.805	S	S	*	*				99.1	137.4	58.4	-75.3	-8.7	0	0	0	112.2
761	G	29.1	Very low	33	Very low	72 Å²	72	143.1 Å²	143.1	74%	0.742	80%	0.799	S	S	*	*			cis	179.8	-171.5	-0.5	0	0	0	0	0	114.9
762	D	28.6	Very low	32.2	Very low	162 Å²	162	144 Å²	144	87%	0.866	79%	0.792	S	S	*	*			trans	-77.3	166.6	-172	-46.2	-91.8	0	0	0	117.2
763	I	33.6	Very low	32.7	Very low	168 Å²	168	147.3 Å²	147.3	86%	0.862	78%	0.782	S	S	*	*			trans	-136.5	140.9	140.4	-60.7	-172.1	0	0	0	112.7
764	K	34.8	Very low	32.6	Very low	204 Å²	204	144.9 Å²	144.9	89%	0.887	77%	0.769	S	S	*	*			trans	-58.4	172.1	177.7	-58.1	136.5	-178.9	172.3	0	115.1
765	G	30.4	Very low	31.7	Very low	70 Å²	70	148.7 Å²	148.7	72%	0.722	78%	0.776	S	S	*	*			cis	143.4	178.7	-1.4	0	0	0	0	0	114
766	R	30.8	Very low	32	Very low	255 Å²	255	145.3 Å²	145.3	96%	0.962	77%	0.767	S	S	*	*			trans	105	146.3	173.6	-71.8	-174.9	163.6	-101.1	0.9	119.8
767	K	28.6	Very low	31.9	Very low	194 Å²	194	142.5 Å²	142.5	84%	0.843	77%	0.766	S	S	*	*			trans	-109	171.2	164.9	-57.4	-176.8	177.4	-176.1	0	110.5
768	P	42	Very low	31.1	Very low	117 Å²	117	145.9 Å²	145.9	76%	0.76	77%	0.774	S	S	*	*				-150.4	174.9	92.8	36.4	-16.4	0	0	0	118
769	F	27.7	Very low	31	Very low	193 Å²	193	142.6 Å²	142.6	85%	0.846	77%	0.774	S	S	*	*			trans	-17	168.1	165	-61.2	-96.9	0	0	0	121.7
770	T	29.9	Very low	31	Very low	124 Å²	124	147.2 Å²	147.2	76%	0.761	78%	0.78	S	S	*	*			cis	-156.1	140	32.1	49	0	0	0	0	117.5
771	N	30.6	Very low	30.9	Very low	132 Å²	132	144.3 Å²	144.3	71%	0.706	77%	0.768	S	S	*	*			trans	36.5	135.7	134.7	-79.6	-33.3	0	0	0	127.8
772	Q	30.7	Very low	31	Very low	139 Å²	139	151.4 Å²	151.4	65%	0.65	77%	0.774	S	S	*	*			trans	71.2	142	137	-68.5	-176.9	8.9	0	0	120.1
773	R	33.5	Very low	31.5	Very low	173 Å²	173	152.2 Å²	152.2	65%	0.653	77%	0.772	S	S	*	*			cis	-153.4	-146.3	8.1	-135.9	179.1	-65.5	99.6	5.2	111.3
774	D	25.4	Very low	31.3	Very low	108 Å²	108	149.8 Å²	149.8	58%	0.578	77%	0.77	S	S	*	*			cis	-159.9	-174.9	14.7	-131.1	-42.6	0	0	0	115
775	F	29.4	Very low	31.5	Very low	181 Å²	181	144.9 Å²	144.9	79%	0.794	76%	0.762	S	S	*	*			trans	-61.5	169.5	-178.4	-70.9	-70.4	0	0	0	119
776	S	31.8	Very low	31.4	Very low	100 Å²	100	152.4 Å²	152.4	70%	0.699	77%	0.77	S	S	*	*			cis	-168.8	153.7	8.8	-126.2	0	0	0	0	116.3
777	S	31.9	Very low	31.6	Very low	104 Å²	104	149.9 Å²	149.9	73%	0.727	77%	0.766	S	S	*	*			trans	53	163.8	144.5	-122.2	0	0	0	0	122.7
778	M	29.2	Very low	31.7	Very low	184 Å²	184	144 Å²	144	91%	0.906	76%	0.76	S	S	*	*			cis	-158.5	-176.1	5.2	-149.5	151.9	178.1	0	0	112.5
779	G	28.9	Very low	32.6	Very low	70 Å²	70	144.6 Å²	144.6	72%	0.722	76%	0.764	S	S	*	*			trans	-84.7	-159.7	-179.5	0	0	0	0	0	117.1
780	E	30	Very low	33.7	Very low	187 Å²	187	141.6 Å²	141.6	87%	0.874	76%	0.764	S	S	*	*			cis	-159.1	156.6	13.2	-87.7	-166.8	99	0	0	115.8
781	V	32.9	Very low	33.9	Very low	93 Å²	93	141 Å²	141	56%	0.564	77%	0.765	S	S	*	*			trans	16.1	135.9	145.8	-155.4	0	0	0	0	124.4
782	Y	31.4	Very low	34.1	Very low	221 Å²	221	143.5 Å²	143.5	87%	0.867	77%	0.772	S	S	*	*				166.9	170.4	118.6	-93.9	-67.9	0	0	0	117.7
783	H	37.5	Very low	34	Very low	179 Å²	179	139.9 Å²	139.9	83%	0.829	77%	0.772	S	S	*	*			trans	-114.1	162.3	-162.6	-80.2	-104.8	0	0	0	116.2
784	S	31	Very low	34.1	Very low	118 Å²	118	137.1 Å²	137.1	83%	0.825	78%	0.78	S	S	*	*				168.1	-179.9	117.4	-158.3	0	0	0	0	115.1
785	S	37.1	Very low	34.6	Very low	101 Å²	101	137 Å²	137	71%	0.706	79%	0.787	S	S	*	*			trans	-113.3	172.4	-161.2	-46.3	0	0	0	0	117
786	Y	30	Very low	34.7	Very low	227 Å²	227	136.6 Å²	136.6	89%	0.89	79%	0.788	S	S	*	*				-178.4	178	126.9	-102.1	-68.4	0	0	0	115
787	K	35.2	Very low	34.8	Very low	203 Å²	203	137.9 Å²	137.9	88%	0.883	79%	0.792	S	S	*	*			trans	-84.5	174.1	-173.1	-60.7	178.3	177.1	-179.7	0	113.2
788	G	30.4	Very low	34.9	Very low	71 Å²	71	137.7 Å²	137.7	73%	0.732	79%	0.79	S	S	*	*			cis	-174.6	-163.8	13	0	0	0	0	0	114.6
789	P	60.5	Low	35.2	Very low	128 Å²	128	133.8 Å²	133.8	83%	0.831	78%	0.781	S	S	*	*			trans	-107.7	-175	-161.2	43	-38	0	0	0	116.4
790	P	50.9	Low	35.4	Very low	130 Å²	130	139.4 Å²	139.4	84%	0.844	79%	0.788	S	S	*	*				-147.7	-168.9	99.5	42	-25.3	0	0	0	116.5
791	S	33.5	Very low	35.5	Very low	112 Å²	112	135 Å²	135	78%	0.783	78%	0.778	S	S	*	*			trans	-144.3	-174.1	-178.7	-156.5	0	0	0	0	109.2
792	E	35.2	Very low	35.5	Very low	184 Å²	184	139.6 Å²	139.6	86%	0.86	79%	0.793	S	S	*	*			cis	-141.4	-166.9	16	-60.9	-173.7	105.5	0	0	109.7
793	G	28.9	Very low	35.5	Very low	63 Å²	63	138 Å²	138	65%	0.649	79%	0.794	S	S	*	*			cis	-146.5	-159.2	7.2	0	0	0	0	0	111.7
794	S	34.7	Very low	35.4	Very low	116 Å²	116	134.6 Å²	134.6	81%	0.811	79%	0.79	S	S	*	*			cis	79.7	133.7	25.3	-49.6	0	0	0	0	114.6
795	S	35.4	Very low	35.7	Very low	104 Å²	104	139.1 Å²	139.1	73%	0.727	79%	0.791	S	S	*	*			cis	-158.4	-154.4	-9.4	30.1	0	0	0	0	109.1
796	E	32.7	Very low	35.3	Very low	174 Å²	174	144.1 Å²	144.1	81%	0.813	80%	0.8	S	S	*	*			cis	-149	-91.6	17.1	-67.9	-174	127.7	0	0	115.9
797	T	32.7	Very low	35.3	Very low	127 Å²	127	139.6 Å²	139.6	78%	0.779	80%	0.8	S	S	*	*			trans	-148.9	167.6	-150.7	45	0	0	0	0	115.3
798	S	34	Very low	35	Very low	99 Å²	99	132.7 Å²	132.7	69%	0.692	79%	0.786	S	S	*	*			cis	-177.2	172.6	-24.7	70.1	0	0	0	0	112.3
799	S	36	Very low	35.6	Very low	102 Å²	102	137.7 Å²	137.7	71%	0.713	79%	0.794	S	S	*	*			trans	82	140	153.1	-56.2	0	0	0	0	122.4
800	Q	34.4	Very low	34.3	Very low	188 Å²	188	137.2 Å²	137.2	88%	0.879	79%	0.794	S	S	*	*			trans	65.3	152.5	160.9	-72.1	175	-2.8	0	0	117.8
801	S	32.2	Very low	33.6	Very low	94 Å²	94	135 Å²	135	66%	0.657	79%	0.787	S	S	*	*			cis	-166	179.8	-12	44.6	0	0	0	0	111.7
802	E	32.4	Very low	33.5	Very low	190 Å²	190	135.1 Å²	135.1	89%	0.888	79%	0.786	S	S	*	*			trans	79.4	157.5	160.2	-55.4	-168.5	151.6	0	0	121
803	E	31.8	Very low	33.6	Very low	188 Å²	188	132.5 Å²	132.5	88%	0.879	78%	0.783	S	S	*	*			trans	-101.3	155.3	-178.7	-63.6	167.5	80	0	0	111.1
804	S	35.5	Very low	33.9	Very low	107 Å²	107	134.9 Å²	134.9	75%	0.748	79%	0.79	S	S	*	*				160.1	151.5	117.2	57.6	0	0	0	0	116
805	Y	36.1	Very low	33.9	Very low	213 Å²	213	136.5 Å²	136.5	84%	0.835	79%	0.789	S	S	*	*			trans	21.6	110.9	162.7	-55.2	-63.2	0	0	0	123.3
806	F	28	Very low	33.7	Very low	207 Å²	207	137.1 Å²	137.1	91%	0.908	79%	0.792	S	S	*	*				40.8	103.5	106.6	-164.8	-87.4	0	0	0	118.5
807	C	30	Very low	33.6	Very low	132 Å²	132	135.8 Å²	135.8	89%	0.892	79%	0.79	S	S	*	*			trans	-147.9	158.3	146.9	-158.6	0	0	0	0	110.5
808	G	30.2	Very low	33.4	Very low	57 Å²	57	132.7 Å²	132.7	59%	0.588	78%	0.783	S	S	*	*			trans	-117.4	142.1	-166.4	0	0	0	0	0	116.1
809	I	42.7	Very low	33	Very low	176 Å²	176	135.9 Å²	135.9	90%	0.903	79%	0.787	S	S	*	*			trans	40.8	98.9	144.5	-44.7	176.7	0	0	0	117.8
810	S	32.8	Very low	32.6	Very low	118 Å²	118	136.3 Å²	136.3	83%	0.825	79%	0.786	S	S	*	*			trans	-162.2	148.7	140.1	55.3	0	0	0	0	109.5
811	A	36.2	Very low	32.2	Very low	84 Å²	84	135 Å²	135	69%	0.694	78%	0.779	S	S	*	*			cis	-163.1	-173.9	-18.7	0	0	0	0	0	108.9
812	C	32.8	Very low	32.2	Very low	114 Å²	114	139 Å²	139	77%	0.77	79%	0.785	S	S	*	*			trans	74.5	149.2	163.2	-54.4	0	0	0	0	118.5
813	T	35.8	Very low	32	Very low	129 Å²	129	137.2 Å²	137.2	79%	0.791	79%	0.787	S	S	*	*				179.2	130.8	-53.6	29.6	0	0	0	0	108.7
814	S	35.8	Very low	31.9	Very low	113 Å²	113	138 Å²	138	79%	0.79	79%	0.788	S	S	*	*			trans	-163.1	145.8	155.1	63.7	0	0	0	0	111.7
815	L	35.4	Very low	31.9	Very low	151 Å²	151	138.9 Å²	138.9	79%	0.791	79%	0.789	S	S	*	*			cis	-164.6	122.8	-23.5	-118.1	173.3	0	0	0	108.2
816	C	30.2	Very low	31.5	Very low	117 Å²	117	135.7 Å²	135.7	79%	0.791	78%	0.781	S	S	*	*			trans	56.2	177.3	158.9	-66.5	0	0	0	0	120.5
817	N	30.2	Very low	31.6	Very low	145 Å²	145	134.1 Å²	134.1	78%	0.775	77%	0.774	S	S	*	*				-163.3	157.3	-58.2	-163.1	7.3	0	0	0	109.5
818	G	28.6	Very low	31.6	Very low	62 Å²	62	139.7 Å²	139.7	64%	0.639	78%	0.777	S	S	*	*			trans	116.7	112.8	171.2	0	0	0	0	0	114.3
819	Q	25.4	Very low	31.5	Very low	167 Å²	167	141.8 Å²	141.8	78%	0.78	79%	0.788	S	S	*	*			cis	81.5	122	29.5	-164	172.3	-3.8	0	0	113.1
820	T	28.1	Very low	30.8	Very low	110 Å²	110	140.4 Å²	140.4	68%	0.675	78%	0.782	S	S	*	*			cis	-164.7	176.6	-8.6	19.2	0	0	0	0	110.3
821	Q	27.2	Very low	30.6	Very low	160 Å²	160	143.9 Å²	143.9	75%	0.748	78%	0.782	S	S	*	*			trans	136.2	108.8	143.9	-69.2	-81.1	7.3	0	0	109.4
822	K	30.2	Very low	30.3	Very low	180 Å²	180	151 Å²	151	78%	0.783	79%	0.791	S	S	*	*				65.9	113.5	66.9	-71.1	-177.3	176	171.7	0	115.7
823	T	28.4	Very low	30.1	Very low	152 Å²	152	156.7 Å²	156.7	93%	0.933	80%	0.796	S	S	*	*			trans	-136.3	150.9	145.4	44.8	0	0	0	0	109.1
824	K	30.8	Very low	29.7	Very low	204 Å²	204	162.3 Å²	162.3	89%	0.887	80%	0.803	S	S	*	*			trans	-157.8	120.1	-165.9	174.9	-171.4	175.7	-178.8	0	112.7
825	T	35.6	Very low	29.2	Very low	125 Å²	125	162.5 Å²	162.5	77%	0.767	80%	0.804	S	S	*	*			trans	-160.7	149.9	171.7	12.2	0	0	0	0	109.2
826	E	27.9	Very low	28.7	Very low	146 Å²	146	164.2 Å²	164.2	68%	0.682	81%	0.805	S	S	*	*			cis	-139.8	-159.9	-3	-162.1	146.2	-179	0	0	113.1
827	K	30.2	Very low	28.5	Very low	174 Å²	174	164 Å²	164	76%	0.757	80%	0.8	S	S	*	*			trans	-104.9	167.4	-143.8	-60.7	141.9	-170.8	160.1	0	115.5
828	R	28.8	Very low	28.4	Very low	250 Å²	250	164.3 Å²	164.3	94%	0.943	80%	0.797	S	S	*	*			trans	-50.7	146.8	171.1	-59.6	164.9	169.5	154.8	-6.6	116
829	A	28.1	Very low	28.4	Very low	100 Å²	100	167.2 Å²	167.2	83%	0.826	80%	0.798	S	S	*	*			trans	-162.6	162.9	158.5	0	0	0	0	0	111.7
830	L	28.3	Very low	28.6	Very low	147 Å²	147	168 Å²	168	77%	0.77	80%	0.801	S	S	*	*			cis	-157.5	84.9	-39.6	-175	59.7	0	0	0	112.9
831	K	28.7	Very low	28.5	Very low	192 Å²	192	165.3 Å²	165.3	84%	0.835	80%	0.796	S	S	*	*			trans	34.6	107.4	142.6	-173	-176.6	-172.8	175.5	0	119.3
832	R	29	Very low	28.7	Very low	233 Å²	233	166.8 Å²	166.8	88%	0.879	80%	0.8	S	S	*	*			trans	-172.7	149.8	162.1	-101.1	137.5	-168.2	-157.7	4.2	109.6
833	R	30.3	Very low	28.7	Very low	234 Å²	234	165.7 Å²	165.7	88%	0.883	80%	0.802	S	S	*	*			cis	-139.3	163.9	8.5	-98.1	169.4	-178	178.2	0.4	111.6
834	R	26.6	Very low	28.9	Very low	247 Å²	247	165.4 Å²	165.4	93%	0.932	79%	0.793	S	S	*	*			trans	-91.9	136.5	160.4	-89.7	179.2	165.6	176.7	-5	110.1
835	S	25.3	Very low	28.7	Very low	117 Å²	117	165.7 Å²	165.7	82%	0.818	79%	0.794	S	S	*	*			trans	178.4	155	144.4	47.1	0	0	0	0	112.3
836	K	25.6	Very low	28.4	Very low	186 Å²	186	163.9 Å²	163.9	81%	0.809	79%	0.792	S	S	*	*			cis	174	130.9	-34.3	170.9	-177.8	173.5	-172	0	106.8
837	V	25.9	Very low	28.4	Very low	113 Å²	113	164.1 Å²	164.1	69%	0.685	80%	0.797	S	S	*	*			trans	67.4	150.3	162	153.9	0	0	0	0	115.1
838	Q	27.8	Very low	28.6	Very low	152 Å²	152	162.5 Å²	162.5	71%	0.71	80%	0.796	S	S	*	*			cis	-148	143.3	-14.9	-118.9	179	-88.2	0	0	109.7
839	D	28	Very low	28.6	Very low	122 Å²	122	159.7 Å²	159.7	65%	0.652	79%	0.793	S	S	*	*				27.6	118.2	114	-175.5	38.6	0	0	0	120.3
840	Q	29.7	Very low	28.8	Very low	183 Å²	183	161.2 Å²	161.2	86%	0.855	79%	0.792	S	S	*	*				-148.9	143	110	-86.2	-148.1	1.8	0	0	111.5
841	G	26.9	Very low	28.8	Very low	54 Å²	54	163.3 Å²	163.3	56%	0.557	80%	0.795	S	S	*	*			trans	-79.6	-155	164.3	0	0	0	0	0	112.6
842	K	30.9	Very low	29	Very low	191 Å²	191	159.7 Å²	159.7	83%	0.83	79%	0.794	S	S	*	*			cis	-158.6	163.1	13.4	-54.6	164.9	-174.5	167.9	0	108.8
843	L	30.5	Very low	29	Very low	157 Å²	157	152.4 Å²	152.4	82%	0.822	79%	0.791	S	S	*	*				-160.8	123.7	121.7	-130.8	79.6	0	0	0	113.1
844	I	31.9	Very low	29	Very low	147 Å²	147	146.3 Å²	146.3	75%	0.754	79%	0.785	S	S	*	*			trans	51	125.8	147.7	-65.8	168.6	0	0	0	121
845	K	26.5	Very low	29.2	Very low	209 Å²	209	142.2 Å²	142.2	91%	0.909	78%	0.78	S	S	*	*			trans	-93.5	141.7	155.2	-74.9	-178.1	173.4	-176.6	0	110.6
846	A	29.6	Very low	30	Very low	88 Å²	88	141.9 Å²	141.9	73%	0.727	78%	0.775	S	S	*	*			trans	166.7	151.3	146.5	0	0	0	0	0	107.6
847	L	27.4	Very low	30.5	Very low	151 Å²	151	138 Å²	138	79%	0.791	77%	0.772	S	S	*	*			cis	-158.6	159.8	31.3	-158.5	70.6	0	0	0	110.6
848	I	33.7	Very low	31.1	Very low	140 Å²	140	139.1 Å²	139.1	72%	0.718	77%	0.773	S	S	*	*			trans	67.8	134	162	-73.9	153.3	0	0	0	120.3
849	Q	30.7	Very low	31.9	Very low	191 Å²	191	139.9 Å²	139.9	89%	0.893	78%	0.776	S	S	*	*			trans	-107.3	132.2	159.9	-57	159.5	-88.7	0	0	109.6
850	T	32.2	Very low	32.4	Very low	131 Å²	131	140.6 Å²	140.6	80%	0.804	78%	0.78	S	S	*	*			trans	-163.2	153.4	157.3	39.7	0	0	0	0	108.2
851	K	28.7	Very low	33.3	Very low	192 Å²	192	138.8 Å²	138.8	84%	0.835	78%	0.775	S	S	*	*			cis	-154.8	148.8	-27.2	176.8	-179.4	174.1	-172.8	0	106
852	S	31.4	Very low	34.2	Very low	115 Å²	115	143 Å²	143	80%	0.804	78%	0.783	S	S	*	*			trans	-65.1	142.6	177.6	51.3	0	0	0	0	114
853	G	28.4	Very low	34.6	Very low	80 Å²	80	143.9 Å²	143.9	83%	0.825	79%	0.787	S	S	*	*			trans	-161.7	143.1	167.6	0	0	0	0	0	109.6
854	S	31.2	Very low	34.8	Very low	107 Å²	107	140 Å²	140	75%	0.748	79%	0.785	S	S	*	*			trans	-140.6	173.5	-174.4	56.4	0	0	0	0	110.6
855	L	30.4	Very low	34.7	Very low	161 Å²	161	140.5 Å²	140.5	84%	0.843	79%	0.789	S	S	*	*			trans	78.4	160.5	177.4	-54.4	169.1	0	0	0	114.9
856	P	42.9	Very low	35.2	Very low	109 Å²	109	138.3 Å²	138.3	71%	0.708	78%	0.779	S	S	*	*			cis	-117.5	-176.7	-2.6	19.2	4.6	0	0	0	114.6
857	S	35.8	Very low	35.3	Very low	105 Å²	105	141.3 Å²	141.3	73%	0.734	78%	0.778	S	S	*	*			trans	-84.4	168.7	174.6	-168.9	0	0	0	0	112.4	H859	S857-H859 PolarHBondContact O-N 3.08Å
858	L	38.4	Very low	35.8	Very low	137 Å²	137	141.4 Å²	141.4	72%	0.717	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	10.3	-165.9	-161.2	116.2	0	0	0	116.3
859	H	44.2	Very low	35.6	Very low	167 Å²	167	140.5 Å²	140.5	77%	0.773	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-12.3	-162.6	-136	-63.1	0	0	0	115.8	S857	S857-H859 PolarHBondContact O-N 3.08Å
860	D	39.8	Very low	35.6	Very low	137 Å²	137	138.3 Å²	138.3	73%	0.733	78%	0.779	S	S	*	*	S	Bend	trans	-97.4	-5.2	-174.1	-65.7	-42.5	0	0	0	114.8
861	I	47.8	Very low	35.5	Very low	145 Å²	145	135.4 Å²	135.4	74%	0.744	78%	0.775	S	S	*	*	S	Bend	trans	-85.8	-24.3	-177.3	-63	177.8	0	0	0	112	K863	I861-K863 VanDerWaalsContact C-N 3.29Å; I861-K863 PolarHBondContact O-N 2.86Å
862	I	46.8	Very low	35.6	Very low	142 Å²	142	130 Å²	130	73%	0.728	77%	0.766	S	S	*	*	S	Bend	trans	-90.2	54.2	-174.7	-43.4	-177.5	0	0	0	111.6
863	K	37.7	Very low	35.4	Very low	211 Å²	211	134.7 Å²	134.7	92%	0.917	77%	0.772	S	S	*	*	S	Bend	trans	-173.5	67	165.6	-109.4	162.4	-174.9	175.3	0	112.7	I861	I861-K863 VanDerWaalsContact C-N 3.29Å; I861-K863 PolarHBondContact O-N 2.86Å
864	G	35.1	Very low	35.5	Very low	75 Å²	75	134.3 Å²	134.3	77%	0.773	77%	0.768	S	S	*	*			trans	-152.2	114.5	175.9	0	0	0	0	0	112.2
865	N	30.5	Very low	35.6	Very low	157 Å²	157	136 Å²	136	84%	0.84	77%	0.773	S	S	*	*			trans	-107.1	151	-170.8	-116.2	-13.6	0	0	0	112.3
866	K	36.3	Very low	35.6	Very low	163 Å²	163	135.3 Å²	135.3	71%	0.709	78%	0.776	S	S	*	*			trans	84.5	120.5	156	-69.4	160.9	157.2	-90.2	0	121.7
867	E	32.3	Very low	34.9	Very low	152 Å²	152	134.3 Å²	134.3	71%	0.71	78%	0.777	S	S	*	*				81.4	166.5	129	-65.8	166.3	-134.2	0	0	121.2
868	I	38.5	Very low	34.7	Very low	152 Å²	152	135.8 Å²	135.8	78%	0.779	78%	0.782	S	S	*	*			trans	89.5	70.1	169.9	-42.5	178.5	0	0	0	118.6
869	T	29.6	Very low	34.3	Very low	121 Å²	121	134.8 Å²	134.8	74%	0.742	79%	0.786	S	S	*	*				46.4	109.4	105.4	-47.8	0	0	0	0	122.2
870	V	30.6	Very low	33.7	Very low	146 Å²	146	129.7 Å²	129.7	89%	0.885	78%	0.779	S	S	*	*			trans	42.3	123.2	131.3	-172.3	0	0	0	0	121.7
871	G	29	Very low	33.2	Very low	70 Å²	70	131.9 Å²	131.9	72%	0.722	78%	0.784	S	S	*	*			trans	104.2	162.1	142.4	0	0	0	0	0	117.1
872	A	30.8	Very low	32.7	Very low	78 Å²	78	135.8 Å²	135.8	65%	0.645	80%	0.804	S	S	*	*			cis	-167.9	176.3	-13.1	0	0	0	0	0	110
873	F	28.3	Very low	31.9	Very low	213 Å²	213	135.5 Å²	135.5	93%	0.934	81%	0.808	S	S	*	*			trans	70	154.7	173.7	-54.2	-83.1	0	0	0	116.5
874	G	29.4	Very low	31.6	Very low	72 Å²	72	131.5 Å²	131.5	74%	0.742	80%	0.802	S	S	*	*			cis	-163.6	163.3	0.4	0	0	0	0	0	113.5
875	V	33.7	Very low	31.5	Very low	142 Å²	142	134.7 Å²	134.7	86%	0.861	80%	0.804	S	S	*	*			trans	-94.7	141.2	-172	174.7	0	0	0	0	112.3
876	T	31.2	Very low	31.5	Very low	147 Å²	147	133.4 Å²	133.4	90%	0.902	80%	0.802	S	S	*	*			trans	-150.1	149.6	145.7	15	0	0	0	0	110.7
877	A	28	Very low	31.2	Very low	88 Å²	88	131.5 Å²	131.5	73%	0.727	81%	0.808	S	S	*	*			trans	-114.9	-179.7	-180	0	0	0	0	0	111.1
878	V	31.8	Very low	31.1	Very low	137 Å²	137	130.1 Å²	130.1	83%	0.83	81%	0.814	S	S	*	*				164.4	133.8	124.3	155.7	0	0	0	0	112.9
879	S	29.3	Very low	30.6	Very low	115 Å²	115	128.6 Å²	128.6	80%	0.804	82%	0.817	S	S	*	*			trans	57.3	141.5	157.6	-154.5	0	0	0	0	122
880	G	31.9	Very low	30.7	Very low	61 Å²	61	129.2 Å²	129.2	63%	0.629	82%	0.822	S	S	*	*			trans	-114.1	-131.1	159	0	0	0	0	0	111.6
881	H	29.2	Very low	30.7	Very low	183 Å²	183	127.8 Å²	127.8	85%	0.847	82%	0.817	S	S	*	*			trans	71.3	145.8	-159.5	-86.8	-43.2	0	0	0	114.6
882	I	35.8	Very low	30.8	Very low	227 Å²	227	133 Å²	133	100%	1.164	83%	0.826	S	S	*	*			cis	-95.8	0	0.6	-69.2	176.7	0	0	0	111.2

Retrieved 882 of 882 residues in 412.1 ms (Link to these results)

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