A0A087XXQ4_POEFO Loading...

B30.2/SPRY domain-containing protein

AlphaFold DB , UniProt , Accession A0A087XXQ4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 385 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.4	Very low	36.7	Very low	249 Å²	249	151.5 Å²	151.5	100%	1.227	82%	0.822	S	S	*	*				0	167.3	0	-105.2	172.7	168.5	0	0	109.6
2	M	30.5	Very low	37.4	Very low	151 Å²	151	156.3 Å²	156.3	74%	0.744	82%	0.822	S	S	*	*			trans	-41.9	160.1	172.9	-61.9	-179.3	-158.6	0	0	115.4
3	R	31.4	Very low	37.4	Very low	218 Å²	218	157.2 Å²	157.2	82%	0.823	82%	0.819	S	S	*	*			cis	-167.1	157.7	-3.4	-111.3	168.7	-170.2	-176.9	3.1	109.8
4	F	37.8	Very low	38.2	Very low	203 Å²	203	161.8 Å²	161.8	89%	0.89	82%	0.82	S	S	*	*			trans	-93.2	178.2	157.4	-83	-84	0	0	0	109.8
5	P	50.3	Low	38.9	Very low	117 Å²	117	158.8 Å²	158.8	76%	0.76	81%	0.813	S	S	*	*			cis	-127.7	-139.8	9	36	-10.6	0	0	0	112
6	S	32.5	Very low	39.5	Very low	95 Å²	95	156.9 Å²	156.9	66%	0.664	81%	0.812	S	S	*	*			cis	-166	132.9	3.4	37.1	0	0	0	0	115.6
7	V	34.9	Very low	40.1	Very low	131 Å²	131	158.3 Å²	158.3	79%	0.794	81%	0.81	S	S	*	*				59.8	117.4	127	-173.8	0	0	0	0	123.6
8	S	35.4	Very low	40.6	Very low	112 Å²	112	155.7 Å²	155.7	78%	0.783	81%	0.807	S	S	*	*			trans	70.7	158.2	149.7	85.7	0	0	0	0	118.7
9	S	32.1	Very low	41.2	Very low	98 Å²	98	152.5 Å²	152.5	69%	0.685	80%	0.795	S	S	*	*			cis	-152.1	161.2	29	55.4	0	0	0	0	114.2
10	A	46.2	Very low	42	Very low	102 Å²	102	147.7 Å²	147.7	84%	0.843	78%	0.775	S	S	*	*			trans	-89	134.7	174.1	0	0	0	0	0	111.6
11	K	34.7	Very low	42.7	Very low	190 Å²	190	142.6 Å²	142.6	83%	0.826	76%	0.755	S	S	*	*			trans	-128.9	112.1	167.4	-81.5	-174.7	176.1	175.5	0	111.3
12	Y	45.3	Very low	43.9	Very low	209 Å²	209	133.5 Å²	133.5	82%	0.82	72%	0.719	S	S	*	*			trans	-82.8	111.4	176.5	-159.2	-94.4	0	0	0	109.1	R14	Y12-R14 HydrophobicContact CE1-CG 4.32Å
13	Q	37.7	Very low	45.6	Very low	169 Å²	169	132.6 Å²	132.6	79%	0.79	71%	0.713	S	S	*	*			trans	-126.3	108.5	174.1	-78.5	-167.6	-31.6	0	0	112.2
14	R	49.2	Very low	47.1	Very low	221 Å²	221	130 Å²	130	83%	0.834	70%	0.703	S	S	*	*			trans	-76.5	110	164.5	-72.2	173	167.2	173.5	-4.1	109.2	Y12	Y12-R14 HydrophobicContact CE1-CG 4.32Å
15	T	47.8	Very low	48.5	Very low	117 Å²	117	129.4 Å²	129.4	72%	0.718	70%	0.695	S	S	*	*			trans	-147.1	12.8	170.8	2.5	0	0	0	0	116.2	K17	T15-K17 PolarHBondContact O-N 2.89Å
16	T	49.6	Very low	49.4	Very low	129 Å²	129	130.1 Å²	130.1	79%	0.791	69%	0.686	S	S	*	*			trans	-101.8	61.1	-177.9	36.6	0	0	0	0	114.1
17	K	48.6	Very low	51	Low	180 Å²	180	131.4 Å²	131.4	78%	0.783	68%	0.682	S	S	*	*	S	Bend	trans	-135	-15.4	169.3	-81.2	-163.4	172.8	-174.5	0	117.5	T15	T15-K17 PolarHBondContact O-N 2.89Å
18	C	49.6	Very low	52.3	Low	111 Å²	111	130 Å²	130	75%	0.75	67%	0.669	S	S	*	*	H	α-helix	trans	-83.5	-38.1	-178.6	-67.5	0	0	0	0	114.1	A22	C18-A22 PolarHBondContact O-N 3.16Å
19	T	51.5	Low	53.7	Low	96 Å²	96	128 Å²	128	59%	0.589	66%	0.655	S	S	*	*	H	α-helix	trans	-66.9	-44.6	-177.9	34.7	0	0	0	0	113	A21 A22 Q23	T19-A21 PolarHBondContact O-N 3.26Å; T19-A22 PolarHBondContact O-N 3.26Å; T19-Q23 PolarHBondContact O-N 3.17Å
20	S	57.8	Low	55.4	Low	55 Å²	55	131.5 Å²	131.5	39%	0.385	65%	0.653	S	S	.	*	H	α-helix	trans	-63.4	-42.2	178.2	56.7	0	0	0	0	112.1	A22 Q23 W24	S20-A22 VanDerWaalsContact C-N 3.32Å; S20-A22 PolarHBondContact O-N 2.94Å; S20-Q23 PolarHBondContact O-N 3.28Å; S20-W24 WeakPolarHBondContact O-CB 3.11Å; S20-W24 PolarHBondContact O-N 3.37Å
21	A	56	Low	56.4	Low	42 Å²	42	133.9 Å²	133.9	35%	0.347	64%	0.644	S	S	.	*	H	α-helix	trans	-61.8	-38	175.6	0	0	0	0	0	112.6	T19 R25	T19-A21 PolarHBondContact O-N 3.26Å; A21-R25 WeakPolarHBondContact O-CB 3.43Å; A21-R25 VanDerWaalsContact O-CG 3.28Å; A21-R25 WeakPolarHBondContact O-CG 3.22Å; A21-R25 PolarHBondContact O-N 3.2Å
22	A	64	Low	57.4	Low	58 Å²	58	133.4 Å²	133.4	48%	0.479	64%	0.637	S	S	.	*	H	α-helix	trans	-68.9	-43	175.2	0	0	0	0	0	112.4	C18 T19 S20 R25 K26	C18-A22 PolarHBondContact O-N 3.16Å; T19-A22 PolarHBondContact O-N 3.26Å; S20-A22 VanDerWaalsContact C-N 3.32Å; S20-A22 PolarHBondContact O-N 2.94Å; A22-R25 PolarHBondContact O-N 2.91Å; A22-K26 WeakPolarHBondContact O-CB 3.34Å; A22-K26 PolarHBondContact O-N 3.13Å
23	Q	66	Low	58.3	Low	132 Å²	132	130.8 Å²	130.8	62%	0.617	63%	0.627	S	S	*	*	H	α-helix	trans	-63.6	-44.3	174.9	-76.3	176.2	-75.2	0	0	112.1	T19 S20 R25 K26 Q27	T19-Q23 PolarHBondContact O-N 3.17Å; S20-Q23 PolarHBondContact O-N 3.28Å; Q23-R25 PolarHBondContact O-N 3.32Å; Q23-K26 CarbonylContact O-C 3.49Å; Q23-K26 PolarHBondContact O-N 3.2Å; Q23-K26 VanDerWaalsContact O-N 3.13Å; Q23-Q27 PolarHBondContact O-N 3.46Å
24	W	62.6	Low	59.6	Low	164 Å²	164	125.2 Å²	125.2	62%	0.621	61%	0.607	S	S	*	*	H	α-helix	trans	-60.3	-44	175.7	-93.2	94.5	0	0	0	112.1	S20 K26 Q27 L28	S20-W24 WeakPolarHBondContact O-CB 3.11Å; S20-W24 PolarHBondContact O-N 3.37Å; W24-K26 VanDerWaalsContact C-N 3.32Å; W24-K26 PolarHBondContact O-N 2.96Å; W24-Q27 PolarHBondContact O-N 3.1Å; W24-L28 HydrophobicContact CE3-CD1 4.39Å; W24-L28 HydrophobicContact CE3-CG 4.44Å; W24-L28 WeakPolarHBondContact O-CB 3.1Å; W24-L28 VanDerWaalsContact O-CG 3.29Å; W24-L28 WeakPolarHBondContact O-CG 3.27Å; W24-L28 PolarHBondContact O-N 3.32Å
25	R	66.6	Low	60.2	Low	189 Å²	189	120.4 Å²	120.4	71%	0.713	60%	0.595	S	S	*	*	H	α-helix	trans	-59.6	-41	173.2	-74.3	171.6	-177	173.9	1.2	112	A21 A22 Q23 L28 S29	A21-R25 WeakPolarHBondContact O-CB 3.43Å; A21-R25 VanDerWaalsContact O-CG 3.28Å; A21-R25 WeakPolarHBondContact O-CG 3.22Å; A21-R25 PolarHBondContact O-N 3.2Å; A22-R25 PolarHBondContact O-N 2.91Å; Q23-R25 PolarHBondContact O-N 3.32Å; R25-L28 PolarHBondContact O-N 3.34Å; R25-S29 WeakPolarHBondContact O-CB 3.36Å; R25-S29 PolarHBondContact O-N 3.27Å; R25-S29 PolarHBondContact O-OG 3.37Å
26	K	69.3	Low	61.2	Low	133 Å²	133	118.9 Å²	118.9	58%	0.578	58%	0.583	S	S	*	*	H	α-helix	trans	-73.3	-26.9	179.3	-165	169	-175.6	173	0	113.6	A22 Q23 W24 S29 R30	A22-K26 WeakPolarHBondContact O-CB 3.34Å; A22-K26 PolarHBondContact O-N 3.13Å; Q23-K26 CarbonylContact O-C 3.49Å; Q23-K26 PolarHBondContact O-N 3.2Å; Q23-K26 VanDerWaalsContact O-N 3.13Å; W24-K26 VanDerWaalsContact C-N 3.32Å; W24-K26 PolarHBondContact O-N 2.96Å; K26-S29 PolarHBondContact O-OG 3.43Å; K26-R30 WeakPolarHBondContact O-CB 3.48Å; K26-R30 VanDerWaalsContact O-CG 3.31Å; K26-R30 WeakPolarHBondContact O-CG 3.4Å; K26-R30 PolarHBondContact O-N 3.37Å
27	Q	67.3	Low	62.2	Low	121 Å²	121	116.8 Å²	116.8	57%	0.565	56%	0.564	S	S	*	*	H	α-helix	trans	-76.5	-42.1	169.1	-79.1	-179.3	-42.6	0	0	111.7	Q23 W24 R30 K31	Q23-Q27 PolarHBondContact O-N 3.46Å; W24-Q27 PolarHBondContact O-N 3.1Å; Q27-R30 PolarHBondContact O-N 3.27Å; Q27-K31 VanDerWaalsContact O-CB 3.32Å; Q27-K31 WeakPolarHBondContact O-CB 3.35Å; Q27-K31 PolarHBondContact O-N 3.18Å
28	L	61.9	Low	63.4	Low	103 Å²	103	113 Å²	113	54%	0.539	55%	0.552	S	S	.	*	H	α-helix	trans	-64.7	-39.6	176.6	-74.3	167.2	0	0	0	112.1	W24 R25 K31 R32	W24-L28 HydrophobicContact CE3-CD1 4.39Å; W24-L28 HydrophobicContact CE3-CG 4.44Å; W24-L28 WeakPolarHBondContact O-CB 3.1Å; W24-L28 VanDerWaalsContact O-CG 3.29Å; W24-L28 WeakPolarHBondContact O-CG 3.27Å; W24-L28 PolarHBondContact O-N 3.32Å; R25-L28 PolarHBondContact O-N 3.34Å; L28-K31 PolarHBondContact O-N 3.08Å; L28-R32 VanDerWaalsContact O-CB 3.27Å; L28-R32 WeakPolarHBondContact O-CB 3.39Å; L28-R32 PolarHBondContact O-N 2.88Å
29	S	64.9	Low	64.6	Low	68 Å²	68	113.9 Å²	113.9	48%	0.476	54%	0.544	S	S	.	.	H	α-helix	trans	-66.5	-43.4	175	65.4	0	0	0	0	112.1	R25 K26 R32 Y33	R25-S29 WeakPolarHBondContact O-CB 3.36Å; R25-S29 PolarHBondContact O-N 3.27Å; R25-S29 PolarHBondContact O-OG 3.37Å; K26-S29 PolarHBondContact O-OG 3.43Å; S29-R32 PolarHBondContact O-N 3.43Å; S29-Y33 VanDerWaalsContact O-CB 3.3Å; S29-Y33 WeakPolarHBondContact O-CB 3.43Å; S29-Y33 PolarHBondContact O-N 3.39Å
30	R	66.9	Low	65.9	Low	173 Å²	173	115.6 Å²	115.6	65%	0.653	55%	0.545	S	S	*	.	H	α-helix	trans	-61.9	-43	173.6	-79.2	176	166.2	-175	-7.1	112.9	K26 Q27 R32 Y33 S34	K26-R30 WeakPolarHBondContact O-CB 3.48Å; K26-R30 VanDerWaalsContact O-CG 3.31Å; K26-R30 WeakPolarHBondContact O-CG 3.4Å; K26-R30 PolarHBondContact O-N 3.37Å; Q27-R30 PolarHBondContact O-N 3.27Å; R30-R32 VanDerWaalsContact C-N 3.35Å; R30-Y33 PolarHBondContact O-N 3.48Å; R30-S34 WeakPolarHBondContact O-CB 3.45Å; R30-S34 PolarHBondContact O-N 3.11Å
31	K	66.4	Low	67	Low	151 Å²	151	119.4 Å²	119.4	66%	0.657	56%	0.556	S	S	*	*	H	α-helix	trans	-71.6	-29.3	179.3	-170	170.9	-176.8	177.2	0	112.4	Q27 L28 M35	Q27-K31 VanDerWaalsContact O-CB 3.32Å; Q27-K31 WeakPolarHBondContact O-CB 3.35Å; Q27-K31 PolarHBondContact O-N 3.18Å; L28-K31 PolarHBondContact O-N 3.08Å; K31-M35 VanDerWaalsContact O-CB 3.22Å; K31-M35 WeakPolarHBondContact O-CB 3.45Å; K31-M35 PolarHBondContact O-N 3.18Å
32	R	55.9	Low	68.2	Low	180 Å²	180	120.8 Å²	120.8	68%	0.679	56%	0.564	S	S	*	*	H	α-helix	trans	-70.5	-52.5	170	-176.6	174	-64.7	174.9	-1.6	110.5	L28 S29 R30 S34 M35 D36	L28-R32 VanDerWaalsContact O-CB 3.27Å; L28-R32 WeakPolarHBondContact O-CB 3.39Å; L28-R32 PolarHBondContact O-N 2.88Å; S29-R32 PolarHBondContact O-N 3.43Å; R30-R32 VanDerWaalsContact C-N 3.35Å; R32-S34 PolarHBondContact O-N 3.22Å; R32-M35 CarbonylContact O-C 3.58Å; R32-M35 WeakPolarHBondContact O-CA 3.38Å; R32-M35 WeakPolarHBondContact O-CB 3.42Å; R32-M35 PolarHBondContact O-N 3.24Å; R32-D36 VanDerWaalsContact CG-OD2 3.3Å; R32-D36 WeakPolarHBondContact CG-OD2 3.5Å; R32-D36 PolarHBondContact O-N 3.13Å
33	Y	65.8	Low	69.4	Low	154 Å²	154	121.5 Å²	121.5	60%	0.604	56%	0.56	S	S	*	*	H	α-helix	trans	-52.4	-51.7	177.1	-172.8	-110	0	0	0	112.2	S29 R30 M35 D36 E37	S29-Y33 VanDerWaalsContact O-CB 3.3Å; S29-Y33 WeakPolarHBondContact O-CB 3.43Å; S29-Y33 PolarHBondContact O-N 3.39Å; R30-Y33 PolarHBondContact O-N 3.48Å; Y33-M35 VanDerWaalsContact C-N 3.27Å; Y33-M35 PolarHBondContact O-N 3.26Å; Y33-D36 CarbonylContact O-C 3.56Å; Y33-D36 PolarHBondContact O-N 3Å; Y33-D36 VanDerWaalsContact O-N 3.1Å; Y33-E37 HydrophobicContact CD1-CG 4.26Å; Y33-E37 VanDerWaalsContact CD1-OE2 3.25Å; Y33-E37 WeakPolarHBondContact CD1-OE2 3.23Å; Y33-E37 HydrophobicContact CE1-CG 4.11Å; Y33-E37 WeakPolarHBondContact CE1-OE1 3.41Å; Y33-E37 WeakPolarHBondContact CE1-OE2 3.27Å; Y33-E37 WeakPolarHBondContact O-CG 3.46Å; Y33-E37 PolarHBondContact O-N 2.67Å
34	S	64.2	Low	70.4	Confident	53 Å²	53	121 Å²	121	37%	0.371	56%	0.559	S	S	.	*	H	α-helix	trans	-65	-25.9	176.2	170.9	0	0	0	0	114.2	R30 R32 E37 N38	R30-S34 WeakPolarHBondContact O-CB 3.45Å; R30-S34 PolarHBondContact O-N 3.11Å; R32-S34 PolarHBondContact O-N 3.22Å; S34-E37 WeakPolarHBondContact CA-OE2 3.3Å; S34-N38 WeakPolarHBondContact O-CB 3.33Å; S34-N38 PolarHBondContact O-N 3.33Å; S34-N38 VanDerWaalsContact O-N 3.08Å; S34-N38 PolarHBondContact O-ND2 3.03Å; S34-N38 PolarHBondContact O-OD1 2.8Å
35	M	62.1	Low	71.7	Confident	119 Å²	119	116.9 Å²	116.9	59%	0.586	55%	0.552	S	S	*	*	H	α-helix	trans	-78.3	-33	173.7	-175.2	176.2	-66.2	0	0	111.9	K31 R32 Y33 K39	K31-M35 VanDerWaalsContact O-CB 3.22Å; K31-M35 WeakPolarHBondContact O-CB 3.45Å; K31-M35 PolarHBondContact O-N 3.18Å; R32-M35 CarbonylContact O-C 3.58Å; R32-M35 WeakPolarHBondContact O-CA 3.38Å; R32-M35 WeakPolarHBondContact O-CB 3.42Å; R32-M35 PolarHBondContact O-N 3.24Å; Y33-M35 VanDerWaalsContact C-N 3.27Å; Y33-M35 PolarHBondContact O-N 3.26Å; M35-K39 VanDerWaalsContact O-CB 3.26Å; M35-K39 WeakPolarHBondContact O-CB 3.49Å; M35-K39 PolarHBondContact O-N 2.93Å
36	D	67.9	Low	73	Confident	86 Å²	86	113.5 Å²	113.5	46%	0.46	54%	0.544	S	S	.	.	H	α-helix	trans	-73	-42.2	173.4	-63.7	-38.4	0	0	0	110.5	R32 Y33 K39 E40	R32-D36 VanDerWaalsContact CG-OD2 3.3Å; R32-D36 WeakPolarHBondContact CG-OD2 3.5Å; R32-D36 PolarHBondContact O-N 3.13Å; Y33-D36 CarbonylContact O-C 3.56Å; Y33-D36 PolarHBondContact O-N 3Å; Y33-D36 VanDerWaalsContact O-N 3.1Å; D36-K39 CarbonylContact O-C 3.53Å; D36-K39 WeakPolarHBondContact O-CB 3.34Å; D36-K39 PolarHBondContact O-N 2.73Å; D36-E40 WeakPolarHBondContact O-CB 3.35Å; D36-E40 PolarHBondContact O-N 3.24Å
37	E	70.2	Confident	74.1	Confident	85 Å²	85	112 Å²	112	40%	0.397	54%	0.542	S	S	.	.	H	α-helix	trans	-58.4	-52.4	172.1	-72.9	174.4	123.7	0	0	111.7	Y33 S34 K39 E40 E41	Y33-E37 HydrophobicContact CD1-CG 4.26Å; Y33-E37 VanDerWaalsContact CD1-OE2 3.25Å; Y33-E37 WeakPolarHBondContact CD1-OE2 3.23Å; Y33-E37 HydrophobicContact CE1-CG 4.11Å; Y33-E37 WeakPolarHBondContact CE1-OE1 3.41Å; Y33-E37 WeakPolarHBondContact CE1-OE2 3.27Å; Y33-E37 WeakPolarHBondContact O-CG 3.46Å; Y33-E37 PolarHBondContact O-N 2.67Å; S34-E37 WeakPolarHBondContact CA-OE2 3.3Å; E37-K39 PolarHBondContact O-N 2.86Å; E37-E40 WeakPolarHBondContact O-CB 3.41Å; E37-E40 PolarHBondContact O-N 2.9Å; E37-E40 VanDerWaalsContact O-N 3.09Å; E37-E41 PolarHBondContact O-N 3.07Å
38	N	73.6	Confident	75.4	Confident	100 Å²	100	109.9 Å²	109.9	54%	0.535	54%	0.54	S	S	.	.	H	α-helix	trans	-60.2	-31.4	177.4	-71.9	-13.4	0	0	0	112.1	S34 S42	S34-N38 WeakPolarHBondContact O-CB 3.33Å; S34-N38 PolarHBondContact O-N 3.33Å; S34-N38 VanDerWaalsContact O-N 3.08Å; S34-N38 PolarHBondContact O-ND2 3.03Å; S34-N38 PolarHBondContact O-OD1 2.8Å; N38-S42 WeakPolarHBondContact O-CB 3.36Å; N38-S42 PolarHBondContact O-N 3.03Å; N38-S42 VanDerWaalsContact O-N 3.12Å
39	K	76.6	Confident	77	Confident	130 Å²	130	110.2 Å²	110.2	57%	0.565	54%	0.542	S	S	*	.	H	α-helix	trans	-76.3	-37.7	176.3	-174	179	-178.9	-176	0	111.4	M35 D36 E37 S42 N43	M35-K39 VanDerWaalsContact O-CB 3.26Å; M35-K39 WeakPolarHBondContact O-CB 3.49Å; M35-K39 PolarHBondContact O-N 2.93Å; D36-K39 CarbonylContact O-C 3.53Å; D36-K39 WeakPolarHBondContact O-CB 3.34Å; D36-K39 PolarHBondContact O-N 2.73Å; E37-K39 PolarHBondContact O-N 2.86Å; K39-S42 PolarHBondContact O-N 2.81Å; K39-N43 WeakPolarHBondContact O-CB 3.38Å; K39-N43 PolarHBondContact O-N 2.9Å; K39-N43 PolarHBondContact O-ND2 3.2Å; K39-N43 PolarHBondContact O-OD1 3.42Å
40	E	78.4	Confident	78.5	Confident	132 Å²	132	111 Å²	111	62%	0.617	54%	0.54	S	S	*	.	H	α-helix	trans	-63.9	-45.1	173.8	-173	168.8	-174.3	0	0	111.3	D36 E37 S42 N43 M44	D36-E40 WeakPolarHBondContact O-CB 3.35Å; D36-E40 PolarHBondContact O-N 3.24Å; E37-E40 WeakPolarHBondContact O-CB 3.41Å; E37-E40 PolarHBondContact O-N 2.9Å; E37-E40 VanDerWaalsContact O-N 3.09Å; E40-S42 PolarHBondContact O-N 3.2Å; E40-N43 PolarHBondContact O-N 3.35Å; E40-M44 WeakPolarHBondContact O-CB 3.49Å; E40-M44 VanDerWaalsContact O-CG 3.26Å; E40-M44 WeakPolarHBondContact O-CG 3.22Å; E40-M44 PolarHBondContact O-N 3.07Å
41	E	79.4	Confident	79.8	Confident	134 Å²	134	106.4 Å²	106.4	63%	0.626	53%	0.528	S	S	*	.	H	α-helix	trans	-63.5	-40.8	175.1	-173	173.2	-146.1	0	0	112.2	E37 M44 T45	E37-E41 PolarHBondContact O-N 3.07Å; E41-M44 PolarHBondContact O-N 3.27Å; E41-T45 WeakPolarHBondContact O-CB 3.37Å; E41-T45 PolarHBondContact O-N 3.16Å; E41-T45 PolarHBondContact O-OG1 2.86Å
42	S	83	Confident	81.3	Confident	72 Å²	72	101.1 Å²	101.1	50%	0.503	52%	0.516	S	S	.	.	H	α-helix	trans	-61.4	-48.1	173	-174.2	0	0	0	0	111.9	N38 K39 E40 M44 T45 E46	N38-S42 WeakPolarHBondContact O-CB 3.36Å; N38-S42 PolarHBondContact O-N 3.03Å; N38-S42 VanDerWaalsContact O-N 3.12Å; K39-S42 PolarHBondContact O-N 2.81Å; E40-S42 PolarHBondContact O-N 3.2Å; S42-M44 PolarHBondContact O-N 3.4Å; S42-T45 PolarHBondContact O-N 3.41Å; S42-E46 PolarHBondContact O-N 2.88Å
43	N	87.8	Confident	83.2	Confident	73 Å²	73	96.3 Å²	96.3	39%	0.39	51%	0.51	S	S	.	.	H	α-helix	trans	-62.6	-41.9	177.9	-67.5	-14.6	0	0	0	111.4	K39 E40 T45 E46 I47	K39-N43 WeakPolarHBondContact O-CB 3.38Å; K39-N43 PolarHBondContact O-N 2.9Å; K39-N43 PolarHBondContact O-ND2 3.2Å; K39-N43 PolarHBondContact O-OD1 3.42Å; E40-N43 PolarHBondContact O-N 3.35Å; N43-T45 VanDerWaalsContact C-N 3.33Å; N43-T45 PolarHBondContact O-N 3.21Å; N43-E46 PolarHBondContact O-N 2.98Å; N43-I47 WeakPolarHBondContact O-CB 3.37Å; N43-I47 VanDerWaalsContact O-CG1 3.26Å; N43-I47 WeakPolarHBondContact O-CG1 3.28Å; N43-I47 PolarHBondContact O-N 3.48Å
44	M	87.9	Confident	84.7	Confident	121 Å²	121	93.7 Å²	93.7	60%	0.596	51%	0.506	S	S	*	.	H	α-helix	trans	-64.9	-37.9	177.4	-77.5	-68.8	-77.3	0	0	111.8	E40 E41 S42 S48	E40-M44 WeakPolarHBondContact O-CB 3.49Å; E40-M44 VanDerWaalsContact O-CG 3.26Å; E40-M44 WeakPolarHBondContact O-CG 3.22Å; E40-M44 PolarHBondContact O-N 3.07Å; E41-M44 PolarHBondContact O-N 3.27Å; S42-M44 PolarHBondContact O-N 3.4Å; M44-S48 WeakPolarHBondContact O-CB 3.46Å; M44-S48 PolarHBondContact O-N 2.73Å
45	T	90.3	Very high	86.3	Confident	77 Å²	77	98.5 Å²	98.5	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-65.2	-43.3	173.7	-59.5	0	0	0	0	111.3	E41 S42 N43 S48 N49	E41-T45 WeakPolarHBondContact O-CB 3.37Å; E41-T45 PolarHBondContact O-N 3.16Å; E41-T45 PolarHBondContact O-OG1 2.86Å; S42-T45 PolarHBondContact O-N 3.41Å; N43-T45 VanDerWaalsContact C-N 3.33Å; N43-T45 PolarHBondContact O-N 3.21Å; T45-S48 PolarHBondContact O-N 2.91Å; T45-N49 PolarHBondContact O-N 3.14Å; T45-N49 PolarHBondContact O-ND2 3.17Å
46	E	92.8	Very high	87.9	Confident	118 Å²	118	100.2 Å²	100.2	55%	0.551	52%	0.52	S	S	*	.	H	α-helix	trans	-62.4	-49	175.2	-171.5	178.3	174.7	0	0	111.9	S42 N43 S48 N49 I50	S42-E46 PolarHBondContact O-N 2.88Å; N43-E46 PolarHBondContact O-N 2.98Å; E46-S48 VanDerWaalsContact C-N 3.31Å; E46-S48 PolarHBondContact O-N 3.15Å; E46-N49 WeakPolarHBondContact O-CB 3.47Å; E46-N49 PolarHBondContact O-N 3.32Å; E46-N49 VanDerWaalsContact O-N 3.16Å; E46-I50 HydrophobicContact CG-CD1 4.03Å; E46-I50 WeakPolarHBondContact O-CG1 3.37Å; E46-I50 PolarHBondContact O-N 3.16Å
47	I	93.3	Very high	89.3	Confident	103 Å²	103	102.4 Å²	102.4	53%	0.528	53%	0.526	S	S	.	.	H	α-helix	trans	-61	-39.4	177.4	-69.5	165.5	0	0	0	111.2	N43 I50 L51	N43-I47 WeakPolarHBondContact O-CB 3.37Å; N43-I47 VanDerWaalsContact O-CG1 3.26Å; N43-I47 WeakPolarHBondContact O-CG1 3.28Å; N43-I47 PolarHBondContact O-N 3.48Å; I47-I50 PolarHBondContact O-N 3.07Å; I47-L51 WeakPolarHBondContact O-CB 3.28Å; I47-L51 PolarHBondContact O-N 2.96Å
48	S	93.7	Very high	90.6	Very high	76 Å²	76	102.7 Å²	102.7	53%	0.531	53%	0.533	S	S	.	.	H	α-helix	trans	-62.9	-43.4	175.1	-172.4	0	0	0	0	111.9	M44 T45 E46 L51 G52	M44-S48 WeakPolarHBondContact O-CB 3.46Å; M44-S48 PolarHBondContact O-N 2.73Å; T45-S48 PolarHBondContact O-N 2.91Å; E46-S48 VanDerWaalsContact C-N 3.31Å; E46-S48 PolarHBondContact O-N 3.15Å; S48-L51 PolarHBondContact O-N 3.4Å; S48-G52 PolarHBondContact O-N 2.84Å
49	N	95.4	Very high	91.8	Very high	110 Å²	110	106.7 Å²	106.7	59%	0.588	54%	0.541	S	S	*	.	H	α-helix	trans	-64.2	-42.1	174.9	-75.5	-41.1	0	0	0	112.2	T45 E46 G52 S53	T45-N49 PolarHBondContact O-N 3.14Å; T45-N49 PolarHBondContact O-ND2 3.17Å; E46-N49 WeakPolarHBondContact O-CB 3.47Å; E46-N49 PolarHBondContact O-N 3.32Å; E46-N49 VanDerWaalsContact O-N 3.16Å; N49-G52 PolarHBondContact O-N 3.39Å; N49-S53 WeakPolarHBondContact O-CB 3.32Å; N49-S53 PolarHBondContact O-N 2.61Å
50	I	96.1	Very high	92.7	Very high	84 Å²	84	104.3 Å²	104.3	43%	0.431	54%	0.537	S	S	.	.	H	α-helix	trans	-61.3	-46.6	174	-68.8	166.2	0	0	0	110.4	E46 I47 G52 S53 L54	E46-I50 HydrophobicContact CG-CD1 4.03Å; E46-I50 WeakPolarHBondContact O-CG1 3.37Å; E46-I50 PolarHBondContact O-N 3.16Å; I47-I50 PolarHBondContact O-N 3.07Å; I50-G52 VanDerWaalsContact C-N 3.33Å; I50-G52 PolarHBondContact O-N 3.35Å; I50-S53 WeakPolarHBondContact O-CB 3.18Å; I50-S53 PolarHBondContact O-N 3.46Å; I50-L54 HydrophobicContact CG2-CD1 3.93Å; I50-L54 HydrophobicContact CG2-CG 4.34Å; I50-L54 WeakPolarHBondContact O-CG 3.04Å; I50-L54 PolarHBondContact O-N 2.98Å
51	L	95.4	Very high	93.6	Very high	77 Å²	77	103.8 Å²	103.8	40%	0.403	54%	0.536	S	S	.	.	H	α-helix	trans	-61.5	-39.9	177	179.4	60.5	0	0	0	112	I47 S48 R55	I47-L51 WeakPolarHBondContact O-CB 3.28Å; I47-L51 PolarHBondContact O-N 2.96Å; S48-L51 PolarHBondContact O-N 3.4Å; L51-R55 HydrophobicContact CD1-CG 4.36Å; L51-R55 WeakPolarHBondContact O-CB 3.45Å; L51-R55 WeakPolarHBondContact O-CG 3.15Å; L51-R55 PolarHBondContact O-N 2.93Å
52	G	96.9	Very high	94.4	Very high	39 Å²	39	101 Å²	101	40%	0.402	53%	0.532	S	S	.	.	H	α-helix	trans	-61.2	-45.5	172.2	0	0	0	0	0	112.6	S48 N49 I50 R55 K56	S48-G52 PolarHBondContact O-N 2.84Å; N49-G52 PolarHBondContact O-N 3.39Å; I50-G52 VanDerWaalsContact C-N 3.33Å; I50-G52 PolarHBondContact O-N 3.35Å; G52-R55 PolarHBondContact O-N 3.27Å; G52-K56 WeakPolarHBondContact O-CB 3.28Å; G52-K56 PolarHBondContact O-N 3.17Å
53	S	96.8	Very high	95	Very high	79 Å²	79	104.7 Å²	104.7	55%	0.552	54%	0.539	S	S	*	.	H	α-helix	trans	-61.6	-46.3	175.9	-173.2	0	0	0	0	112.2	N49 I50 K56 K57	N49-S53 WeakPolarHBondContact O-CB 3.32Å; N49-S53 PolarHBondContact O-N 2.61Å; I50-S53 WeakPolarHBondContact O-CB 3.18Å; I50-S53 PolarHBondContact O-N 3.46Å; S53-K56 WeakPolarHBondContact O-CB 3.48Å; S53-K56 PolarHBondContact O-N 3.28Å; S53-K57 PolarHBondContact O-N 3.02Å
54	L	97	Very high	95.3	Very high	99 Å²	99	103.3 Å²	103.3	52%	0.518	53%	0.533	S	S	.	.	H	α-helix	trans	-62.7	-45.1	176.3	-70	172.9	0	0	0	111.7	I50 K56 K57 V58	I50-L54 HydrophobicContact CG2-CD1 3.93Å; I50-L54 HydrophobicContact CG2-CG 4.34Å; I50-L54 WeakPolarHBondContact O-CG 3.04Å; I50-L54 PolarHBondContact O-N 2.98Å; L54-K56 VanDerWaalsContact C-N 3.3Å; L54-K56 PolarHBondContact O-N 3.1Å; L54-K57 PolarHBondContact O-N 3.36Å; L54-K57 VanDerWaalsContact O-N 3.14Å; L54-V58 WeakPolarHBondContact O-CG2 3.39Å; L54-V58 PolarHBondContact O-N 2.98Å
55	R	97.3	Very high	95.7	Very high	155 Å²	155	104.2 Å²	104.2	59%	0.585	53%	0.533	S	S	*	.	H	α-helix	trans	-59.5	-38.5	174.2	-75.2	169.3	173.3	-179	-1.8	112	L51 G52 R59	L51-R55 HydrophobicContact CD1-CG 4.36Å; L51-R55 WeakPolarHBondContact O-CB 3.45Å; L51-R55 WeakPolarHBondContact O-CG 3.15Å; L51-R55 PolarHBondContact O-N 2.93Å; G52-R55 PolarHBondContact O-N 3.27Å; R55-R59 WeakPolarHBondContact O-CG 3.45Å; R55-R59 PolarHBondContact O-N 2.9Å
56	K	97	Very high	95.8	Very high	154 Å²	154	106.3 Å²	106.3	67%	0.67	54%	0.538	S	S	*	.	H	α-helix	trans	-65.4	-44.9	172.9	-173.5	179.2	179.4	-179	0	111.4	G52 S53 L54 R59 T60	G52-K56 WeakPolarHBondContact O-CB 3.28Å; G52-K56 PolarHBondContact O-N 3.17Å; S53-K56 WeakPolarHBondContact O-CB 3.48Å; S53-K56 PolarHBondContact O-N 3.28Å; L54-K56 VanDerWaalsContact C-N 3.3Å; L54-K56 PolarHBondContact O-N 3.1Å; K56-R59 PolarHBondContact O-N 3.3Å; K56-T60 PolarHBondContact O-N 3Å; K56-T60 VanDerWaalsContact O-N 3.09Å; K56-T60 PolarHBondContact O-OG1 3.41Å
57	K	97.2	Very high	95.8	Very high	133 Å²	133	104.9 Å²	104.9	58%	0.578	53%	0.531	S	S	*	.	H	α-helix	trans	-62.6	-43.8	179	-167.9	172.3	-178	177.5	0	112.3	S53 L54 R59 T60 M61	S53-K57 PolarHBondContact O-N 3.02Å; L54-K57 PolarHBondContact O-N 3.36Å; L54-K57 VanDerWaalsContact O-N 3.14Å; K57-R59 PolarHBondContact O-N 2.85Å; K57-T60 PolarHBondContact O-N 3.27Å; K57-M61 HydrophobicContact CG-SD 4.15Å; K57-M61 WeakPolarHBondContact O-CG 3.49Å; K57-M61 PolarHBondContact O-N 2.86Å
58	V	97.7	Very high	95.8	Very high	91 Å²	91	108.3 Å²	108.3	55%	0.552	54%	0.537	S	S	*	.	H	α-helix	trans	-58.9	-45.7	174	171	0	0	0	0	111.2	L54 T60 M61 S62	L54-V58 WeakPolarHBondContact O-CG2 3.39Å; L54-V58 PolarHBondContact O-N 2.98Å; V58-T60 VanDerWaalsContact C-N 3.3Å; V58-T60 PolarHBondContact O-N 2.72Å; V58-M61 PolarHBondContact O-N 3.44Å; V58-S62 PolarHBondContact O-N 3.47Å; V58-S62 PolarHBondContact O-OG 3.32Å
59	R	97.3	Very high	95.9	Very high	183 Å²	183	108.5 Å²	108.5	69%	0.691	53%	0.53	S	S	*	.	H	α-helix	trans	-59	-39.5	176.2	-71.9	169.6	179.9	-179.6	-0.2	112.5	R55 K56 K57 K63	R55-R59 WeakPolarHBondContact O-CG 3.45Å; R55-R59 PolarHBondContact O-N 2.9Å; K56-R59 PolarHBondContact O-N 3.3Å; K57-R59 PolarHBondContact O-N 2.85Å; R59-K63 WeakPolarHBondContact O-CG 3.16Å; R59-K63 PolarHBondContact O-N 2.77Å
60	T	96.9	Very high	95.8	Very high	80 Å²	80	108.2 Å²	108.2	49%	0.491	53%	0.525	S	S	.	.	H	α-helix	trans	-65.3	-51	173.9	-56.4	0	0	0	0	111.2	K56 K57 V58 S62 K63 T64	K56-T60 PolarHBondContact O-N 3Å; K56-T60 VanDerWaalsContact O-N 3.09Å; K56-T60 PolarHBondContact O-OG1 3.41Å; K57-T60 PolarHBondContact O-N 3.27Å; V58-T60 VanDerWaalsContact C-N 3.3Å; V58-T60 PolarHBondContact O-N 2.72Å; T60-S62 VanDerWaalsContact C-N 3.32Å; T60-S62 PolarHBondContact O-N 3.4Å; T60-K63 WeakPolarHBondContact O-CB 3.44Å; T60-K63 PolarHBondContact O-N 2.72Å; T60-K63 VanDerWaalsContact O-N 3.09Å; T60-T64 PolarHBondContact O-N 3.34Å; T60-T64 PolarHBondContact O-OG1 2.91Å
61	M	96.8	Very high	95.6	Very high	122 Å²	122	106.6 Å²	106.6	60%	0.601	52%	0.517	S	S	*	.	H	α-helix	trans	-61.5	-37.6	-177.7	-68.5	177.4	78.2	0	0	112.6	K57 V58 T64 K65	K57-M61 HydrophobicContact CG-SD 4.15Å; K57-M61 WeakPolarHBondContact O-CG 3.49Å; K57-M61 PolarHBondContact O-N 2.86Å; V58-M61 PolarHBondContact O-N 3.44Å; M61-T64 PolarHBondContact O-N 3.05Å; M61-K65 WeakPolarHBondContact O-CB 3.39Å; M61-K65 PolarHBondContact O-N 3.19Å
62	S	96.5	Very high	95.6	Very high	76 Å²	76	108 Å²	108	53%	0.531	52%	0.52	S	S	.	.	H	α-helix	trans	-66.1	-36.7	174.4	-63.5	0	0	0	0	113	V58 T60 H66	V58-S62 PolarHBondContact O-N 3.47Å; V58-S62 PolarHBondContact O-OG 3.32Å; T60-S62 VanDerWaalsContact C-N 3.32Å; T60-S62 PolarHBondContact O-N 3.4Å; S62-H66 PolarHBondContact O-N 2.86Å; S62-H66 VanDerWaalsContact O-N 3.15Å
63	K	95.3	Very high	95.6	Very high	149 Å²	149	110.2 Å²	110.2	65%	0.648	53%	0.525	S	S	*	.	H	α-helix	trans	-65.4	-48.3	173	-74.2	-177.6	175.5	-165.6	0	111.2	R59 T60 K65 H66 Q67	R59-K63 WeakPolarHBondContact O-CG 3.16Å; R59-K63 PolarHBondContact O-N 2.77Å; T60-K63 WeakPolarHBondContact O-CB 3.44Å; T60-K63 PolarHBondContact O-N 2.72Å; T60-K63 VanDerWaalsContact O-N 3.09Å; K63-K65 VanDerWaalsContact C-N 3.32Å; K63-K65 PolarHBondContact O-N 2.95Å; K63-H66 WeakPolarHBondContact O-CB 3.41Å; K63-H66 PolarHBondContact O-N 3.15Å; K63-H66 VanDerWaalsContact O-N 3.12Å; K63-Q67 WeakPolarHBondContact O-CG 3.27Å; K63-Q67 PolarHBondContact O-N 3.43Å
64	T	94.6	Very high	95.4	Very high	44 Å²	44	109 Å²	109	27%	0.27	51%	0.509	S	S	.	.	H	α-helix	trans	-59.3	-41.7	176.8	-56	0	0	0	0	111.7	T60 M61 H66 Q67 W68	T60-T64 PolarHBondContact O-N 3.34Å; T60-T64 PolarHBondContact O-OG1 2.91Å; M61-T64 PolarHBondContact O-N 3.05Å; T64-H66 VanDerWaalsContact C-N 3.34Å; T64-H66 PolarHBondContact O-N 3.15Å; T64-Q67 PolarHBondContact O-N 3.37Å; T64-W68 HydrophobicContact CG2-CD2 3.98Å; T64-W68 VanDerWaalsContact CG2-CE2 3.45Å; T64-W68 HydrophobicContact CG2-CG 4.43Å; T64-W68 HydrophobicContact CG2-CH2 4.29Å; T64-W68 HydrophobicContact CG2-CZ2 3.63Å; T64-W68 WeakPolarHBondContact O-CB 3.25Å; T64-W68 VanDerWaalsContact O-CG 3.27Å; T64-W68 PolarHBondContact O-N 3.2Å
65	K	95.8	Very high	95.3	Very high	139 Å²	139	108.9 Å²	108.9	60%	0.604	51%	0.508	S	S	*	.	H	α-helix	trans	-58.3	-44.8	174.1	-176.4	-175.1	175.6	-174.8	0	111.9	M61 K63 W68 E69	M61-K65 WeakPolarHBondContact O-CB 3.39Å; M61-K65 PolarHBondContact O-N 3.19Å; K63-K65 VanDerWaalsContact C-N 3.32Å; K63-K65 PolarHBondContact O-N 2.95Å; K65-W68 PolarHBondContact O-N 2.93Å; K65-E69 PolarHBondContact O-N 2.89Å
66	H	93.2	Very high	95.3	Very high	122 Å²	122	108.2 Å²	108.2	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-61.7	-47.4	178.5	-176.4	14	0	0	0	111.4	S62 K63 T64 W68 E69 E70	S62-H66 PolarHBondContact O-N 2.86Å; S62-H66 VanDerWaalsContact O-N 3.15Å; K63-H66 WeakPolarHBondContact O-CB 3.41Å; K63-H66 PolarHBondContact O-N 3.15Å; K63-H66 VanDerWaalsContact O-N 3.12Å; T64-H66 VanDerWaalsContact C-N 3.34Å; T64-H66 PolarHBondContact O-N 3.15Å; H66-W68 VanDerWaalsContact C-N 3.28Å; H66-W68 PolarHBondContact O-N 3.1Å; H66-E69 PolarHBondContact O-N 3.5Å; H66-E69 VanDerWaalsContact O-N 3.14Å; H66-E70 IonicContact CE1-OE1 3.9Å; H66-E70 WeakPolarHBondContact O-CG 3.46Å; H66-E70 PolarHBondContact O-N 3.19Å
67	Q	91.4	Very high	95.2	Very high	88 Å²	88	104 Å²	104	41%	0.411	50%	0.497	S	S	.	.	H	α-helix	trans	-60.5	-35.8	176.1	-65.4	174.8	-68.8	0	0	112.5	K63 T64 E70 I71	K63-Q67 WeakPolarHBondContact O-CG 3.27Å; K63-Q67 PolarHBondContact O-N 3.43Å; T64-Q67 PolarHBondContact O-N 3.37Å; Q67-E70 WeakPolarHBondContact CA-OE2 3.48Å; Q67-E70 PolarHBondContact O-N 2.91Å; Q67-I71 WeakPolarHBondContact O-CB 3.26Å; Q67-I71 WeakPolarHBondContact O-CD1 3.31Å; Q67-I71 VanDerWaalsContact O-CG1 3.25Å; Q67-I71 WeakPolarHBondContact O-CG1 3.22Å; Q67-I71 PolarHBondContact O-N 3.34Å
68	W	94.4	Very high	95	Very high	174 Å²	174	99.5 Å²	99.5	66%	0.659	48%	0.477	S	S	*	.	H	α-helix	trans	-71	-33.2	175.9	-70.2	-3.3	0	0	0	113.1	T64 K65 H66 K72	T64-W68 HydrophobicContact CG2-CD2 3.98Å; T64-W68 VanDerWaalsContact CG2-CE2 3.45Å; T64-W68 HydrophobicContact CG2-CG 4.43Å; T64-W68 HydrophobicContact CG2-CH2 4.29Å; T64-W68 HydrophobicContact CG2-CZ2 3.63Å; T64-W68 WeakPolarHBondContact O-CB 3.25Å; T64-W68 VanDerWaalsContact O-CG 3.27Å; T64-W68 PolarHBondContact O-N 3.2Å; K65-W68 PolarHBondContact O-N 2.93Å; H66-W68 VanDerWaalsContact C-N 3.28Å; H66-W68 PolarHBondContact O-N 3.1Å; W68-K72 WeakPolarHBondContact O-CB 3.39Å; W68-K72 PolarHBondContact O-N 3.19Å
69	E	95	Very high	95	Very high	80 Å²	80	98.2 Å²	98.2	37%	0.374	47%	0.473	S	S	.	.	H	α-helix	trans	-70.6	-35.5	171.1	-68.7	-68.7	168.6	0	0	111.8	K65 H66 K72 T73	K65-E69 PolarHBondContact O-N 2.89Å; H66-E69 PolarHBondContact O-N 3.5Å; H66-E69 VanDerWaalsContact O-N 3.14Å; E69-K72 IonicContact OE1-NZ 2.72Å; E69-K72 PolarHBondContact OE1-NZ 2.89Å; E69-K72 WeakPolarHBondContact OE2-CD 3.48Å; E69-K72 WeakPolarHBondContact OE2-CE 3.33Å; E69-K72 IonicContact OE2-NZ 3.27Å; E69-K72 PolarHBondContact OE2-NZ 3.35Å; E69-T73 WeakPolarHBondContact O-CB 3.42Å; E69-T73 PolarHBondContact O-N 2.83Å; E69-T73 PolarHBondContact O-OG1 3.34Å
70	E	92.2	Very high	95	Very high	104 Å²	104	94.2 Å²	94.2	49%	0.486	47%	0.465	S	S	.	.	H	α-helix	trans	-62.3	-50.5	170.5	-67.4	176.9	129.6	0	0	111.3	H66 Q67 K72 T73 Y74	H66-E70 IonicContact CE1-OE1 3.9Å; H66-E70 WeakPolarHBondContact O-CG 3.46Å; H66-E70 PolarHBondContact O-N 3.19Å; Q67-E70 WeakPolarHBondContact CA-OE2 3.48Å; Q67-E70 PolarHBondContact O-N 2.91Å; E70-K72 PolarHBondContact O-N 3.41Å; E70-T73 PolarHBondContact O-N 2.7Å; E70-T73 VanDerWaalsContact O-N 3.17Å; E70-Y74 WeakPolarHBondContact O-CB 3.43Å; E70-Y74 PolarHBondContact O-N 3.33Å
71	I	93.6	Very high	94.9	Very high	50 Å²	50	95.9 Å²	95.9	26%	0.256	47%	0.467	S	S	.	.	H	α-helix	trans	-57.6	-47.9	176	-73.5	161.2	0	0	0	111.2	Q67 T73 Y74 I75 P232	Q67-I71 WeakPolarHBondContact O-CB 3.26Å; Q67-I71 WeakPolarHBondContact O-CD1 3.31Å; Q67-I71 VanDerWaalsContact O-CG1 3.25Å; Q67-I71 WeakPolarHBondContact O-CG1 3.22Å; Q67-I71 PolarHBondContact O-N 3.34Å; I71-T73 VanDerWaalsContact C-N 3.25Å; I71-T73 PolarHBondContact O-N 2.92Å; I71-Y74 PolarHBondContact O-N 2.96Å; I71-I75 HydrophobicContact CG2-CD1 3.66Å; I71-I75 HydrophobicContact CG2-CG1 4.32Å; I71-I75 VanDerWaalsContact O-CG1 3.27Å; I71-I75 WeakPolarHBondContact O-CG1 3.27Å; I71-I75 PolarHBondContact O-N 3.09Å; I71-P232 HydrophobicContact CG1-CB 3.59Å; I71-P232 HydrophobicContact CG1-CG 4.33Å
72	K	95.8	Very high	94.7	Very high	108 Å²	108	94.1 Å²	94.1	47%	0.47	46%	0.459	S	S	.	.	H	α-helix	trans	-61.2	-31.4	177.7	170.1	-179	157	-152.5	0	113	W68 E69 E70	W68-K72 WeakPolarHBondContact O-CB 3.39Å; W68-K72 PolarHBondContact O-N 3.19Å; E69-K72 IonicContact OE1-NZ 2.72Å; E69-K72 PolarHBondContact OE1-NZ 2.89Å; E69-K72 WeakPolarHBondContact OE2-CD 3.48Å; E69-K72 WeakPolarHBondContact OE2-CE 3.33Å; E69-K72 IonicContact OE2-NZ 3.27Å; E69-K72 PolarHBondContact OE2-NZ 3.35Å; E70-K72 PolarHBondContact O-N 3.41Å
73	T	94.9	Very high	94.8	Very high	85 Å²	85	94.9 Å²	94.9	52%	0.521	45%	0.454	S	S	.	.	H	α-helix	trans	-75.1	-47.8	174	-55.3	0	0	0	0	110.4	E69 E70 I71 I75 K76 T77	E69-T73 WeakPolarHBondContact O-CB 3.42Å; E69-T73 PolarHBondContact O-N 2.83Å; E69-T73 PolarHBondContact O-OG1 3.34Å; E70-T73 PolarHBondContact O-N 2.7Å; E70-T73 VanDerWaalsContact O-N 3.17Å; I71-T73 VanDerWaalsContact C-N 3.25Å; I71-T73 PolarHBondContact O-N 2.92Å; T73-I75 VanDerWaalsContact C-N 3.35Å; T73-I75 PolarHBondContact O-N 3.41Å; T73-K76 WeakPolarHBondContact O-CB 3.42Å; T73-K76 PolarHBondContact O-N 3.09Å; T73-K76 VanDerWaalsContact O-N 3.11Å; T73-T77 PolarHBondContact O-N 3.01Å; T73-T77 PolarHBondContact O-OG1 3.04Å
74	Y	93.8	Very high	94.9	Very high	52 Å²	52	92.4 Å²	92.4	20%	0.204	45%	0.452	C	S	.	.	H	α-helix	trans	-58.9	-41.4	177.7	-178.5	-98.8	0	0	0	112.9	E70 I71 K76 T77 Q78 L231 P232	E70-Y74 WeakPolarHBondContact O-CB 3.43Å; E70-Y74 PolarHBondContact O-N 3.33Å; I71-Y74 PolarHBondContact O-N 2.96Å; Y74-K76 PolarHBondContact O-N 2.88Å; Y74-T77 PolarHBondContact O-N 3.43Å; Y74-Q78 HydrophobicContact CE1-CB 4.29Å; Y74-Q78 VanDerWaalsContact O-CB 3.28Å; Y74-Q78 WeakPolarHBondContact O-CB 3.38Å; Y74-Q78 PolarHBondContact O-N 3.21Å; Y74-L231 HydrophobicContact CE2-CD2 4Å; Y74-P232 HydrophobicContact CD1-CG 3.43Å; Y74-P232 VanDerWaalsContact CD1-CG 3.43Å; Y74-P232 HydrophobicContact CD2-CG 4.34Å; Y74-P232 HydrophobicContact CE1-CG 3.95Å; Y74-P232 VanDerWaalsContact CG-CD 3.48Å; Y74-P232 HydrophobicContact CG-CG 3.65Å
75	I	95.3	Very high	94.9	Very high	98 Å²	98	94.6 Å²	94.6	50%	0.503	47%	0.465	S	S	.	.	H	α-helix	trans	-56.7	-37.8	176.1	-74.2	165.7	0	0	0	111.7	I71 T73 S79	I71-I75 HydrophobicContact CG2-CD1 3.66Å; I71-I75 HydrophobicContact CG2-CG1 4.32Å; I71-I75 VanDerWaalsContact O-CG1 3.27Å; I71-I75 WeakPolarHBondContact O-CG1 3.27Å; I71-I75 PolarHBondContact O-N 3.09Å; T73-I75 VanDerWaalsContact C-N 3.35Å; T73-I75 PolarHBondContact O-N 3.41Å; I75-S79 VanDerWaalsContact O-CB 3.31Å; I75-S79 WeakPolarHBondContact O-CB 3.36Å; I75-S79 PolarHBondContact O-N 3.5Å
76	K	96.8	Very high	94.9	Very high	140 Å²	140	92.3 Å²	92.3	61%	0.609	46%	0.459	S	S	*	.	H	α-helix	trans	-67.7	-55.3	175.8	-69.3	-173.8	171.3	-163.4	0	111.1	T73 Y74 Q78 S79 D80	T73-K76 WeakPolarHBondContact O-CB 3.42Å; T73-K76 PolarHBondContact O-N 3.09Å; T73-K76 VanDerWaalsContact O-N 3.11Å; Y74-K76 PolarHBondContact O-N 2.88Å; K76-Q78 VanDerWaalsContact C-N 3.29Å; K76-Q78 PolarHBondContact O-N 3.29Å; K76-S79 WeakPolarHBondContact O-CA 3.24Å; K76-S79 WeakPolarHBondContact O-CB 3.5Å; K76-S79 PolarHBondContact O-N 3.49Å; K76-D80 VanDerWaalsContact O-CG 3.22Å; K76-D80 PolarHBondContact O-N 2.94Å
77	T	94.8	Very high	95.1	Very high	66 Å²	66	92.5 Å²	92.5	41%	0.405	46%	0.458	S	S	.	.	H	α-helix	trans	-55.4	-44.4	179.8	-54	0	0	0	0	111.9	T73 Y74 S79 D80 E81	T73-T77 PolarHBondContact O-N 3.01Å; T73-T77 PolarHBondContact O-OG1 3.04Å; Y74-T77 PolarHBondContact O-N 3.43Å; T77-S79 VanDerWaalsContact C-N 3.35Å; T77-S79 PolarHBondContact O-N 2.91Å; T77-D80 PolarHBondContact O-N 3.27Å; T77-E81 WeakPolarHBondContact O-CB 3.33Å; T77-E81 VanDerWaalsContact O-CG 3.29Å; T77-E81 WeakPolarHBondContact O-CG 3.44Å; T77-E81 PolarHBondContact O-N 3.42Å
78	Q	93.8	Very high	95.3	Very high	38 Å²	38	89.7 Å²	89.7	18%	0.178	45%	0.453	C	S	.	.	H	α-helix	trans	-63.6	-37.9	175.7	-174	-176.4	1.6	0	0	112.2	Y74 K76 I82	Y74-Q78 HydrophobicContact CE1-CB 4.29Å; Y74-Q78 VanDerWaalsContact O-CB 3.28Å; Y74-Q78 WeakPolarHBondContact O-CB 3.38Å; Y74-Q78 PolarHBondContact O-N 3.21Å; K76-Q78 VanDerWaalsContact C-N 3.29Å; K76-Q78 PolarHBondContact O-N 3.29Å; Q78-I82 HydrophobicContact CG-CD1 3.82Å; Q78-I82 WeakPolarHBondContact O-CB 3.49Å; Q78-I82 WeakPolarHBondContact O-CG1 3.31Å; Q78-I82 PolarHBondContact O-N 3.47Å
79	S	96.9	Very high	95.2	Very high	65 Å²	65	85.3 Å²	85.3	46%	0.455	44%	0.44	S	S	.	.	H	α-helix	trans	-65.2	-45.8	174.7	-169.2	0	0	0	0	111.5	I75 K76 T77 I82 E83	I75-S79 VanDerWaalsContact O-CB 3.31Å; I75-S79 WeakPolarHBondContact O-CB 3.36Å; I75-S79 PolarHBondContact O-N 3.5Å; K76-S79 WeakPolarHBondContact O-CA 3.24Å; K76-S79 WeakPolarHBondContact O-CB 3.5Å; K76-S79 PolarHBondContact O-N 3.49Å; T77-S79 VanDerWaalsContact C-N 3.35Å; T77-S79 PolarHBondContact O-N 2.91Å; S79-I82 PolarHBondContact O-N 3.43Å; S79-E83 VanDerWaalsContact O-CB 3.3Å; S79-E83 WeakPolarHBondContact O-CB 3.45Å; S79-E83 PolarHBondContact O-N 2.76Å
80	D	97.4	Very high	95.2	Very high	98 Å²	98	87.2 Å²	87.2	52%	0.524	45%	0.447	S	S	.	.	H	α-helix	trans	-64.6	-40.2	-179.8	-57.1	-33.3	0	0	0	111.2	K76 T77 T84	K76-D80 VanDerWaalsContact O-CG 3.22Å; K76-D80 PolarHBondContact O-N 2.94Å; T77-D80 PolarHBondContact O-N 3.27Å; D80-T84 WeakPolarHBondContact O-CB 3.28Å; D80-T84 PolarHBondContact O-N 3.39Å; D80-T84 PolarHBondContact O-OG1 3.09Å
81	E	93.8	Very high	95.5	Very high	116 Å²	116	87.9 Å²	87.9	54%	0.542	45%	0.453	S	S	.	.	H	α-helix	trans	-63	-49.1	173.2	-75.6	174.7	179.6	0	0	111.9	T77 T84 V85	T77-E81 WeakPolarHBondContact O-CB 3.33Å; T77-E81 VanDerWaalsContact O-CG 3.29Å; T77-E81 WeakPolarHBondContact O-CG 3.44Å; T77-E81 PolarHBondContact O-N 3.42Å; E81-T84 WeakPolarHBondContact O-CB 3.43Å; E81-T84 PolarHBondContact O-N 2.92Å; E81-V85 PolarHBondContact O-N 3.3Å
82	I	94.5	Very high	95.5	Very high	84 Å²	84	91 Å²	91	43%	0.431	47%	0.466	S	S	.	.	H	α-helix	trans	-65.3	-42.4	179.6	-72.4	171	0	0	0	111.1	Q78 S79 T84 V85 I86	Q78-I82 HydrophobicContact CG-CD1 3.82Å; Q78-I82 WeakPolarHBondContact O-CB 3.49Å; Q78-I82 WeakPolarHBondContact O-CG1 3.31Å; Q78-I82 PolarHBondContact O-N 3.47Å; S79-I82 PolarHBondContact O-N 3.43Å; I82-T84 VanDerWaalsContact C-N 3.28Å; I82-T84 PolarHBondContact O-N 2.74Å; I82-V85 PolarHBondContact O-N 2.72Å; I82-I86 HydrophobicContact CG2-CD1 3.67Å; I82-I86 HydrophobicContact CG2-CG1 4.31Å; I82-I86 VanDerWaalsContact O-CG1 3.32Å; I82-I86 WeakPolarHBondContact O-CG1 3.29Å; I82-I86 PolarHBondContact O-N 2.95Å
83	E	97.9	Very high	95.4	Very high	92 Å²	92	88.9 Å²	88.9	43%	0.43	46%	0.46	S	S	.	.	H	α-helix	trans	-61.4	-38.9	176.4	-170.1	-176.1	129.7	0	0	111.4	S79 I86 K87	S79-E83 VanDerWaalsContact O-CB 3.3Å; S79-E83 WeakPolarHBondContact O-CB 3.45Å; S79-E83 PolarHBondContact O-N 2.76Å; E83-I86 PolarHBondContact O-N 2.98Å; E83-K87 HydrophobicContact CG-CD 4.2Å; E83-K87 WeakPolarHBondContact O-CB 3.4Å; E83-K87 VanDerWaalsContact O-CG 3.31Å; E83-K87 WeakPolarHBondContact O-CG 3.47Å; E83-K87 PolarHBondContact O-N 3.39Å; E83-K87 VanDerWaalsContact OE1-CE 3.3Å; E83-K87 WeakPolarHBondContact OE1-CE 3.46Å; E83-K87 IonicContact OE1-NZ 2.67Å; E83-K87 PolarHBondContact OE1-NZ 2.94Å
84	T	97.1	Very high	95.5	Very high	97 Å²	97	90.3 Å²	90.3	60%	0.595	46%	0.461	S	S	*	.	H	α-helix	trans	-63.4	-43.9	175.6	-59.5	0	0	0	0	111.8	D80 E81 I82 K87 G88	D80-T84 WeakPolarHBondContact O-CB 3.28Å; D80-T84 PolarHBondContact O-N 3.39Å; D80-T84 PolarHBondContact O-OG1 3.09Å; E81-T84 WeakPolarHBondContact O-CB 3.43Å; E81-T84 PolarHBondContact O-N 2.92Å; I82-T84 VanDerWaalsContact C-N 3.28Å; I82-T84 PolarHBondContact O-N 2.74Å; T84-K87 PolarHBondContact O-N 3.06Å; T84-G88 PolarHBondContact O-N 2.79Å
85	V	94.3	Very high	95.7	Very high	91 Å²	91	92.1 Å²	92.1	55%	0.552	47%	0.471	S	S	*	.	H	α-helix	trans	-64.8	-46.9	175.7	173.8	0	0	0	0	111.3	E81 I82 K87 G88 E89	E81-V85 PolarHBondContact O-N 3.3Å; I82-V85 PolarHBondContact O-N 2.72Å; V85-K87 VanDerWaalsContact C-N 3.31Å; V85-K87 PolarHBondContact O-N 3.27Å; V85-G88 WeakPolarHBondContact O-CA 3.22Å; V85-G88 PolarHBondContact O-N 3.36Å; V85-E89 PolarHBondContact O-N 2.93Å
86	I	95.7	Very high	95.7	Very high	91 Å²	91	89.6 Å²	89.6	47%	0.467	46%	0.456	S	S	.	.	H	α-helix	trans	-57.3	-45.3	177.8	-69.7	168.5	0	0	0	110.8	I82 E83 G88 E89 F90	I82-I86 HydrophobicContact CG2-CD1 3.67Å; I82-I86 HydrophobicContact CG2-CG1 4.31Å; I82-I86 VanDerWaalsContact O-CG1 3.32Å; I82-I86 WeakPolarHBondContact O-CG1 3.29Å; I82-I86 PolarHBondContact O-N 2.95Å; E83-I86 PolarHBondContact O-N 2.98Å; I86-G88 VanDerWaalsContact C-N 3.32Å; I86-G88 PolarHBondContact O-N 3.27Å; I86-E89 PolarHBondContact O-N 3.25Å; I86-F90 HydrophobicContact CG2-CD2 4.03Å; I86-F90 HydrophobicContact CG2-CE2 4.23Å; I86-F90 WeakPolarHBondContact O-CD2 3.4Å; I86-F90 PolarHBondContact O-N 3Å
87	K	97.8	Very high	95.7	Very high	126 Å²	126	86.6 Å²	86.6	55%	0.548	45%	0.446	S	S	.	.	H	α-helix	trans	-61.2	-38.6	175.6	-77.2	169.8	169.7	173	0	112.5	E83 T84 V85 L91	E83-K87 HydrophobicContact CG-CD 4.2Å; E83-K87 WeakPolarHBondContact O-CB 3.4Å; E83-K87 VanDerWaalsContact O-CG 3.31Å; E83-K87 WeakPolarHBondContact O-CG 3.47Å; E83-K87 PolarHBondContact O-N 3.39Å; E83-K87 VanDerWaalsContact OE1-CE 3.3Å; E83-K87 WeakPolarHBondContact OE1-CE 3.46Å; E83-K87 IonicContact OE1-NZ 2.67Å; E83-K87 PolarHBondContact OE1-NZ 2.94Å; T84-K87 PolarHBondContact O-N 3.06Å; V85-K87 VanDerWaalsContact C-N 3.31Å; V85-K87 PolarHBondContact O-N 3.27Å; K87-L91 VanDerWaalsContact O-CB 3.28Å; K87-L91 WeakPolarHBondContact O-CB 3.19Å; K87-L91 PolarHBondContact O-N 3.41Å
88	G	95.9	Very high	95.8	Very high	29 Å²	29	88.7 Å²	88.7	30%	0.299	45%	0.45	S	S	.	.	H	α-helix	trans	-63	-45.9	175.8	0	0	0	0	0	113.4	T84 V85 I86 L91 Q92	T84-G88 PolarHBondContact O-N 2.79Å; V85-G88 WeakPolarHBondContact O-CA 3.22Å; V85-G88 PolarHBondContact O-N 3.36Å; I86-G88 VanDerWaalsContact C-N 3.32Å; I86-G88 PolarHBondContact O-N 3.27Å; G88-L91 PolarHBondContact O-N 3.21Å; G88-Q92 WeakPolarHBondContact O-CG 3.46Å; G88-Q92 PolarHBondContact O-N 3.45Å; G88-Q92 VanDerWaalsContact O-N 3.11Å; G88-Q92 PolarHBondContact O-NE2 3.37Å
89	E	92.3	Very high	95.9	Very high	82 Å²	82	90.7 Å²	90.7	38%	0.383	46%	0.462	S	S	.	.	H	α-helix	trans	-67.5	-43	178.5	-64.3	-48	126.5	0	0	112.4	V85 I86 L91 Q92 L93	V85-E89 PolarHBondContact O-N 2.93Å; I86-E89 PolarHBondContact O-N 3.25Å; E89-L91 VanDerWaalsContact C-N 3.32Å; E89-L91 PolarHBondContact O-N 3Å; E89-Q92 PolarHBondContact O-N 3.31Å; E89-Q92 PolarHBondContact OE1-NE2 3.21Å; E89-Q92 PolarHBondContact OE2-NE2 3.33Å; E89-Q92 VanDerWaalsContact OE2-NE2 3.11Å; E89-L93 WeakPolarHBondContact O-CG 3.44Å; E89-L93 PolarHBondContact O-N 2.77Å; E89-L93 VanDerWaalsContact O-N 3.09Å
90	F	95.9	Very high	95.9	Very high	119 Å²	119	88.2 Å²	88.2	52%	0.522	44%	0.443	S	S	.	.	H	α-helix	trans	-64	-36.4	174.6	-88.1	-99.8	0	0	0	112.4	I86 L93 H94	I86-F90 HydrophobicContact CG2-CD2 4.03Å; I86-F90 HydrophobicContact CG2-CE2 4.23Å; I86-F90 WeakPolarHBondContact O-CD2 3.4Å; I86-F90 PolarHBondContact O-N 3Å; F90-L93 PolarHBondContact O-N 2.81Å; F90-H94 WeakPolarHBondContact O-CB 3.42Å; F90-H94 PolarHBondContact O-CD2 3.15Å; F90-H94 VanDerWaalsContact O-CG 3.26Å; F90-H94 PolarHBondContact O-N 2.94Å
91	L	97.1	Very high	95.9	Very high	118 Å²	118	89.4 Å²	89.4	62%	0.618	45%	0.445	S	S	*	.	H	α-helix	trans	-63.4	-40.9	175	-177.7	61.3	0	0	0	112.1	K87 G88 E89 H94 Q95	K87-L91 VanDerWaalsContact O-CB 3.28Å; K87-L91 WeakPolarHBondContact O-CB 3.19Å; K87-L91 PolarHBondContact O-N 3.41Å; G88-L91 PolarHBondContact O-N 3.21Å; E89-L91 VanDerWaalsContact C-N 3.32Å; E89-L91 PolarHBondContact O-N 3Å; L91-H94 PolarHBondContact O-N 3.02Å; L91-Q95 WeakPolarHBondContact O-CB 3.47Å; L91-Q95 PolarHBondContact O-N 3.43Å
92	Q	93.8	Very high	96.1	Very high	115 Å²	115	87 Å²	87	54%	0.537	44%	0.436	S	S	.	.	H	α-helix	trans	-61.7	-43.9	174.2	-72.3	174.7	85.8	0	0	111.9	G88 E89 Q95 F96	G88-Q92 WeakPolarHBondContact O-CG 3.46Å; G88-Q92 PolarHBondContact O-N 3.45Å; G88-Q92 VanDerWaalsContact O-N 3.11Å; G88-Q92 PolarHBondContact O-NE2 3.37Å; E89-Q92 PolarHBondContact O-N 3.31Å; E89-Q92 PolarHBondContact OE1-NE2 3.21Å; E89-Q92 PolarHBondContact OE2-NE2 3.33Å; E89-Q92 VanDerWaalsContact OE2-NE2 3.11Å; Q92-Q95 PolarHBondContact O-N 2.58Å; Q92-F96 WeakPolarHBondContact O-CB 3.36Å; Q92-F96 PolarHBondContact O-N 3.47Å
93	L	94.6	Very high	96.1	Very high	64 Å²	64	87.2 Å²	87.2	34%	0.335	44%	0.437	S	S	.	.	H	α-helix	trans	-64.6	-41.2	176.7	-67.4	173.5	0	0	0	112.3	E89 F90 F96 L97 M194	E89-L93 WeakPolarHBondContact O-CG 3.44Å; E89-L93 PolarHBondContact O-N 2.77Å; E89-L93 VanDerWaalsContact O-N 3.09Å; F90-L93 PolarHBondContact O-N 2.81Å; L93-F96 PolarHBondContact O-N 2.87Å; L93-L97 WeakPolarHBondContact O-CG 3.19Å; L93-L97 PolarHBondContact O-N 3.24Å; L93-L97 VanDerWaalsContact O-N 3.09Å; L93-M194 HydrophobicContact CD2-CG 4.31Å; L93-M194 HydrophobicContact CD2-SD 4.11Å
94	H	96.5	Very high	96	Very high	116 Å²	116	85.4 Å²	85.4	54%	0.537	43%	0.426	S	S	.	.	H	α-helix	trans	-64.8	-41.3	175.4	-69.2	-42.5	0	0	0	112.4	F90 L91 L97 K98	F90-H94 WeakPolarHBondContact O-CB 3.42Å; F90-H94 PolarHBondContact O-CD2 3.15Å; F90-H94 VanDerWaalsContact O-CG 3.26Å; F90-H94 PolarHBondContact O-N 2.94Å; L91-H94 PolarHBondContact O-N 3.02Å; H94-L97 PolarHBondContact O-N 2.69Å; H94-K98 PolarHBondContact O-N 2.89Å; H94-K98 VanDerWaalsContact O-N 3.08Å
95	Q	97	Very high	96	Very high	90 Å²	90	85 Å²	85	42%	0.421	42%	0.419	S	S	.	.	H	α-helix	trans	-64.2	-45.4	176.2	-173.9	58.4	47.6	0	0	111.4	L91 Q92 L97 K98 D99	L91-Q95 WeakPolarHBondContact O-CB 3.47Å; L91-Q95 PolarHBondContact O-N 3.43Å; Q92-Q95 PolarHBondContact O-N 2.58Å; Q95-L97 VanDerWaalsContact C-N 3.33Å; Q95-L97 PolarHBondContact O-N 3.18Å; Q95-K98 PolarHBondContact O-N 3.23Å; Q95-D99 VanDerWaalsContact NE2-CG 3.35Å; Q95-D99 PolarHBondContact NE2-OD1 2.88Å; Q95-D99 PolarHBondContact NE2-OD2 3.49Å; Q95-D99 VanDerWaalsContact O-CG 3.29Å; Q95-D99 PolarHBondContact O-N 3.05Å
96	F	96.1	Very high	96.2	Very high	44 Å²	44	88.4 Å²	88.4	19%	0.193	42%	0.422	C	S	.	.	H	α-helix	trans	-56.9	-43.8	175.6	169.5	-90.9	0	0	0	112.8	Q92 L93 K98 D99 E100 V190 K193 M194	Q92-F96 WeakPolarHBondContact O-CB 3.36Å; Q92-F96 PolarHBondContact O-N 3.47Å; L93-F96 PolarHBondContact O-N 2.87Å; F96-K98 VanDerWaalsContact C-N 3.35Å; F96-D99 PolarHBondContact O-N 3.19Å; F96-E100 PolarHBondContact O-N 2.92Å; F96-E100 VanDerWaalsContact O-N 3.13Å; F96-V190 HydrophobicContact CE1-CG1 4.19Å; F96-K193 HydrophobicContact CE2-CB 4.5Å; F96-K193 HydrophobicContact CZ-CB 3.83Å; F96-M194 HydrophobicContact CD1-CB 4.23Å; F96-M194 HydrophobicContact CD1-CG 3.98Å; F96-M194 HydrophobicContact CD1-SD 4.41Å; F96-M194 HydrophobicContact CE1-CB 3.56Å; F96-M194 HydrophobicContact CE1-CG 3.84Å; F96-M194 HydrophobicContact CE1-SD 4.46Å; F96-M194 HydrophobicContact CZ-CB 3.99Å
97	L	96.2	Very high	96.2	Very high	77 Å²	77	88.7 Å²	88.7	40%	0.403	42%	0.423	S	S	.	.	H	α-helix	trans	-64.5	-40.5	178.5	-71.8	171.8	0	0	0	111.7	L93 H94 Q95 E101 V190	L93-L97 WeakPolarHBondContact O-CG 3.19Å; L93-L97 PolarHBondContact O-N 3.24Å; L93-L97 VanDerWaalsContact O-N 3.09Å; H94-L97 PolarHBondContact O-N 2.69Å; Q95-L97 VanDerWaalsContact C-N 3.33Å; Q95-L97 PolarHBondContact O-N 3.18Å; L97-E101 PolarHBondContact O-N 2.94Å; L97-V190 HydrophobicContact CD2-CG1 3.72Å
98	K	97.7	Very high	96.2	Very high	111 Å²	111	85.3 Å²	85.3	48%	0.483	41%	0.411	S	S	.	.	H	α-helix	trans	-65.8	-43.8	175.7	-174.9	179.4	176.8	-176.6	0	112.3	H94 Q95 F96 E100 E101 D102	H94-K98 PolarHBondContact O-N 2.89Å; H94-K98 VanDerWaalsContact O-N 3.08Å; Q95-K98 PolarHBondContact O-N 3.23Å; F96-K98 VanDerWaalsContact C-N 3.35Å; K98-E100 VanDerWaalsContact C-N 3.3Å; K98-E100 PolarHBondContact O-N 3.26Å; K98-E101 PolarHBondContact O-N 2.83Å; K98-E101 VanDerWaalsContact O-N 3.16Å; K98-D102 WeakPolarHBondContact O-CB 3.18Å; K98-D102 PolarHBondContact O-N 3.16Å
99	D	96.6	Very high	96.3	Very high	80 Å²	80	89.9 Å²	89.9	43%	0.428	42%	0.422	S	S	.	.	H	α-helix	trans	-62.2	-38	179.3	-69.7	-30.7	0	0	0	112	Q95 F96 M103	Q95-D99 VanDerWaalsContact NE2-CG 3.35Å; Q95-D99 PolarHBondContact NE2-OD1 2.88Å; Q95-D99 PolarHBondContact NE2-OD2 3.49Å; Q95-D99 VanDerWaalsContact O-CG 3.29Å; Q95-D99 PolarHBondContact O-N 3.05Å; F96-D99 PolarHBondContact O-N 3.19Å; D99-M103 VanDerWaalsContact O-CB 3.28Å; D99-M103 WeakPolarHBondContact O-CB 3.23Å; D99-M103 PolarHBondContact O-N 3.31Å
100	E	95.9	Very high	96.5	Very high	13 Å²	13	90.8 Å²	90.8	6%	0.061	43%	0.427	C	S	.	.	H	α-helix	trans	-70	-39.9	173.5	-179.4	69	-168.3	0	0	111.8	F96 K98 M103 R104 V190 K193	F96-E100 PolarHBondContact O-N 2.92Å; F96-E100 VanDerWaalsContact O-N 3.13Å; K98-E100 VanDerWaalsContact C-N 3.3Å; K98-E100 PolarHBondContact O-N 3.26Å; E100-M103 WeakPolarHBondContact O-CB 3.39Å; E100-M103 PolarHBondContact O-N 2.97Å; E100-R104 WeakPolarHBondContact O-CG 3.26Å; E100-R104 PolarHBondContact O-N 2.93Å; E100-R104 IonicContact OE1-CZ 3.19Å; E100-R104 VanDerWaalsContact OE1-CZ 3.27Å; E100-R104 IonicContact OE1-NE 2.7Å; E100-R104 PolarHBondContact OE1-NE 2.99Å; E100-R104 IonicContact OE1-NH2 2.73Å; E100-R104 PolarHBondContact OE1-NH2 2.83Å; E100-V190 HydrophobicContact CG-CB 4.37Å; E100-V190 HydrophobicContact CG-CG1 4.09Å; E100-V190 HydrophobicContact CG-CG2 3.64Å; E100-K193 IonicContact OE1-NZ 2.77Å; E100-K193 PolarHBondContact OE1-NZ 3.28Å; E100-K193 VanDerWaalsContact OE2-CD 3.31Å; E100-K193 WeakPolarHBondContact OE2-CD 3.17Å; E100-K193 IonicContact OE2-NZ 2.61Å; E100-K193 PolarHBondContact OE2-NZ 3.31Å
101	E	96.9	Very high	96.6	Very high	122 Å²	122	85.9 Å²	85.9	57%	0.57	41%	0.405	S	S	*	.	H	α-helix	trans	-60.3	-53.1	173.2	178.3	169	-141.1	0	0	111.4	L97 K98 M103 R104 L105	L97-E101 PolarHBondContact O-N 2.94Å; K98-E101 PolarHBondContact O-N 2.83Å; K98-E101 VanDerWaalsContact O-N 3.16Å; E101-M103 PolarHBondContact O-N 3.02Å; E101-R104 PolarHBondContact O-N 2.83Å; E101-L105 HydrophobicContact CG-CD1 3.93Å; E101-L105 HydrophobicContact CG-CG 4.39Å; E101-L105 WeakPolarHBondContact O-CG 3.41Å; E101-L105 PolarHBondContact O-N 2.95Å
102	D	97.9	Very high	96.7	Very high	66 Å²	66	83.5 Å²	83.5	35%	0.353	39%	0.391	S	S	.	.	H	α-helix	trans	-59.8	-32.8	176	-80.8	-32.8	0	0	0	111.5	K98 R106	K98-D102 WeakPolarHBondContact O-CB 3.18Å; K98-D102 PolarHBondContact O-N 3.16Å; D102-R106 WeakPolarHBondContact O-CB 3.33Å; D102-R106 VanDerWaalsContact O-CG 3.29Å; D102-R106 WeakPolarHBondContact O-CG 3.1Å; D102-R106 PolarHBondContact O-N 3.29Å; D102-R106 PolarHBondContact O-NE 3.04Å
103	M	95.7	Very high	96.9	Very high	89 Å²	89	84.3 Å²	84.3	44%	0.438	39%	0.393	S	S	.	.	H	α-helix	trans	-65.2	-47.1	171.1	-171.9	-170.9	-172.8	0	0	111.8	D99 E100 E101 R106 M107	D99-M103 VanDerWaalsContact O-CB 3.28Å; D99-M103 WeakPolarHBondContact O-CB 3.23Å; D99-M103 PolarHBondContact O-N 3.31Å; E100-M103 WeakPolarHBondContact O-CB 3.39Å; E100-M103 PolarHBondContact O-N 2.97Å; E101-M103 PolarHBondContact O-N 3.02Å; M103-R106 PolarHBondContact O-N 3.26Å; M103-M107 WeakPolarHBondContact O-CG 3.37Å; M103-M107 PolarHBondContact O-N 3.45Å
104	R	94.8	Very high	97	Very high	53 Å²	53	85.7 Å²	85.7	20%	0.2	40%	0.399	C	S	.	.	H	α-helix	trans	-65.1	-44.5	179.5	-65.3	-59.2	176.2	117.8	9.2	112	E100 E101 R106 M107 L108 L186	E100-R104 WeakPolarHBondContact O-CG 3.26Å; E100-R104 PolarHBondContact O-N 2.93Å; E100-R104 IonicContact OE1-CZ 3.19Å; E100-R104 VanDerWaalsContact OE1-CZ 3.27Å; E100-R104 IonicContact OE1-NE 2.7Å; E100-R104 PolarHBondContact OE1-NE 2.99Å; E100-R104 IonicContact OE1-NH2 2.73Å; E100-R104 PolarHBondContact OE1-NH2 2.83Å; E101-R104 PolarHBondContact O-N 2.83Å; R104-R106 VanDerWaalsContact C-N 3.33Å; R104-R106 PolarHBondContact O-N 3.31Å; R104-M107 PolarHBondContact O-N 2.95Å; R104-M107 VanDerWaalsContact O-N 3.15Å; R104-L108 PolarHBondContact O-N 3.16Å; R104-L186 HydrophobicContact CG-CD1 4.21Å
105	L	97.3	Very high	97.1	Very high	88 Å²	88	82 Å²	82	46%	0.461	38%	0.382	S	S	.	.	H	α-helix	trans	-61.9	-40.1	178.9	-67.6	175	0	0	0	111.6	E101 L108 K109	E101-L105 HydrophobicContact CG-CD1 3.93Å; E101-L105 HydrophobicContact CG-CG 4.39Å; E101-L105 WeakPolarHBondContact O-CG 3.41Å; E101-L105 PolarHBondContact O-N 2.95Å; L105-L108 PolarHBondContact O-N 3.1Å; L105-K109 WeakPolarHBondContact O-CB 3.4Å; L105-K109 WeakPolarHBondContact O-CG 3.44Å; L105-K109 PolarHBondContact O-N 3.27Å
106	R	97.8	Very high	97.1	Very high	163 Å²	163	83.1 Å²	83.1	62%	0.615	39%	0.389	S	S	*	.	H	α-helix	trans	-63.1	-42.9	171.8	-76.8	177.2	-71.8	178.6	-3.9	112.7	D102 M103 R104 L108 K109 Q110	D102-R106 WeakPolarHBondContact O-CB 3.33Å; D102-R106 VanDerWaalsContact O-CG 3.29Å; D102-R106 WeakPolarHBondContact O-CG 3.1Å; D102-R106 PolarHBondContact O-N 3.29Å; D102-R106 PolarHBondContact O-NE 3.04Å; M103-R106 PolarHBondContact O-N 3.26Å; R104-R106 VanDerWaalsContact C-N 3.33Å; R104-R106 PolarHBondContact O-N 3.31Å; R106-L108 VanDerWaalsContact C-N 3.34Å; R106-L108 PolarHBondContact O-N 3.01Å; R106-K109 PolarHBondContact O-N 3.37Å; R106-Q110 WeakPolarHBondContact O-CB 3.44Å; R106-Q110 PolarHBondContact O-N 2.94Å
107	M	95.9	Very high	97.1	Very high	97 Å²	97	86.1 Å²	86.1	48%	0.478	40%	0.403	S	S	.	.	H	α-helix	trans	-65	-35.6	177.4	-71.2	-63	-66.8	0	0	112.9	M103 R104 E111	M103-M107 WeakPolarHBondContact O-CG 3.37Å; M103-M107 PolarHBondContact O-N 3.45Å; R104-M107 PolarHBondContact O-N 2.95Å; R104-M107 VanDerWaalsContact O-N 3.15Å; M107-E111 PolarHBondContact O-N 2.97Å
108	L	97.4	Very high	97.1	Very high	56 Å²	56	85.5 Å²	85.5	29%	0.293	40%	0.402	S	S	.	.	H	α-helix	trans	-67.4	-50.8	172.7	175.8	59.9	0	0	0	111.3	R104 L105 R106 Q110 E111 E112 I177	R104-L108 PolarHBondContact O-N 3.16Å; L105-L108 PolarHBondContact O-N 3.1Å; R106-L108 VanDerWaalsContact C-N 3.34Å; R106-L108 PolarHBondContact O-N 3.01Å; L108-Q110 VanDerWaalsContact C-N 3.27Å; L108-Q110 PolarHBondContact O-N 3.22Å; L108-E111 PolarHBondContact O-N 3.48Å; L108-E111 VanDerWaalsContact O-N 3.09Å; L108-E112 WeakPolarHBondContact O-CB 3.35Å; L108-E112 PolarHBondContact O-N 2.99Å; L108-I177 HydrophobicContact CD1-CG2 3.7Å
109	K	98.3	Very high	97	Very high	124 Å²	124	83.4 Å²	83.4	54%	0.539	40%	0.395	S	S	.	.	H	α-helix	trans	-61.5	-32.4	179.7	-79.5	-76.3	161.4	-158.9	0	113.3	L105 R106 E112 K113	L105-K109 WeakPolarHBondContact O-CB 3.4Å; L105-K109 WeakPolarHBondContact O-CG 3.44Å; L105-K109 PolarHBondContact O-N 3.27Å; R106-K109 PolarHBondContact O-N 3.37Å; K109-E112 VanDerWaalsContact CD-OE2 3.31Å; K109-E112 WeakPolarHBondContact CD-OE2 3.44Å; K109-E112 WeakPolarHBondContact CE-OE2 3.33Å; K109-E112 IonicContact NZ-OE1 2.58Å; K109-E112 PolarHBondContact NZ-OE1 2.89Å; K109-E112 IonicContact NZ-OE2 2.73Å; K109-E112 PolarHBondContact NZ-OE2 3.09Å; K109-K113 WeakPolarHBondContact O-CB 3.27Å; K109-K113 PolarHBondContact O-N 2.79Å
110	Q	97.9	Very high	97	Very high	102 Å²	102	82.3 Å²	82.3	48%	0.477	39%	0.393	S	S	.	.	H	α-helix	trans	-72	-37.6	174	-176.3	59.5	20.4	0	0	112.4	R106 L108 K113 I114	R106-Q110 WeakPolarHBondContact O-CB 3.44Å; R106-Q110 PolarHBondContact O-N 2.94Å; L108-Q110 VanDerWaalsContact C-N 3.27Å; L108-Q110 PolarHBondContact O-N 3.22Å; Q110-K113 PolarHBondContact O-N 2.81Å; Q110-I114 HydrophobicContact CG-CD1 4.14Å; Q110-I114 WeakPolarHBondContact O-CD1 3.46Å; Q110-I114 VanDerWaalsContact O-CG1 3.27Å; Q110-I114 WeakPolarHBondContact O-CG1 3.45Å; Q110-I114 PolarHBondContact O-N 2.87Å; Q110-I114 VanDerWaalsContact O-N 3.09Å
111	E	98.1	Very high	96.9	Very high	16 Å²	16	85.2 Å²	85.2	8%	0.075	41%	0.409	C	S	.	.	H	α-helix	trans	-66.8	-42.3	174.4	179.2	170	160.7	0	0	111.9	M107 L108 I114 K115 I177 N178 K181 H182	M107-E111 PolarHBondContact O-N 2.97Å; L108-E111 PolarHBondContact O-N 3.48Å; L108-E111 VanDerWaalsContact O-N 3.09Å; E111-I114 PolarHBondContact O-N 2.87Å; E111-K115 HydrophobicContact CG-CD 3.82Å; E111-K115 WeakPolarHBondContact O-CB 3.24Å; E111-K115 WeakPolarHBondContact O-CG 3.44Å; E111-K115 PolarHBondContact O-N 3.09Å; E111-K115 IonicContact OE1-NZ 3.51Å; E111-K115 PolarHBondContact OE1-NZ 3.09Å; E111-I177 HydrophobicContact CG-CD1 4.27Å; E111-N178 PolarHBondContact OE1-N 2.91Å; E111-K181 IonicContact OE2-NZ 2.66Å; E111-K181 PolarHBondContact OE2-NZ 2.88Å; E111-H182 IonicContact OE2-CD2 2.65Å; E111-H182 IonicContact OE2-CE1 2.68Å; E111-H182 IonicContact OE2-NE2 3.51Å; E111-H182 PolarHBondContact OE2-NE2 2.9Å
112	E	98.1	Very high	96.7	Very high	68 Å²	68	82.4 Å²	82.4	32%	0.318	40%	0.395	S	S	.	.	H	α-helix	trans	-55.8	-51.5	171.5	-179.8	-172.5	150.8	0	0	111.5	L108 K109 I114 K115 M116 I177	L108-E112 WeakPolarHBondContact O-CB 3.35Å; L108-E112 PolarHBondContact O-N 2.99Å; K109-E112 VanDerWaalsContact CD-OE2 3.31Å; K109-E112 WeakPolarHBondContact CD-OE2 3.44Å; K109-E112 WeakPolarHBondContact CE-OE2 3.33Å; K109-E112 IonicContact NZ-OE1 2.58Å; K109-E112 PolarHBondContact NZ-OE1 2.89Å; K109-E112 IonicContact NZ-OE2 2.73Å; K109-E112 PolarHBondContact NZ-OE2 3.09Å; E112-I114 PolarHBondContact O-N 2.84Å; E112-K115 PolarHBondContact O-N 3.41Å; E112-M116 VanDerWaalsContact O-CB 3.25Å; E112-M116 WeakPolarHBondContact O-CB 3.3Å; E112-M116 PolarHBondContact O-N 3.13Å; E112-I177 HydrophobicContact CB-CD1 4.12Å
113	K	98.3	Very high	96.6	Very high	131 Å²	131	83.3 Å²	83.3	57%	0.57	40%	0.399	S	S	*	.	H	α-helix	trans	-58.6	-44.8	178.7	-176.9	177.1	179.5	178.6	0	112.7	K109 Q110 Q117	K109-K113 WeakPolarHBondContact O-CB 3.27Å; K109-K113 PolarHBondContact O-N 2.79Å; Q110-K113 PolarHBondContact O-N 2.81Å; K113-Q117 PolarHBondContact O-N 3.08Å; K113-Q117 VanDerWaalsContact O-N 3.09Å
114	I	97.3	Very high	96.6	Very high	93 Å²	93	83.5 Å²	83.5	48%	0.477	40%	0.399	S	S	.	.	H	α-helix	trans	-63.2	-48.7	179.2	-69.8	165.3	0	0	0	110.5	Q110 E111 E112 Q117 V118	Q110-I114 HydrophobicContact CG-CD1 4.14Å; Q110-I114 WeakPolarHBondContact O-CD1 3.46Å; Q110-I114 VanDerWaalsContact O-CG1 3.27Å; Q110-I114 WeakPolarHBondContact O-CG1 3.45Å; Q110-I114 PolarHBondContact O-N 2.87Å; Q110-I114 VanDerWaalsContact O-N 3.09Å; E111-I114 PolarHBondContact O-N 2.87Å; E112-I114 PolarHBondContact O-N 2.84Å; I114-Q117 PolarHBondContact O-N 2.84Å; I114-V118 WeakPolarHBondContact O-CG2 3.34Å; I114-V118 PolarHBondContact O-N 3.38Å; I114-V118 VanDerWaalsContact O-N 3.15Å
115	K	97.3	Very high	96.4	Very high	38 Å²	38	84.6 Å²	84.6	17%	0.165	41%	0.409	C	S	.	.	H	α-helix	trans	-69.9	-37.2	-176.1	-72.9	171.7	172.5	-172.2	0	112.4	E111 E112 V118 M119 D174 I175 L176 I177	E111-K115 HydrophobicContact CG-CD 3.82Å; E111-K115 WeakPolarHBondContact O-CB 3.24Å; E111-K115 WeakPolarHBondContact O-CG 3.44Å; E111-K115 PolarHBondContact O-N 3.09Å; E111-K115 IonicContact OE1-NZ 3.51Å; E111-K115 PolarHBondContact OE1-NZ 3.09Å; E112-K115 PolarHBondContact O-N 3.41Å; K115-V118 PolarHBondContact O-N 3.17Å; K115-M119 PolarHBondContact O-N 2.84Å; K115-D174 WeakPolarHBondContact CE-O 3.34Å; K115-D174 PolarHBondContact NZ-O 3.36Å; K115-I175 HydrophobicContact CB-CD1 4.47Å; K115-I175 WeakPolarHBondContact CD-O 3.34Å; K115-L176 PolarHBondContact NZ-O 3.43Å; K115-I177 HydrophobicContact CD-CD1 4.4Å
116	M	97.6	Very high	96.2	Very high	115 Å²	115	83.9 Å²	83.9	57%	0.567	41%	0.405	S	S	*	.	H	α-helix	trans	-61.8	-44.5	172.3	-174.5	171.5	65.3	0	0	111.8	E112 V118 M119 C120	E112-M116 VanDerWaalsContact O-CB 3.25Å; E112-M116 WeakPolarHBondContact O-CB 3.3Å; E112-M116 PolarHBondContact O-N 3.13Å; M116-V118 PolarHBondContact O-N 2.93Å; M116-M119 PolarHBondContact O-N 3.3Å; M116-C120 PolarHBondContact O-N 2.84Å; M116-C120 PolarHBondContact O-SG 2.95Å
117	Q	97.3	Very high	96	Very high	107 Å²	107	81.4 Å²	81.4	50%	0.5	40%	0.4	S	S	.	.	H	α-helix	trans	-61.5	-42.2	177.3	-172.8	66.3	68.1	0	0	112.2	K113 I114 M119 C120 N121	K113-Q117 PolarHBondContact O-N 3.08Å; K113-Q117 VanDerWaalsContact O-N 3.09Å; I114-Q117 PolarHBondContact O-N 2.84Å; Q117-M119 VanDerWaalsContact C-N 3.32Å; Q117-M119 PolarHBondContact O-N 2.95Å; Q117-C120 PolarHBondContact O-N 2.84Å; Q117-N121 PolarHBondContact NE2-OD1 3.38Å; Q117-N121 PolarHBondContact O-N 2.79Å; Q117-N121 VanDerWaalsContact O-N 3.15Å; Q117-N121 PolarHBondContact O-OD1 3.48Å
118	V	95.8	Very high	95.9	Very high	63 Å²	63	81.9 Å²	81.9	38%	0.382	40%	0.399	S	S	.	.	H	α-helix	trans	-61	-42.3	175.5	173.2	0	0	0	0	111	I114 K115 M116 K122 M172 I175	I114-V118 WeakPolarHBondContact O-CG2 3.34Å; I114-V118 PolarHBondContact O-N 3.38Å; I114-V118 VanDerWaalsContact O-N 3.15Å; K115-V118 PolarHBondContact O-N 3.17Å; M116-V118 PolarHBondContact O-N 2.93Å; V118-K122 WeakPolarHBondContact O-CB 3.47Å; V118-K122 VanDerWaalsContact O-CG 3.28Å; V118-K122 WeakPolarHBondContact O-CG 3.39Å; V118-K122 PolarHBondContact O-N 2.97Å; V118-K122 VanDerWaalsContact O-N 3.1Å; V118-M172 HydrophobicContact CG1-SD 4.31Å; V118-I175 HydrophobicContact CB-CD1 4.13Å; V118-I175 HydrophobicContact CG1-CD1 3.84Å
119	M	95.3	Very high	95.5	Very high	67 Å²	67	83.2 Å²	83.2	33%	0.33	40%	0.404	S	S	.	.	H	α-helix	trans	-65.2	-42.6	176.5	-75.9	-55.3	-51.7	0	0	113.1	K115 M116 Q117 K122 I123 M172 I175	K115-M119 PolarHBondContact O-N 2.84Å; M116-M119 PolarHBondContact O-N 3.3Å; Q117-M119 VanDerWaalsContact C-N 3.32Å; Q117-M119 PolarHBondContact O-N 2.95Å; M119-K122 PolarHBondContact O-N 2.86Å; M119-I123 HydrophobicContact CE-CD1 4.38Å; M119-I123 HydrophobicContact CE-CG1 4.44Å; M119-I123 VanDerWaalsContact O-CG1 3.28Å; M119-I123 WeakPolarHBondContact O-CG1 3.4Å; M119-I123 PolarHBondContact O-N 2.88Å; M119-M172 HydrophobicContact CE-CE 4.23Å; M119-M172 HydrophobicContact SD-CE 3.75Å; M119-M172 HydrophobicContact SD-SD 4.17Å; M119-I175 HydrophobicContact CG-CD1 4.02Å; M119-I175 HydrophobicContact CG-CG1 3.94Å; M119-I175 HydrophobicContact SD-CD1 4.03Å; M119-I175 HydrophobicContact SD-CG1 3.56Å; M119-I175 VanDerWaalsContact SD-CG1 3.56Å
120	C	96.1	Very high	95.3	Very high	57 Å²	57	81.3 Å²	81.3	39%	0.385	40%	0.399	S	S	.	.	H	α-helix	trans	-57.3	-52	176.5	-66.4	0	0	0	0	111.1	M116 Q117 K122 I123 E124	M116-C120 PolarHBondContact O-N 2.84Å; M116-C120 PolarHBondContact O-SG 2.95Å; Q117-C120 PolarHBondContact O-N 2.84Å; C120-K122 VanDerWaalsContact C-N 3.29Å; C120-K122 PolarHBondContact O-N 2.8Å; C120-I123 PolarHBondContact O-N 2.83Å; C120-E124 WeakPolarHBondContact O-CG 3.4Å; C120-E124 PolarHBondContact O-N 2.86Å
121	N	94.4	Very high	95.1	Very high	74 Å²	74	83 Å²	83	40%	0.396	41%	0.406	S	S	.	.	H	α-helix	trans	-57.2	-42.9	178.7	-65.1	25.1	0	0	0	111.7	Q117 E124 D125	Q117-N121 PolarHBondContact NE2-OD1 3.38Å; Q117-N121 PolarHBondContact O-N 2.79Å; Q117-N121 VanDerWaalsContact O-N 3.15Å; Q117-N121 PolarHBondContact O-OD1 3.48Å; N121-E124 PolarHBondContact O-N 3.09Å; N121-D125 VanDerWaalsContact O-CG 3.26Å; N121-D125 PolarHBondContact O-N 3.38Å
122	K	93.2	Very high	94.6	Very high	64 Å²	64	84.9 Å²	84.9	28%	0.278	43%	0.425	S	S	.	.	H	α-helix	trans	-70.5	-31.4	-179.6	-72.8	-79.6	175.1	-175.8	0	113.4	V118 M119 C120 I126 E170 M172	V118-K122 WeakPolarHBondContact O-CB 3.47Å; V118-K122 VanDerWaalsContact O-CG 3.28Å; V118-K122 WeakPolarHBondContact O-CG 3.39Å; V118-K122 PolarHBondContact O-N 2.97Å; V118-K122 VanDerWaalsContact O-N 3.1Å; M119-K122 PolarHBondContact O-N 2.86Å; C120-K122 VanDerWaalsContact C-N 3.29Å; C120-K122 PolarHBondContact O-N 2.8Å; K122-I126 WeakPolarHBondContact O-CG1 3.5Å; K122-I126 PolarHBondContact O-N 2.87Å; K122-I126 VanDerWaalsContact O-N 3.16Å; K122-E170 IonicContact NZ-OE2 2.69Å; K122-E170 PolarHBondContact NZ-OE2 3.16Å; K122-M172 HydrophobicContact CB-CE 3.84Å; K122-M172 HydrophobicContact CB-SD 4.3Å; K122-M172 HydrophobicContact CD-CE 4.31Å; K122-M172 HydrophobicContact CD-SD 4.19Å; K122-M172 HydrophobicContact CG-CE 3.92Å; K122-M172 HydrophobicContact CG-SD 3.75Å
123	I	94.4	Very high	94.2	Very high	84 Å²	84	84.7 Å²	84.7	43%	0.431	43%	0.426	S	S	.	.	H	α-helix	trans	-67.3	-50.4	171.5	-71	164	0	0	0	109.6	M119 C120 D125 I126 E127	M119-I123 HydrophobicContact CE-CD1 4.38Å; M119-I123 HydrophobicContact CE-CG1 4.44Å; M119-I123 VanDerWaalsContact O-CG1 3.28Å; M119-I123 WeakPolarHBondContact O-CG1 3.4Å; M119-I123 PolarHBondContact O-N 2.88Å; C120-I123 PolarHBondContact O-N 2.83Å; I123-D125 VanDerWaalsContact C-N 3.27Å; I123-D125 PolarHBondContact O-N 3.33Å; I123-I126 PolarHBondContact O-N 3.06Å; I123-I126 VanDerWaalsContact O-N 3.17Å; I123-E127 HydrophobicContact CG2-CG 4.32Å; I123-E127 WeakPolarHBondContact O-CG 3.42Å; I123-E127 PolarHBondContact O-N 3.09Å
124	E	95.8	Very high	93.9	Very high	93 Å²	93	82.6 Å²	82.6	44%	0.435	42%	0.421	S	S	.	.	H	α-helix	trans	-56.7	-40.4	177.4	-67.7	177.4	-156.9	0	0	112.4	C120 N121 E127 K128	C120-E124 WeakPolarHBondContact O-CG 3.4Å; C120-E124 PolarHBondContact O-N 2.86Å; N121-E124 PolarHBondContact O-N 3.09Å; E124-E127 PolarHBondContact O-N 3.32Å; E124-K128 WeakPolarHBondContact O-CD 3.44Å; E124-K128 WeakPolarHBondContact O-CE 3.4Å; E124-K128 WeakPolarHBondContact O-CG 3.4Å; E124-K128 PolarHBondContact O-N 3.42Å; E124-K128 IonicContact OE2-NZ 3.66Å; E124-K128 PolarHBondContact OE2-NZ 2.93Å
125	D	92.2	Very high	93.6	Very high	77 Å²	77	81.2 Å²	81.2	41%	0.412	42%	0.419	S	S	.	.	H	α-helix	trans	-66.7	-41.6	179.2	-70.2	-17.7	0	0	0	112.1	N121 I123 K128 E129	N121-D125 VanDerWaalsContact O-CG 3.26Å; N121-D125 PolarHBondContact O-N 3.38Å; I123-D125 VanDerWaalsContact C-N 3.27Å; I123-D125 PolarHBondContact O-N 3.33Å; D125-K128 PolarHBondContact O-N 2.93Å; D125-K128 IonicContact OD1-NZ 2.8Å; D125-K128 PolarHBondContact OD1-NZ 3.39Å; D125-E129 PolarHBondContact O-N 2.89Å
126	I	91.8	Very high	93.1	Very high	73 Å²	73	81.4 Å²	81.4	37%	0.374	42%	0.424	S	S	.	.	H	α-helix	trans	-66.1	-37.4	173.1	-71.4	171.5	0	0	0	111.3	K122 I123 E129 I130	K122-I126 WeakPolarHBondContact O-CG1 3.5Å; K122-I126 PolarHBondContact O-N 2.87Å; K122-I126 VanDerWaalsContact O-N 3.16Å; I123-I126 PolarHBondContact O-N 3.06Å; I123-I126 VanDerWaalsContact O-N 3.17Å; I126-E129 PolarHBondContact O-N 3.39Å; I126-I130 HydrophobicContact CG2-CD1 3.72Å; I126-I130 HydrophobicContact CG2-CG1 4.29Å; I126-I130 WeakPolarHBondContact O-CB 3.27Å; I126-I130 VanDerWaalsContact O-CG1 3.28Å; I126-I130 WeakPolarHBondContact O-CG1 3.45Å; I126-I130 PolarHBondContact O-N 3.4Å
127	E	94.8	Very high	92.7	Very high	110 Å²	110	80.9 Å²	80.9	51%	0.514	42%	0.422	S	S	.	.	H	α-helix	trans	-62.8	-41	174.6	-73.8	176.1	167.8	0	0	112.1	I123 E124 I130 Q131	I123-E127 HydrophobicContact CG2-CG 4.32Å; I123-E127 WeakPolarHBondContact O-CG 3.42Å; I123-E127 PolarHBondContact O-N 3.09Å; E124-E127 PolarHBondContact O-N 3.32Å; E127-I130 PolarHBondContact O-N 2.64Å; E127-Q131 WeakPolarHBondContact O-CG 3.29Å; E127-Q131 PolarHBondContact O-N 2.94Å
128	K	92.6	Very high	92.4	Very high	108 Å²	108	79.1 Å²	79.1	47%	0.47	42%	0.422	S	S	.	.	H	α-helix	trans	-61.2	-43.6	173.5	-66.3	156.1	-148	158	0	111	E124 D125 Q131 A132	E124-K128 WeakPolarHBondContact O-CD 3.44Å; E124-K128 WeakPolarHBondContact O-CE 3.4Å; E124-K128 WeakPolarHBondContact O-CG 3.4Å; E124-K128 PolarHBondContact O-N 3.42Å; E124-K128 IonicContact OE2-NZ 3.66Å; E124-K128 PolarHBondContact OE2-NZ 2.93Å; D125-K128 PolarHBondContact O-N 2.93Å; D125-K128 IonicContact OD1-NZ 2.8Å; D125-K128 PolarHBondContact OD1-NZ 3.39Å; K128-Q131 PolarHBondContact O-N 3.49Å; K128-A132 WeakPolarHBondContact O-CB 3.18Å; K128-A132 PolarHBondContact O-N 3.27Å
129	E	90.3	Very high	91.9	Very high	84 Å²	84	82 Å²	82	39%	0.393	43%	0.429	S	S	.	.	H	α-helix	trans	-66.2	-43.2	176.2	-70.9	-167	167.7	0	0	112.5	D125 I126 Q131 A132 L133	D125-E129 PolarHBondContact O-N 2.89Å; I126-E129 PolarHBondContact O-N 3.39Å; E129-Q131 VanDerWaalsContact C-N 3.34Å; E129-Q131 PolarHBondContact O-N 2.91Å; E129-A132 PolarHBondContact O-N 3.11Å; E129-A132 VanDerWaalsContact O-N 3.16Å; E129-L133 WeakPolarHBondContact O-CB 3.44Å; E129-L133 WeakPolarHBondContact O-CG 3.49Å; E129-L133 PolarHBondContact O-N 2.81Å
130	I	92.3	Very high	91.5	Very high	83 Å²	83	80.9 Å²	80.9	43%	0.426	43%	0.426	S	S	.	.	H	α-helix	trans	-58.8	-44.1	175	-72.5	167.7	0	0	0	110.8	I126 E127 L133 N134	I126-I130 HydrophobicContact CG2-CD1 3.72Å; I126-I130 HydrophobicContact CG2-CG1 4.29Å; I126-I130 WeakPolarHBondContact O-CB 3.27Å; I126-I130 VanDerWaalsContact O-CG1 3.28Å; I126-I130 WeakPolarHBondContact O-CG1 3.45Å; I126-I130 PolarHBondContact O-N 3.4Å; E127-I130 PolarHBondContact O-N 2.64Å; I130-L133 PolarHBondContact O-N 3.11Å; I130-N134 WeakPolarHBondContact O-CB 3.45Å; I130-N134 VanDerWaalsContact O-CG 3.29Å; I130-N134 PolarHBondContact O-N 2.84Å; I130-N134 PolarHBondContact O-ND2 3.05Å
131	Q	93.7	Very high	91.1	Very high	137 Å²	137	81.4 Å²	81.4	64%	0.64	43%	0.425	S	S	*	.	H	α-helix	trans	-66	-37.2	176	-71.5	-164.8	21	0	0	112.7	E127 K128 E129 S135	E127-Q131 WeakPolarHBondContact O-CG 3.29Å; E127-Q131 PolarHBondContact O-N 2.94Å; K128-Q131 PolarHBondContact O-N 3.49Å; E129-Q131 VanDerWaalsContact C-N 3.34Å; E129-Q131 PolarHBondContact O-N 2.91Å; Q131-S135 VanDerWaalsContact O-CB 3.22Å; Q131-S135 WeakPolarHBondContact O-CB 3.36Å; Q131-S135 PolarHBondContact O-N 3.36Å; Q131-S135 PolarHBondContact O-OG 2.95Å
132	A	89.6	Confident	90.7	Very high	56 Å²	56	83.3 Å²	83.3	46%	0.463	43%	0.434	S	S	.	.	H	α-helix	trans	-67.1	-37.9	175.3	0	0	0	0	0	112.8	K128 E129 T136	K128-A132 WeakPolarHBondContact O-CB 3.18Å; K128-A132 PolarHBondContact O-N 3.27Å; E129-A132 PolarHBondContact O-N 3.11Å; E129-A132 VanDerWaalsContact O-N 3.16Å; A132-T136 PolarHBondContact O-N 2.79Å; A132-T136 VanDerWaalsContact O-N 3.15Å; A132-T136 PolarHBondContact O-OG1 2.76Å
133	L	89.3	Confident	90.4	Very high	64 Å²	64	81.3 Å²	81.3	34%	0.335	43%	0.427	S	S	.	.	H	α-helix	trans	-67.5	-50.1	174.1	-70.8	171.9	0	0	0	111.1	E129 I130 S135 T136 I137 I166	E129-L133 WeakPolarHBondContact O-CB 3.44Å; E129-L133 WeakPolarHBondContact O-CG 3.49Å; E129-L133 PolarHBondContact O-N 2.81Å; I130-L133 PolarHBondContact O-N 3.11Å; L133-S135 VanDerWaalsContact C-N 3.31Å; L133-S135 PolarHBondContact O-N 2.8Å; L133-T136 CarbonylContact O-C 3.56Å; L133-T136 WeakPolarHBondContact O-CA 3.42Å; L133-T136 WeakPolarHBondContact O-CB 3.46Å; L133-T136 PolarHBondContact O-N 2.86Å; L133-I137 WeakPolarHBondContact O-CG1 3.46Å; L133-I137 PolarHBondContact O-N 2.86Å; L133-I166 HydrophobicContact CD1-CG2 4.26Å; L133-I166 HydrophobicContact CD2-CD1 3.91Å; L133-I166 HydrophobicContact CD2-CG1 3.94Å; L133-I166 HydrophobicContact CD2-CG2 4.31Å
134	N	92	Very high	90	Very high	87 Å²	87	83.1 Å²	83.1	47%	0.465	44%	0.437	S	S	.	.	H	α-helix	trans	-56.9	-43.7	175.3	-74.1	-25.5	0	0	0	111.9	I130 T136 I137 S138	I130-N134 WeakPolarHBondContact O-CB 3.45Å; I130-N134 VanDerWaalsContact O-CG 3.29Å; I130-N134 PolarHBondContact O-N 2.84Å; I130-N134 PolarHBondContact O-ND2 3.05Å; N134-T136 PolarHBondContact O-N 2.92Å; N134-I137 PolarHBondContact O-N 2.8Å; N134-S138 PolarHBondContact O-N 2.91Å; N134-S138 PolarHBondContact O-OG 2.83Å
135	S	90.1	Very high	89.5	Confident	64 Å²	64	87.4 Å²	87.4	45%	0.448	45%	0.449	S	S	.	.	H	α-helix	trans	-62.9	-21.6	174.3	-62.1	0	0	0	0	113.8	Q131 L133 K139	Q131-S135 VanDerWaalsContact O-CB 3.22Å; Q131-S135 WeakPolarHBondContact O-CB 3.36Å; Q131-S135 PolarHBondContact O-N 3.36Å; Q131-S135 PolarHBondContact O-OG 2.95Å; L133-S135 VanDerWaalsContact C-N 3.31Å; L133-S135 PolarHBondContact O-N 2.8Å; S135-K139 VanDerWaalsContact O-CD 3.27Å; S135-K139 WeakPolarHBondContact O-CD 3.33Å; S135-K139 WeakPolarHBondContact O-CE 3.37Å; S135-K139 VanDerWaalsContact O-CG 3.3Å; S135-K139 WeakPolarHBondContact O-CG 3.45Å
136	T	87.5	Confident	89.1	Confident	43 Å²	43	85.6 Å²	85.6	26%	0.264	45%	0.445	S	S	.	.	H	α-helix	trans	-87.4	-41.7	175.4	-57.9	0	0	0	0	110.9	A132 L133 N134 S138 K139 V140 V162	A132-T136 PolarHBondContact O-N 2.79Å; A132-T136 VanDerWaalsContact O-N 3.15Å; A132-T136 PolarHBondContact O-OG1 2.76Å; L133-T136 CarbonylContact O-C 3.56Å; L133-T136 WeakPolarHBondContact O-CA 3.42Å; L133-T136 WeakPolarHBondContact O-CB 3.46Å; L133-T136 PolarHBondContact O-N 2.86Å; N134-T136 PolarHBondContact O-N 2.92Å; T136-S138 PolarHBondContact O-N 3.4Å; T136-K139 PolarHBondContact O-N 2.93Å; T136-V140 WeakPolarHBondContact O-CG2 3.49Å; T136-V140 PolarHBondContact O-N 2.84Å; T136-V140 VanDerWaalsContact O-N 3.07Å; T136-V162 HydrophobicContact CG2-CG2 4.22Å
137	I	88.7	Confident	88.7	Confident	104 Å²	104	90 Å²	90	53%	0.533	46%	0.461	S	S	.	.	H	α-helix	trans	-57.4	-48.6	174.5	-67.6	165.3	0	0	0	110.4	L133 N134 K139 V140 D141	L133-I137 WeakPolarHBondContact O-CG1 3.46Å; L133-I137 PolarHBondContact O-N 2.86Å; N134-I137 PolarHBondContact O-N 2.8Å; I137-K139 VanDerWaalsContact C-N 3.28Å; I137-K139 PolarHBondContact O-N 3.08Å; I137-V140 WeakPolarHBondContact O-CB 3.48Å; I137-V140 PolarHBondContact O-N 2.83Å; I137-D141 PolarHBondContact O-N 3.05Å
138	S	90.1	Very high	88.1	Confident	69 Å²	69	91 Å²	91	48%	0.483	47%	0.47	S	S	.	.	H	α-helix	trans	-60.3	-34.8	178.2	-58.7	0	0	0	0	113.1	N134 T136 I142	N134-S138 PolarHBondContact O-N 2.91Å; N134-S138 PolarHBondContact O-OG 2.83Å; T136-S138 PolarHBondContact O-N 3.4Å; S138-I142 WeakPolarHBondContact O-CD1 3.48Å; S138-I142 VanDerWaalsContact O-CG1 3.23Å; S138-I142 WeakPolarHBondContact O-CG1 3.43Å; S138-I142 PolarHBondContact O-N 3.38Å
139	K	86.1	Confident	87.3	Confident	125 Å²	125	91.4 Å²	91.4	54%	0.543	48%	0.477	S	S	.	.	H	α-helix	trans	-69.2	-37.4	175.1	-70.1	168.7	-171.7	172.6	0	112	S135 T136 I137 V143	S135-K139 VanDerWaalsContact O-CD 3.27Å; S135-K139 WeakPolarHBondContact O-CD 3.33Å; S135-K139 WeakPolarHBondContact O-CE 3.37Å; S135-K139 VanDerWaalsContact O-CG 3.3Å; S135-K139 WeakPolarHBondContact O-CG 3.45Å; T136-K139 PolarHBondContact O-N 2.93Å; I137-K139 VanDerWaalsContact C-N 3.28Å; I137-K139 PolarHBondContact O-N 3.08Å; K139-V143 WeakPolarHBondContact O-CG2 3.25Å; K139-V143 PolarHBondContact O-N 3.43Å
140	V	86.9	Confident	86.8	Confident	43 Å²	43	91.2 Å²	91.2	26%	0.261	48%	0.483	S	S	.	.	H	α-helix	trans	-65.9	-46.7	174.3	174.7	0	0	0	0	110.6	T136 I137 I142 V143 L144 T158 V162	T136-V140 WeakPolarHBondContact O-CG2 3.49Å; T136-V140 PolarHBondContact O-N 2.84Å; T136-V140 VanDerWaalsContact O-N 3.07Å; I137-V140 WeakPolarHBondContact O-CB 3.48Å; I137-V140 PolarHBondContact O-N 2.83Å; V140-I142 PolarHBondContact O-N 3.36Å; V140-V143 PolarHBondContact O-N 3.04Å; V140-L144 HydrophobicContact CG1-CD1 3.82Å; V140-L144 HydrophobicContact CG1-CG 4.24Å; V140-L144 WeakPolarHBondContact O-CG 3.35Å; V140-L144 PolarHBondContact O-N 3.35Å; V140-T158 HydrophobicContact CB-CG2 4.49Å; V140-T158 HydrophobicContact CG2-CG2 3.75Å; V140-V162 HydrophobicContact CG2-CG2 3.46Å; V140-V162 VanDerWaalsContact CG2-CG2 3.46Å
141	D	88.3	Confident	86.4	Confident	67 Å²	67	90.1 Å²	90.1	36%	0.358	48%	0.475	S	S	.	.	H	α-helix	trans	-62.1	-42.2	179.4	-176.7	71.5	0	0	0	112.4	I137 V143 L144 R145	I137-D141 PolarHBondContact O-N 3.05Å; D141-V143 VanDerWaalsContact C-N 3.34Å; D141-V143 PolarHBondContact O-N 3.04Å; D141-L144 PolarHBondContact O-N 3.38Å; D141-R145 VanDerWaalsContact CG-NH2 3.32Å; D141-R145 WeakPolarHBondContact O-CG 3.45Å; D141-R145 PolarHBondContact O-N 3.04Å; D141-R145 VanDerWaalsContact O-N 3.08Å; D141-R145 IonicContact OD1-CZ 2.58Å; D141-R145 IonicContact OD1-NE 3.51Å; D141-R145 IonicContact OD1-NH2 2.67Å; D141-R145 PolarHBondContact OD1-NH2 3.36Å; D141-R145 IonicContact OD2-CZ 3.86Å; D141-R145 IonicContact OD2-NE 3.03Å; D141-R145 PolarHBondContact OD2-NE 2.8Å; D141-R145 IonicContact OD2-NH2 3.63Å; D141-R145 PolarHBondContact OD2-NH2 3.08Å
142	I	86.1	Confident	85.7	Confident	115 Å²	115	89 Å²	89	59%	0.59	47%	0.473	S	S	*	.	H	α-helix	trans	-58.1	-45.3	172.8	-70.9	164.3	0	0	0	111.4	S138 V140 R145 A146	S138-I142 WeakPolarHBondContact O-CD1 3.48Å; S138-I142 VanDerWaalsContact O-CG1 3.23Å; S138-I142 WeakPolarHBondContact O-CG1 3.43Å; S138-I142 PolarHBondContact O-N 3.38Å; V140-I142 PolarHBondContact O-N 3.36Å; I142-R145 PolarHBondContact O-N 3.39Å; I142-A146 PolarHBondContact O-N 3Å
143	V	86.6	Confident	85.2	Confident	21 Å²	21	92.6 Å²	92.6	13%	0.127	48%	0.48	C	S	.	.	H	α-helix	trans	-67.7	-38.8	178.6	171.5	0	0	0	0	111.4	K139 V140 D141 R145 A146 F151 E154	K139-V143 WeakPolarHBondContact O-CG2 3.25Å; K139-V143 PolarHBondContact O-N 3.43Å; V140-V143 PolarHBondContact O-N 3.04Å; D141-V143 VanDerWaalsContact C-N 3.34Å; D141-V143 PolarHBondContact O-N 3.04Å; V143-R145 PolarHBondContact O-N 2.89Å; V143-A146 WeakPolarHBondContact O-CB 3.41Å; V143-A146 PolarHBondContact O-N 2.99Å; V143-A146 VanDerWaalsContact O-N 3.11Å; V143-F151 HydrophobicContact CG1-CD2 3.9Å; V143-F151 HydrophobicContact CG1-CE2 4.15Å; V143-F151 WeakPolarHBondContact O-CD2 3.26Å; V143-E154 HydrophobicContact CG2-CB 4Å
144	L	85.9	Confident	84.8	Confident	122 Å²	122	92.6 Å²	92.6	64%	0.639	48%	0.478	S	S	*	.	H	α-helix	trans	-66.2	-22.8	176.7	-71.3	173.5	0	0	0	113.8	V140 D141	V140-L144 HydrophobicContact CG1-CD1 3.82Å; V140-L144 HydrophobicContact CG1-CG 4.24Å; V140-L144 WeakPolarHBondContact O-CG 3.35Å; V140-L144 PolarHBondContact O-N 3.35Å; D141-L144 PolarHBondContact O-N 3.38Å
145	R	85.8	Confident	84.3	Confident	184 Å²	184	93.3 Å²	93.3	69%	0.694	48%	0.475	S	S	*	.	H	α-helix	trans	-83.2	-16.4	173.1	-67.3	173.3	-162.3	-91.4	-7.3	113.5	D141 I142 V143	D141-R145 VanDerWaalsContact CG-NH2 3.32Å; D141-R145 WeakPolarHBondContact O-CG 3.45Å; D141-R145 PolarHBondContact O-N 3.04Å; D141-R145 VanDerWaalsContact O-N 3.08Å; D141-R145 IonicContact OD1-CZ 2.58Å; D141-R145 IonicContact OD1-NE 3.51Å; D141-R145 IonicContact OD1-NH2 2.67Å; D141-R145 PolarHBondContact OD1-NH2 3.36Å; D141-R145 IonicContact OD2-CZ 3.86Å; D141-R145 IonicContact OD2-NE 3.03Å; D141-R145 PolarHBondContact OD2-NE 2.8Å; D141-R145 IonicContact OD2-NH2 3.63Å; D141-R145 PolarHBondContact OD2-NH2 3.08Å; I142-R145 PolarHBondContact O-N 3.39Å; V143-R145 PolarHBondContact O-N 2.89Å
146	A	82.2	Confident	83.9	Confident	39 Å²	39	98 Å²	98	32%	0.322	49%	0.487	S	S	.	.			trans	-73.2	146.5	176.9	0	0	0	0	0	111.2	I142 V143 F151	I142-A146 PolarHBondContact O-N 3Å; V143-A146 WeakPolarHBondContact O-CB 3.41Å; V143-A146 PolarHBondContact O-N 2.99Å; V143-A146 VanDerWaalsContact O-N 3.11Å; A146-F151 HydrophobicContact CB-CB 4.3Å
147	K	83.9	Confident	83.5	Confident	164 Å²	164	104.1 Å²	104.1	71%	0.713	51%	0.506	S	S	*	.			trans	-107.1	163	174.2	-63.5	-173.4	177.4	-177.2	0	110.9	P150	K147-P150 WeakPolarHBondContact O-CD 3.39Å
148	D	82.4	Confident	83	Confident	131 Å²	131	100.3 Å²	100.3	70%	0.701	49%	0.488	S	S	*	.	H	α-helix	trans	51.5	-132.5	163.3	-47.3	-48.8	0	0	0	114.7	F151 L152	D148-F151 PolarHBondContact O-N 2.95Å; D148-L152 PolarHBondContact O-N 2.97Å
149	L	76.4	Confident	82.6	Confident	117 Å²	117	102.8 Å²	102.8	61%	0.613	49%	0.49	S	S	*	.	H	α-helix	trans	-61.4	-43.6	-170.7	-141.9	76.3	0	0	0	114.2	F151 L152 Q153	L149-F151 VanDerWaalsContact C-N 3.32Å; L149-F151 PolarHBondContact O-N 3.12Å; L149-L152 PolarHBondContact O-N 2.88Å; L149-Q153 WeakPolarHBondContact O-CG 3.37Å; L149-Q153 PolarHBondContact O-N 3.16Å; L149-Q153 VanDerWaalsContact O-N 3.13Å
150	P	79.1	Confident	82.2	Confident	80 Å²	80	104 Å²	104	52%	0.519	50%	0.497	S	S	.	.	H	α-helix	trans	-55.8	-39.8	174.4	-29.5	36.2	0	0	0	114.6	K147 Q153 E154	K147-P150 WeakPolarHBondContact O-CD 3.39Å; P150-Q153 PolarHBondContact O-N 2.87Å; P150-E154 PolarHBondContact O-N 2.97Å
151	F	83.3	Confident	81.6	Confident	61 Å²	61	104.4 Å²	104.4	27%	0.268	50%	0.502	S	S	.	.	H	α-helix	trans	-60.9	-47.5	175.8	170.4	-98.9	0	0	0	111.2	V143 A146 D148 L149 Q153 E154 Y155	V143-F151 HydrophobicContact CG1-CD2 3.9Å; V143-F151 HydrophobicContact CG1-CE2 4.15Å; V143-F151 WeakPolarHBondContact O-CD2 3.26Å; A146-F151 HydrophobicContact CB-CB 4.3Å; D148-F151 PolarHBondContact O-N 2.95Å; L149-F151 VanDerWaalsContact C-N 3.32Å; L149-F151 PolarHBondContact O-N 3.12Å; F151-Q153 VanDerWaalsContact C-N 3.27Å; F151-Q153 PolarHBondContact O-N 3.23Å; F151-E154 PolarHBondContact O-N 3.05Å; F151-Y155 HydrophobicContact CE1-CD2 4.27Å; F151-Y155 HydrophobicContact CE2-CD2 4.31Å; F151-Y155 AromaticContact CZ-CD2 3.73Å; F151-Y155 HydrophobicContact CZ-CD2 3.73Å; F151-Y155 HydrophobicContact CZ-CE2 4.39Å; F151-Y155 HydrophobicContact CZ-CG 4.46Å; F151-Y155 WeakPolarHBondContact O-CB 3.29Å; F151-Y155 PolarHBondContact O-N 3.26Å
152	L	79.2	Confident	81.1	Confident	113 Å²	113	104.9 Å²	104.9	59%	0.592	51%	0.507	S	S	*	.	H	α-helix	trans	-64.7	-29.4	-178.9	-66.1	174.9	0	0	0	113.2	D148 L149	D148-L152 PolarHBondContact O-N 2.97Å; L149-L152 PolarHBondContact O-N 2.88Å
153	Q	79.7	Confident	80.5	Confident	131 Å²	131	108.1 Å²	108.1	61%	0.612	52%	0.517	S	S	*	.	H	α-helix	trans	-70.5	-50.3	176.3	-71.9	179.5	-6.5	0	0	112.3	L149 P150 F151	L149-Q153 WeakPolarHBondContact O-CG 3.37Å; L149-Q153 PolarHBondContact O-N 3.16Å; L149-Q153 VanDerWaalsContact O-N 3.13Å; P150-Q153 PolarHBondContact O-N 2.87Å; F151-Q153 VanDerWaalsContact C-N 3.27Å; F151-Q153 PolarHBondContact O-N 3.23Å
154	E	81.6	Confident	79.7	Confident	65 Å²	65	116.8 Å²	116.8	30%	0.304	55%	0.547	S	S	.	.	H	α-helix	trans	-84.9	-18.4	-177.4	-77.5	-57	141.2	0	0	114.7	V143 P150 F151 K156 R157 T158	V143-E154 HydrophobicContact CG2-CB 4Å; P150-E154 PolarHBondContact O-N 2.97Å; F151-E154 PolarHBondContact O-N 3.05Å; E154-K156 VanDerWaalsContact C-N 3.28Å; E154-K156 PolarHBondContact O-N 2.94Å; E154-K156 VanDerWaalsContact O-N 3.17Å; E154-R157 PolarHBondContact O-N 3.13Å; E154-R157 VanDerWaalsContact O-N 3.1Å; E154-R157 VanDerWaalsContact OE1-CD 3.27Å; E154-R157 WeakPolarHBondContact OE1-CD 3.45Å; E154-R157 IonicContact OE1-CZ 2.81Å; E154-R157 IonicContact OE1-NE 2.87Å; E154-R157 IonicContact OE1-NH1 2.77Å; E154-R157 PolarHBondContact OE1-NH1 3.43Å; E154-R157 WeakPolarHBondContact OE2-CB 3.39Å; E154-R157 WeakPolarHBondContact OE2-CD 3.46Å; E154-T158 PolarHBondContact O-N 3.2Å; E154-T158 PolarHBondContact O-OG1 2.94Å
155	Y	81.6	Confident	78.9	Confident	101 Å²	101	120.5 Å²	120.5	40%	0.396	56%	0.558	S	S	.	*	H	α-helix	trans	-49.1	-45.8	178.4	173.3	-97.3	0	0	0	113.1	F151 K159	F151-Y155 HydrophobicContact CE1-CD2 4.27Å; F151-Y155 HydrophobicContact CE2-CD2 4.31Å; F151-Y155 AromaticContact CZ-CD2 3.73Å; F151-Y155 HydrophobicContact CZ-CD2 3.73Å; F151-Y155 HydrophobicContact CZ-CE2 4.39Å; F151-Y155 HydrophobicContact CZ-CG 4.46Å; F151-Y155 WeakPolarHBondContact O-CB 3.29Å; F151-Y155 PolarHBondContact O-N 3.26Å; Y155-K159 HydrophobicContact CE1-CD 3.8Å; Y155-K159 HydrophobicContact CE2-CD 4.49Å; Y155-K159 WeakPolarHBondContact O-CB 3.29Å; Y155-K159 PolarHBondContact O-N 2.87Å; Y155-K159 PolarHBondContact OH-NZ 2.77Å
156	K	79.8	Confident	78.3	Confident	162 Å²	162	117 Å²	117	70%	0.704	55%	0.552	S	S	*	*	H	α-helix	trans	-64.2	-45.3	-179.6	-76.3	-176.5	177.2	176.6	0	112.2	E154 Q160	E154-K156 VanDerWaalsContact C-N 3.28Å; E154-K156 PolarHBondContact O-N 2.94Å; E154-K156 VanDerWaalsContact O-N 3.17Å; K156-Q160 WeakPolarHBondContact O-CB 3.27Å; K156-Q160 PolarHBondContact O-N 2.94Å; K156-Q160 VanDerWaalsContact O-N 3.16Å
157	R	79.4	Confident	77.9	Confident	173 Å²	173	121.9 Å²	121.9	65%	0.653	57%	0.568	S	S	*	*	H	α-helix	trans	-64.5	-50.8	-179.3	-71.5	168.6	169.4	174.9	-1.5	110.8	E154 Q160 S161	E154-R157 PolarHBondContact O-N 3.13Å; E154-R157 VanDerWaalsContact O-N 3.1Å; E154-R157 VanDerWaalsContact OE1-CD 3.27Å; E154-R157 WeakPolarHBondContact OE1-CD 3.45Å; E154-R157 IonicContact OE1-CZ 2.81Å; E154-R157 IonicContact OE1-NE 2.87Å; E154-R157 IonicContact OE1-NH1 2.77Å; E154-R157 PolarHBondContact OE1-NH1 3.43Å; E154-R157 WeakPolarHBondContact OE2-CB 3.39Å; E154-R157 WeakPolarHBondContact OE2-CD 3.46Å; R157-Q160 PolarHBondContact O-N 2.82Å; R157-S161 PolarHBondContact O-N 3.04Å
158	T	79.6	Confident	77.8	Confident	24 Å²	24	122.2 Å²	122.2	15%	0.147	57%	0.572	C	S	.	*	H	α-helix	trans	-64.1	-44.3	179.9	-64.9	0	0	0	0	112.1	V140 E154 Q160 S161 V162	V140-T158 HydrophobicContact CB-CG2 4.49Å; V140-T158 HydrophobicContact CG2-CG2 3.75Å; E154-T158 PolarHBondContact O-N 3.2Å; E154-T158 PolarHBondContact O-OG1 2.94Å; T158-Q160 PolarHBondContact O-N 3.24Å; T158-S161 WeakPolarHBondContact O-CB 3.23Å; T158-S161 PolarHBondContact O-N 2.93Å; T158-S161 VanDerWaalsContact O-N 3.13Å; T158-V162 HydrophobicContact CG2-CG2 4.39Å; T158-V162 WeakPolarHBondContact O-CG2 3.28Å; T158-V162 PolarHBondContact O-N 3.24Å
159	K	81.7	Confident	77.7	Confident	121 Å²	121	120.2 Å²	120.2	53%	0.526	57%	0.566	S	S	.	*	H	α-helix	trans	-58.2	-35.6	174.9	-174.7	175.5	-168.9	171.8	0	112.6	Y155 K163	Y155-K159 HydrophobicContact CE1-CD 3.8Å; Y155-K159 HydrophobicContact CE2-CD 4.49Å; Y155-K159 WeakPolarHBondContact O-CB 3.29Å; Y155-K159 PolarHBondContact O-N 2.87Å; Y155-K159 PolarHBondContact OH-NZ 2.77Å; K159-K163 PolarHBondContact O-N 2.99Å
160	Q	77.9	Confident	78	Confident	151 Å²	151	120.9 Å²	120.9	71%	0.706	57%	0.566	S	S	*	*	H	α-helix	trans	-77.4	-31.1	178.9	-160.7	162.7	4.6	0	0	112.3	K156 R157 T158	K156-Q160 WeakPolarHBondContact O-CB 3.27Å; K156-Q160 PolarHBondContact O-N 2.94Å; K156-Q160 VanDerWaalsContact O-N 3.16Å; R157-Q160 PolarHBondContact O-N 2.82Å; T158-Q160 PolarHBondContact O-N 3.24Å
161	S	72.9	Confident	78.1	Confident	50 Å²	50	123.2 Å²	123.2	35%	0.35	58%	0.579	S	S	.	*	H	α-helix	trans	-66.9	-47.7	171	-169.4	0	0	0	0	112.2	R157 T158 K163 R164	R157-S161 PolarHBondContact O-N 3.04Å; T158-S161 WeakPolarHBondContact O-CB 3.23Å; T158-S161 PolarHBondContact O-N 2.93Å; T158-S161 VanDerWaalsContact O-N 3.13Å; S161-K163 PolarHBondContact O-N 3.28Å; S161-R164 WeakPolarHBondContact O-CB 3.39Å; S161-R164 WeakPolarHBondContact O-CG 3.47Å; S161-R164 PolarHBondContact O-N 3.13Å
162	V	77.4	Confident	78.1	Confident	78 Å²	78	123.2 Å²	123.2	47%	0.473	58%	0.581	S	S	.	*	H	α-helix	trans	-66.6	-20	178.6	175.8	0	0	0	0	112.5	T136 V140 T158 R164	T136-V162 HydrophobicContact CG2-CG2 4.22Å; V140-V162 HydrophobicContact CG2-CG2 3.46Å; V140-V162 VanDerWaalsContact CG2-CG2 3.46Å; T158-V162 HydrophobicContact CG2-CG2 4.39Å; T158-V162 WeakPolarHBondContact O-CG2 3.28Å; T158-V162 PolarHBondContact O-N 3.24Å; V162-R164 PolarHBondContact O-N 2.78Å
163	K	74.2	Confident	78.5	Confident	183 Å²	183	128.4 Å²	128.4	80%	0.796	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-0.4	175.8	-149.8	-177.3	179.9	-172.9	0	113.9	K159 S161	K159-K163 PolarHBondContact O-N 2.99Å; S161-K163 PolarHBondContact O-N 3.28Å
164	R	70.1	Confident	79	Confident	203 Å²	203	128.9 Å²	128.9	77%	0.766	60%	0.599	S	S	*	*	S	Bend	trans	-67.2	132.9	168.9	-73.5	177.7	170.6	-179.4	-3.5	109.6	S161 V162 I166	S161-R164 WeakPolarHBondContact O-CB 3.39Å; S161-R164 WeakPolarHBondContact O-CG 3.47Å; S161-R164 PolarHBondContact O-N 3.13Å; V162-R164 PolarHBondContact O-N 2.78Å; R164-I166 PolarHBondContact O-N 3.12Å
165	K	69.2	Low	79.7	Confident	200 Å²	200	127.7 Å²	127.7	87%	0.87	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-70	121.2	178	-154	-175.6	-175.1	-168.7	0	108.7
166	I	73.5	Confident	80.3	Confident	111 Å²	111	129.7 Å²	129.7	57%	0.569	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-63.4	138.7	166.6	-54.2	-179.7	0	0	0	107.1	L133 R164	L133-I166 HydrophobicContact CD1-CG2 4.26Å; L133-I166 HydrophobicContact CD2-CD1 3.91Å; L133-I166 HydrophobicContact CD2-CG1 3.94Å; L133-I166 HydrophobicContact CD2-CG2 4.31Å; R164-I166 PolarHBondContact O-N 3.12Å
167	Q	73.3	Confident	81.2	Confident	141 Å²	141	125.2 Å²	125.2	66%	0.659	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-87.3	139.2	173.2	-60.3	-162.2	55.6	0	0	109
168	E	80.6	Confident	81.9	Confident	171 Å²	171	120.5 Å²	120.5	80%	0.799	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-79.9	141	172.1	-69.1	-64.5	163.9	0	0	109.3	E170	E168-E170 PolarHBondContact O-N 2.82Å
169	P	80.8	Confident	82.6	Confident	88 Å²	88	122.8 Å²	122.8	57%	0.571	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-55.9	133.1	179.6	-27.2	35.5	0	0	0	113.4	T171	P169-T171 PolarHBondContact O-N 3.03Å
170	E	83.3	Confident	83.2	Confident	131 Å²	131	120.5 Å²	120.5	61%	0.612	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-66.8	127.6	-177.6	-173.2	-176.3	-162.6	0	0	112.2	K122 E168 M172	K122-E170 IonicContact NZ-OE2 2.69Å; K122-E170 PolarHBondContact NZ-OE2 3.16Å; E168-E170 PolarHBondContact O-N 2.82Å; E170-M172 PolarHBondContact O-N 2.83Å; E170-M172 VanDerWaalsContact O-N 3.14Å
171	T	81	Confident	83.9	Confident	129 Å²	129	118.6 Å²	118.6	79%	0.791	59%	0.592	S	S	*	*			trans	-78.1	98.6	176.3	-55.8	0	0	0	0	111.2	P169	P169-T171 PolarHBondContact O-N 3.03Å
172	M	84.4	Confident	84.9	Confident	62 Å²	62	117.1 Å²	117.1	31%	0.305	58%	0.58	S	S	.	*			trans	-71.3	134.7	178.6	-69.4	-177.6	-94.3	0	0	112.9	V118 M119 K122 E170 I175	V118-M172 HydrophobicContact CG1-SD 4.31Å; M119-M172 HydrophobicContact CE-CE 4.23Å; M119-M172 HydrophobicContact SD-CE 3.75Å; M119-M172 HydrophobicContact SD-SD 4.17Å; K122-M172 HydrophobicContact CB-CE 3.84Å; K122-M172 HydrophobicContact CB-SD 4.3Å; K122-M172 HydrophobicContact CD-CE 4.31Å; K122-M172 HydrophobicContact CD-SD 4.19Å; K122-M172 HydrophobicContact CG-CE 3.92Å; K122-M172 HydrophobicContact CG-SD 3.75Å; E170-M172 PolarHBondContact O-N 2.83Å; E170-M172 VanDerWaalsContact O-N 3.14Å; M172-I175 HydrophobicContact CB-CB 4.27Å; M172-I175 HydrophobicContact CB-CG2 4.36Å; M172-I175 HydrophobicContact SD-CD1 4.39Å; M172-I175 HydrophobicContact SD-CG1 4.37Å
173	R	87.3	Confident	85.6	Confident	221 Å²	221	119.2 Å²	119.2	83%	0.834	59%	0.588	S	S	*	*	S	Bend	trans	-101.6	157.3	172.4	-61.9	-176.7	-176.9	-178.1	0.6	110.8	I175	R173-I175 PolarHBondContact O-N 2.95Å
174	D	90.4	Very high	86.4	Confident	141 Å²	141	112.3 Å²	112.3	75%	0.754	57%	0.568	S	S	*	*	S	Bend	trans	54.2	15.7	175.2	-58.7	-48.7	0	0	0	116.7	K115 L176	K115-D174 WeakPolarHBondContact CE-O 3.34Å; K115-D174 PolarHBondContact NZ-O 3.36Å; D174-L176 PolarHBondContact O-N 2.78Å
175	I	94.6	Very high	87.3	Confident	40 Å²	40	108.8 Å²	108.8	21%	0.205	56%	0.563	C	S	.	*			trans	-74.6	-20.8	-173	-165.3	57.2	0	0	0	114.1	K115 V118 M119 M172 R173	K115-I175 HydrophobicContact CB-CD1 4.47Å; K115-I175 WeakPolarHBondContact CD-O 3.34Å; V118-I175 HydrophobicContact CB-CD1 4.13Å; V118-I175 HydrophobicContact CG1-CD1 3.84Å; M119-I175 HydrophobicContact CG-CD1 4.02Å; M119-I175 HydrophobicContact CG-CG1 3.94Å; M119-I175 HydrophobicContact SD-CD1 4.03Å; M119-I175 HydrophobicContact SD-CG1 3.56Å; M119-I175 VanDerWaalsContact SD-CG1 3.56Å; M172-I175 HydrophobicContact CB-CB 4.27Å; M172-I175 HydrophobicContact CB-CG2 4.36Å; M172-I175 HydrophobicContact SD-CD1 4.39Å; M172-I175 HydrophobicContact SD-CG1 4.37Å; R173-I175 PolarHBondContact O-N 2.95Å
176	L	95.9	Very high	88.4	Confident	144 Å²	144	101.7 Å²	101.7	75%	0.754	54%	0.535	S	S	*	.	S	Bend	trans	-83.9	154.4	174.7	-58.6	-179.2	0	0	0	111.3	K115 D174 N178	K115-L176 PolarHBondContact NZ-O 3.43Å; D174-L176 PolarHBondContact O-N 2.78Å; L176-N178 PolarHBondContact O-N 3.24Å
177	I	97.4	Very high	89.3	Confident	67 Å²	67	104.9 Å²	104.9	34%	0.344	55%	0.545	S	S	.	.			trans	-57.2	130	176.8	-58.7	-62.1	0	0	0	110.5	L108 E111 E112 K115 S179	L108-I177 HydrophobicContact CD1-CG2 3.7Å; E111-I177 HydrophobicContact CG-CD1 4.27Å; E112-I177 HydrophobicContact CB-CD1 4.12Å; K115-I177 HydrophobicContact CD-CD1 4.4Å; I177-S179 VanDerWaalsContact C-N 3.33Å; I177-S179 PolarHBondContact O-N 3.04Å
178	N	95.3	Very high	90.1	Very high	75 Å²	75	102.9 Å²	102.9	40%	0.401	53%	0.534	S	S	.	.			trans	-79.7	81.1	176.9	-172.4	-27.7	0	0	0	110.5	E111 L176 A180 K181 H182	E111-N178 PolarHBondContact OE1-N 2.91Å; L176-N178 PolarHBondContact O-N 3.24Å; N178-A180 PolarHBondContact O-N 2.93Å; N178-A180 PolarHBondContact OD1-N 3.47Å; N178-K181 HydrophobicContact CB-CB 4.02Å; N178-K181 HydrophobicContact CB-CD 4.4Å; N178-K181 WeakPolarHBondContact O-CB 3.37Å; N178-K181 PolarHBondContact O-N 3.22Å; N178-K181 VanDerWaalsContact O-N 3.1Å; N178-K181 WeakPolarHBondContact OD1-CB 3.37Å; N178-K181 PolarHBondContact OD1-N 3.3Å; N178-H182 PolarHBondContact O-CD2 2.65Å; N178-H182 PolarHBondContact O-N 2.68Å
179	S	94.4	Very high	90.6	Very high	72 Å²	72	96.8 Å²	96.8	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-57.1	-31.2	180	-56.1	0	0	0	0	113.3	I177 H182 L183	I177-S179 VanDerWaalsContact C-N 3.33Å; I177-S179 PolarHBondContact O-N 3.04Å; S179-H182 PolarHBondContact O-N 2.91Å; S179-L183 WeakPolarHBondContact O-CB 3.28Å; S179-L183 PolarHBondContact O-N 3.4Å
180	A	93.9	Very high	91.1	Very high	73 Å²	73	93.6 Å²	93.6	60%	0.603	49%	0.488	S	S	*	.	H	α-helix	trans	-66.5	-37.7	177.3	0	0	0	0	0	112.5	N178 H182 G184	N178-A180 PolarHBondContact O-N 2.93Å; N178-A180 PolarHBondContact OD1-N 3.47Å; A180-H182 VanDerWaalsContact C-N 3.34Å; A180-H182 PolarHBondContact O-N 3Å; A180-G184 WeakPolarHBondContact O-CA 3.2Å; A180-G184 PolarHBondContact O-N 2.9Å
181	K	91.8	Very high	91.5	Very high	110 Å²	110	90.3 Å²	90.3	48%	0.478	48%	0.478	S	S	.	.	H	α-helix	trans	-65.1	-34	174.3	168.9	-170	167	-163.6	0	112.9	E111 N178	E111-K181 IonicContact OE2-NZ 2.66Å; E111-K181 PolarHBondContact OE2-NZ 2.88Å; N178-K181 HydrophobicContact CB-CB 4.02Å; N178-K181 HydrophobicContact CB-CD 4.4Å; N178-K181 WeakPolarHBondContact O-CB 3.37Å; N178-K181 PolarHBondContact O-N 3.22Å; N178-K181 VanDerWaalsContact O-N 3.1Å; N178-K181 WeakPolarHBondContact OD1-CB 3.37Å; N178-K181 PolarHBondContact OD1-N 3.3Å
182	H	93.6	Very high	92	Very high	20 Å²	20	86.4 Å²	86.4	9%	0.093	45%	0.451	C	S	.	.	H	α-helix	trans	-88.9	-41.4	-176.6	-65.6	-67.1	0	0	0	113.3	E111 N178 S179 A180	E111-H182 IonicContact OE2-CD2 2.65Å; E111-H182 IonicContact OE2-CE1 2.68Å; E111-H182 IonicContact OE2-NE2 3.51Å; E111-H182 PolarHBondContact OE2-NE2 2.9Å; N178-H182 PolarHBondContact O-CD2 2.65Å; N178-H182 PolarHBondContact O-N 2.68Å; S179-H182 PolarHBondContact O-N 2.91Å; A180-H182 VanDerWaalsContact C-N 3.34Å; A180-H182 PolarHBondContact O-N 3Å
183	L	93.4	Very high	92.3	Very high	121 Å²	121	86.7 Å²	86.7	63%	0.634	45%	0.45	S	S	*	.	H	α-helix	trans	-101.6	-25.3	-174.5	-56.7	177.7	0	0	0	113.7	S179 I185 L186	S179-L183 WeakPolarHBondContact O-CB 3.28Å; S179-L183 PolarHBondContact O-N 3.4Å; L183-I185 PolarHBondContact O-N 3.35Å; L183-L186 HydrophobicContact CD2-CD2 4.45Å; L183-L186 VanDerWaalsContact O-CB 3.26Å; L183-L186 WeakPolarHBondContact O-CB 3.3Å; L183-L186 PolarHBondContact O-N 3.27Å
184	G	90.7	Very high	92.4	Very high	38 Å²	38	78.5 Å²	78.5	39%	0.392	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	123	-177.2	0	0	0	0	0	111.6	A180 L186	A180-G184 WeakPolarHBondContact O-CA 3.2Å; A180-G184 PolarHBondContact O-N 2.9Å; G184-L186 PolarHBondContact O-N 3.46Å
185	I	88.8	Confident	92.3	Very high	129 Å²	129	74 Å²	74	66%	0.662	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	22.4	177.2	-46.3	176.1	0	0	0	111.5	L183 K187 F188 T189	L183-I185 PolarHBondContact O-N 3.35Å; I185-K187 PolarHBondContact O-N 2.8Å; I185-F188 HydrophobicContact CG2-CB 3.76Å; I185-F188 HydrophobicContact CG2-CD1 3.62Å; I185-F188 HydrophobicContact CG2-CG 4Å; I185-F188 PolarHBondContact O-N 3.07Å; I185-T189 WeakPolarHBondContact O-CB 3.19Å; I185-T189 PolarHBondContact O-N 3.06Å; I185-T189 PolarHBondContact O-OG1 3.38Å
186	L	91.3	Very high	92	Very high	52 Å²	52	77.8 Å²	77.8	27%	0.272	41%	0.413	S	S	.	.	H	α-helix	trans	-55	-60.5	-172.9	173.2	59.8	0	0	0	112.2	R104 L183 G184 F188 T189 V190	R104-L186 HydrophobicContact CG-CD1 4.21Å; L183-L186 HydrophobicContact CD2-CD2 4.45Å; L183-L186 VanDerWaalsContact O-CB 3.26Å; L183-L186 WeakPolarHBondContact O-CB 3.3Å; L183-L186 PolarHBondContact O-N 3.27Å; G184-L186 PolarHBondContact O-N 3.46Å; L186-F188 PolarHBondContact O-N 2.91Å; L186-T189 WeakPolarHBondContact O-CB 3.49Å; L186-T189 PolarHBondContact O-N 3.07Å; L186-V190 HydrophobicContact CD1-CG2 4.1Å; L186-V190 WeakPolarHBondContact O-CG2 3.27Å; L186-V190 PolarHBondContact O-N 3.31Å
187	K	92.1	Very high	91.4	Very high	178 Å²	178	76.4 Å²	76.4	77%	0.774	41%	0.406	S	S	*	.	H	α-helix	trans	-54.9	-49.2	-178.2	-66.2	-174.6	178.5	-177	0	112.2	I185 T189 V190 C191	I185-K187 PolarHBondContact O-N 2.8Å; K187-T189 VanDerWaalsContact C-N 3.32Å; K187-T189 PolarHBondContact O-N 3.4Å; K187-V190 PolarHBondContact O-N 2.9Å; K187-C191 PolarHBondContact O-N 2.96Å; K187-C191 PolarHBondContact O-SG 2.88Å
188	F	90.9	Very high	90.8	Very high	98 Å²	98	75.8 Å²	75.8	43%	0.43	41%	0.406	S	S	.	.	H	α-helix	trans	-59.9	-40.5	177.2	174.9	-87.1	0	0	0	112.1	I185 L186 C191 Q192 V380	I185-F188 HydrophobicContact CG2-CB 3.76Å; I185-F188 HydrophobicContact CG2-CD1 3.62Å; I185-F188 HydrophobicContact CG2-CG 4Å; I185-F188 PolarHBondContact O-N 3.07Å; L186-F188 PolarHBondContact O-N 2.91Å; F188-C191 PolarHBondContact O-N 3.46Å; F188-Q192 HydrophobicContact CE1-CB 4.43Å; F188-Q192 VanDerWaalsContact O-CB 3.27Å; F188-Q192 WeakPolarHBondContact O-CB 2.93Å; F188-Q192 PolarHBondContact O-N 3.24Å; F188-V380 HydrophobicContact CE2-CG1 4.01Å; F188-V380 HydrophobicContact CZ-CG1 3.9Å
189	T	90.5	Very high	90.3	Very high	44 Å²	44	79 Å²	79	27%	0.27	42%	0.416	S	S	.	.	H	α-helix	trans	-64.5	-41.8	178.1	-53.7	0	0	0	0	111.8	I185 L186 K187 Q192 K193	I185-T189 WeakPolarHBondContact O-CB 3.19Å; I185-T189 PolarHBondContact O-N 3.06Å; I185-T189 PolarHBondContact O-OG1 3.38Å; L186-T189 WeakPolarHBondContact O-CB 3.49Å; L186-T189 PolarHBondContact O-N 3.07Å; K187-T189 VanDerWaalsContact C-N 3.32Å; K187-T189 PolarHBondContact O-N 3.4Å; T189-Q192 PolarHBondContact O-N 2.95Å; T189-K193 WeakPolarHBondContact O-CG 3.47Å; T189-K193 PolarHBondContact O-N 2.92Å
190	V	93.1	Very high	89.9	Confident	21 Å²	21	80.4 Å²	80.4	13%	0.127	41%	0.411	C	S	.	.	H	α-helix	trans	-63.9	-49.5	175.1	180	0	0	0	0	110.6	F96 L97 E100 L186 K187 Q192 K193 M194	F96-V190 HydrophobicContact CE1-CG1 4.19Å; L97-V190 HydrophobicContact CD2-CG1 3.72Å; E100-V190 HydrophobicContact CG-CB 4.37Å; E100-V190 HydrophobicContact CG-CG1 4.09Å; E100-V190 HydrophobicContact CG-CG2 3.64Å; L186-V190 HydrophobicContact CD1-CG2 4.1Å; L186-V190 WeakPolarHBondContact O-CG2 3.27Å; L186-V190 PolarHBondContact O-N 3.31Å; K187-V190 PolarHBondContact O-N 2.9Å; V190-Q192 VanDerWaalsContact C-N 3.32Å; V190-Q192 PolarHBondContact O-N 3.31Å; V190-K193 WeakPolarHBondContact O-CB 3.4Å; V190-K193 PolarHBondContact O-N 2.75Å; V190-M194 PolarHBondContact O-N 3.03Å
191	C	91.2	Very high	89.7	Confident	61 Å²	61	77.9 Å²	77.9	41%	0.412	39%	0.39	S	S	.	.	H	α-helix	trans	-59.9	-40.1	176.4	-63.9	0	0	0	0	112.2	K187 F188 M194 L195	K187-C191 PolarHBondContact O-N 2.96Å; K187-C191 PolarHBondContact O-SG 2.88Å; F188-C191 PolarHBondContact O-N 3.46Å; C191-M194 WeakPolarHBondContact O-CB 3.45Å; C191-M194 PolarHBondContact O-N 3.48Å; C191-L195 WeakPolarHBondContact O-CB 3.27Å; C191-L195 VanDerWaalsContact O-CG 3.22Å; C191-L195 WeakPolarHBondContact O-CG 3.36Å; C191-L195 PolarHBondContact O-N 2.86Å
192	Q	90.3	Very high	89.6	Confident	48 Å²	48	74.6 Å²	74.6	22%	0.224	38%	0.381	C	S	.	.	H	α-helix	trans	-69	-33.3	178.5	-158.6	-157.7	67.7	0	0	112.3	F188 T189 V190 K196 V380	F188-Q192 HydrophobicContact CE1-CB 4.43Å; F188-Q192 VanDerWaalsContact O-CB 3.27Å; F188-Q192 WeakPolarHBondContact O-CB 2.93Å; F188-Q192 PolarHBondContact O-N 3.24Å; T189-Q192 PolarHBondContact O-N 2.95Å; V190-Q192 VanDerWaalsContact C-N 3.32Å; V190-Q192 PolarHBondContact O-N 3.31Å; Q192-K196 WeakPolarHBondContact O-CD 3.4Å; Q192-K196 VanDerWaalsContact O-CG 3.24Å; Q192-K196 WeakPolarHBondContact O-CG 3.41Å; Q192-K196 PolarHBondContact O-N 2.84Å; Q192-V380 HydrophobicContact CG-CB 4.01Å; Q192-V380 HydrophobicContact CG-CG1 4.35Å; Q192-V380 HydrophobicContact CG-CG2 4.1Å
193	K	90.8	Very high	89.7	Confident	67 Å²	67	74 Å²	74	29%	0.291	38%	0.379	S	S	.	.	H	α-helix	trans	-65	-47.5	169.4	-77.3	176.2	166.9	-176.5	0	110.9	F96 E100 T189 V190 L195 K196 N197	F96-K193 HydrophobicContact CE2-CB 4.5Å; F96-K193 HydrophobicContact CZ-CB 3.83Å; E100-K193 IonicContact OE1-NZ 2.77Å; E100-K193 PolarHBondContact OE1-NZ 3.28Å; E100-K193 VanDerWaalsContact OE2-CD 3.31Å; E100-K193 WeakPolarHBondContact OE2-CD 3.17Å; E100-K193 IonicContact OE2-NZ 2.61Å; E100-K193 PolarHBondContact OE2-NZ 3.31Å; T189-K193 WeakPolarHBondContact O-CG 3.47Å; T189-K193 PolarHBondContact O-N 2.92Å; V190-K193 WeakPolarHBondContact O-CB 3.4Å; V190-K193 PolarHBondContact O-N 2.75Å; K193-L195 PolarHBondContact O-N 3.01Å; K193-K196 PolarHBondContact O-N 2.74Å; K193-N197 PolarHBondContact O-N 3.24Å
194	M	90.4	Very high	89.8	Confident	49 Å²	49	71.3 Å²	71.3	24%	0.241	37%	0.367	C	S	.	.	H	α-helix	trans	-57.3	-51.4	178.9	-162.9	176.8	73.8	0	0	111.6	L93 F96 V190 C191 K196 N197 V198	L93-M194 HydrophobicContact CD2-CG 4.31Å; L93-M194 HydrophobicContact CD2-SD 4.11Å; F96-M194 HydrophobicContact CD1-CB 4.23Å; F96-M194 HydrophobicContact CD1-CG 3.98Å; F96-M194 HydrophobicContact CD1-SD 4.41Å; F96-M194 HydrophobicContact CE1-CB 3.56Å; F96-M194 HydrophobicContact CE1-CG 3.84Å; F96-M194 HydrophobicContact CE1-SD 4.46Å; F96-M194 HydrophobicContact CZ-CB 3.99Å; V190-M194 PolarHBondContact O-N 3.03Å; C191-M194 WeakPolarHBondContact O-CB 3.45Å; C191-M194 PolarHBondContact O-N 3.48Å; M194-K196 PolarHBondContact O-N 3.3Å; M194-N197 PolarHBondContact O-N 2.85Å; M194-V198 WeakPolarHBondContact O-CG2 3.38Å; M194-V198 PolarHBondContact O-N 3.37Å
195	L	88.7	Confident	90.2	Very high	47 Å²	47	69.6 Å²	69.6	25%	0.246	35%	0.349	C	S	.	.	H	α-helix	trans	-66.4	-19.7	-178.7	-67.4	168.4	0	0	0	114.1	C191 K193 M378 V380	C191-L195 WeakPolarHBondContact O-CB 3.27Å; C191-L195 VanDerWaalsContact O-CG 3.22Å; C191-L195 WeakPolarHBondContact O-CG 3.36Å; C191-L195 PolarHBondContact O-N 2.86Å; K193-L195 PolarHBondContact O-N 3.01Å; L195-M378 HydrophobicContact CB-CB 4.33Å; L195-M378 HydrophobicContact CD2-CE 4.27Å; L195-M378 HydrophobicContact CD2-SD 3.67Å; L195-V380 HydrophobicContact CB-CG2 4.24Å; L195-V380 HydrophobicContact CD1-CG2 3.69Å
196	K	86.9	Confident	90.6	Very high	119 Å²	119	65.3 Å²	65.3	52%	0.517	33%	0.328	S	S	.	.	H	α-helix	trans	-75.7	-27.6	171	-75.9	167	-173.5	168.7	0	112.7	Q192 K193 M194	Q192-K196 WeakPolarHBondContact O-CD 3.4Å; Q192-K196 VanDerWaalsContact O-CG 3.24Å; Q192-K196 WeakPolarHBondContact O-CG 3.41Å; Q192-K196 PolarHBondContact O-N 2.84Å; K193-K196 PolarHBondContact O-N 2.74Å; M194-K196 PolarHBondContact O-N 3.3Å
197	N	83.3	Confident	90.8	Very high	115 Å²	115	64.4 Å²	64.4	62%	0.615	33%	0.326	S	S	*	.	H	α-helix	trans	-88.8	-33	178.7	-64.3	-14.3	0	0	0	111.6	K193 M194 K199	K193-N197 PolarHBondContact O-N 3.24Å; M194-N197 PolarHBondContact O-N 2.85Å; N197-K199 PolarHBondContact O-N 3.15Å
198	V	85.2	Confident	91	Very high	55 Å²	55	58.8 Å²	58.8	33%	0.333	30%	0.304	S	S	.	.			trans	-65.4	124.5	172.9	174.8	0	0	0	0	110.3	M194	M194-V198 WeakPolarHBondContact O-CG2 3.38Å; M194-V198 PolarHBondContact O-N 3.37Å
199	K	85	Confident	91.3	Very high	141 Å²	141	54.3 Å²	54.3	61%	0.613	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	153.2	167.2	-68.8	176.7	-176.1	173.3	0	109	N197 A375 Q376 T377	N197-K199 PolarHBondContact O-N 3.15Å; K199-A375 HydrophobicContact CB-CB 4.21Å; K199-A375 HydrophobicContact CD-CB 4.29Å; K199-Q376 WeakPolarHBondContact CA-O 3.49Å; K199-T377 HydrophobicContact CG-CG2 4.48Å
200	Y	85.7	Confident	91.6	Very high	102 Å²	102	52.3 Å²	52.3	40%	0.4	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	146.6	171.6	76.8	-76.1	0	0	0	110.7	Q376 M378	Y200-Q376 HydrophobicContact CD1-CB 4.11Å; Y200-Q376 VanDerWaalsContact CD1-O 3.3Å; Y200-Q376 WeakPolarHBondContact CD1-O 3.3Å; Y200-Q376 HydrophobicContact CE1-CB 3.59Å; Y200-Q376 PolarHBondContact N-O 3.03Å; Y200-Q376 PolarHBondContact O-N 3.13Å; Y200-Q376 PolarHBondContact OH-OE1 3.47Å; Y200-M378 HydrophobicContact CD1-CG 3.64Å; Y200-M378 HydrophobicContact CE1-CG 3.84Å
201	A	89.3	Confident	91.7	Very high	21 Å²	21	52.6 Å²	52.6	17%	0.174	27%	0.273	C	S	.	.			trans	-96.1	151.1	169.4	0	0	0	0	0	110.7	V203 T221 V373	A201-V203 VanDerWaalsContact C-N 3.28Å; A201-V203 WeakPolarHBondContact CB-O 3.28Å; A201-T221 HydrophobicContact CB-CG2 3.36Å; A201-V373 HydrophobicContact CB-CB 4.34Å; A201-V373 HydrophobicContact CB-CG1 3.96Å
202	S	90.6	Very high	91.9	Very high	41 Å²	41	50.8 Å²	50.8	29%	0.287	26%	0.261	S	S	.	.	S	Bend	trans	-77.6	-14.9	174.6	33.5	0	0	0	0	113	W257	S202-W257 WeakPolarHBondContact OG-CA 3.19Å; S202-W257 VanDerWaalsContact OG-CB 3.24Å; S202-W257 WeakPolarHBondContact OG-CB 3.48Å
203	V	95.4	Very high	92.1	Very high	8 Å²	8	49.9 Å²	49.9	5%	0.048	26%	0.258	C	S	.	.			trans	-141.4	136.3	176.3	173.3	0	0	0	0	108.7	A201 L205 W257 P355 F357 V373	A201-V203 VanDerWaalsContact C-N 3.28Å; A201-V203 WeakPolarHBondContact CB-O 3.28Å; V203-L205 HydrophobicContact CG1-CD2 4.38Å; V203-W257 HydrophobicContact CG2-CB 3.81Å; V203-W257 HydrophobicContact CG2-CD2 3.73Å; V203-W257 HydrophobicContact CG2-CE3 4.05Å; V203-W257 HydrophobicContact CG2-CG 3.62Å; V203-P355 HydrophobicContact CG1-CB 3.8Å; V203-P355 HydrophobicContact CG1-CG 3.89Å; V203-P355 HydrophobicContact CG2-CB 4.15Å; V203-P355 HydrophobicContact CG2-CG 3.72Å; V203-F357 HydrophobicContact CG1-CE2 3.92Å; V203-F357 HydrophobicContact CG1-CZ 4.08Å; V203-V373 HydrophobicContact CB-CG1 4.35Å; V203-V373 HydrophobicContact CB-CG2 4.22Å
204	V	96.6	Very high	92.3	Very high	64 Å²	64	46.9 Å²	46.9	39%	0.388	25%	0.245	S	C	.	.			trans	-115.6	141.5	171.1	-176.3	0	0	0	0	107.5	L220 G246 A247	V204-L220 HydrophobicContact CG1-CB 3.83Å; V204-L220 HydrophobicContact CG1-CD1 4.48Å; V204-G246 CarbonylContact O-C 3.53Å; V204-G246 VanDerWaalsContact O-CA 3.27Å; V204-G246 WeakPolarHBondContact O-CA 3.3Å; V204-A247 PolarHBondContact O-N 3.04Å
205	L	98.1	Very high	92.5	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.01	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-94.2	140.8	-172.9	-55.4	174.4	0	0	0	112	V203 L216 L220 V223 V244 F357	V203-L205 HydrophobicContact CG1-CD2 4.38Å; L205-L216 HydrophobicContact CB-CD1 4.08Å; L205-L216 HydrophobicContact CB-CD2 4.22Å; L205-L216 HydrophobicContact CD1-CD2 3.94Å; L205-L220 WeakPolarHBondContact CB-O 3.48Å; L205-L220 WeakPolarHBondContact CG-O 3.48Å; L205-L220 PolarHBondContact N-O 2.72Å; L205-V223 HydrophobicContact CD1-CB 3.79Å; L205-V223 HydrophobicContact CD1-CG1 3.88Å; L205-V244 HydrophobicContact CB-CG2 4.09Å; L205-V244 HydrophobicContact CD1-CG1 4.21Å; L205-V244 HydrophobicContact CD2-CG1 4.29Å; L205-F357 HydrophobicContact CD2-CD2 3.35Å; L205-F357 HydrophobicContact CD2-CE2 3.36Å; L205-F357 HydrophobicContact CD2-CG 4.03Å; L205-F357 HydrophobicContact CD2-CZ 4.03Å
206	D	97.4	Very high	92.8	Very high	39 Å²	39	48.9 Å²	48.9	21%	0.209	25%	0.251	C	S	.	.			trans	-91.3	110.4	-179.3	-175.7	2.5	0	0	0	112.4	N208 T209 A210 V244 L245 A247	D206-N208 PolarHBondContact O-N 2.96Å; D206-N208 VanDerWaalsContact OD1-CB 3.26Å; D206-N208 WeakPolarHBondContact OD1-CB 3.46Å; D206-N208 PolarHBondContact OD1-N 2.66Å; D206-N208 PolarHBondContact OD1-ND2 2.73Å; D206-T209 HydrophobicContact CB-CG2 4.04Å; D206-T209 PolarHBondContact O-N 2.96Å; D206-T209 PolarHBondContact O-OG1 2.84Å; D206-T209 WeakPolarHBondContact OD2-CG2 3.32Å; D206-A210 PolarHBondContact O-N 3.36Å; D206-V244 WeakPolarHBondContact O-CG2 3.46Å; D206-L245 PolarHBondContact N-O 3.22Å; D206-A247 HydrophobicContact CB-CB 4.13Å
207	S	95.7	Very high	93.1	Very high	33 Å²	33	44.9 Å²	44.9	23%	0.231	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-22	176.1	57.8	0	0	0	0	114.2	R237	S207-R237 PolarHBondContact O-NH1 3.42Å
208	N	95.6	Very high	93.3	Very high	59 Å²	59	44.8 Å²	44.8	32%	0.316	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-34.1	173.9	-58.9	-72.1	0	0	0	111.5	D206 N234 R237	D206-N208 PolarHBondContact O-N 2.96Å; D206-N208 VanDerWaalsContact OD1-CB 3.26Å; D206-N208 WeakPolarHBondContact OD1-CB 3.46Å; D206-N208 PolarHBondContact OD1-N 2.66Å; D206-N208 PolarHBondContact OD1-ND2 2.73Å; N208-N234 PolarHBondContact O-ND2 2.98Å; N208-N234 PolarHBondContact O-OD1 3.48Å; N208-R237 WeakPolarHBondContact O-CA 3.43Å; N208-R237 WeakPolarHBondContact O-CB 3.22Å; N208-R237 PolarHBondContact O-NH1 2.92Å
209	T	97.4	Very high	93.5	Very high	4 Å²	4	49.2 Å²	49.2	3%	0.025	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-24.4	177.1	70.9	0	0	0	0	113.4	D206 H211 E236 C238 L245	D206-T209 HydrophobicContact CB-CG2 4.04Å; D206-T209 PolarHBondContact O-N 2.96Å; D206-T209 PolarHBondContact O-OG1 2.84Å; D206-T209 WeakPolarHBondContact OD2-CG2 3.32Å; T209-H211 PolarHBondContact O-N 2.86Å; T209-E236 HydrophobicContact CG2-CB 4.39Å; T209-C238 WeakPolarHBondContact O-CB 3.04Å; T209-C238 PolarHBondContact O-N 2.81Å; T209-L245 HydrophobicContact CG2-CB 4.14Å; T209-L245 HydrophobicContact CG2-CD1 4.17Å; T209-L245 HydrophobicContact CG2-CG 4.32Å; T209-L245 PolarHBondContact OG1-N 2.76Å
210	A	97.1	Very high	93.9	Very high	3 Å²	3	45.8 Å²	45.8	3%	0.025	24%	0.238	C	C	.	.	S	Bend	trans	-60.5	131.4	-172.9	0	0	0	0	0	113.4	D206 R237 V244	D206-A210 PolarHBondContact O-N 3.36Å; A210-R237 VanDerWaalsContact O-CG 3.29Å; A210-R237 WeakPolarHBondContact O-CG 3.27Å; A210-R237 PolarHBondContact O-NH1 3.01Å; A210-V244 HydrophobicContact CB-CB 4.1Å; A210-V244 HydrophobicContact CB-CG2 3.77Å
211	H	96	Very high	94.4	Very high	27 Å²	27	41.8 Å²	41.8	13%	0.125	22%	0.224	C	C	.	.			trans	-59	145.4	170.4	-178	-87.4	0	0	0	112.2	T209 N213 L214 C238 R241 M242 C243	T209-H211 PolarHBondContact O-N 2.86Å; H211-N213 PolarHBondContact ND1-N 2.82Å; H211-N213 PolarHBondContact O-N 2.58Å; H211-L214 HydrophobicContact CB-CD1 3.96Å; H211-L214 HydrophobicContact CB-CG 4.08Å; H211-L214 WeakPolarHBondContact O-CB 3.32Å; H211-L214 PolarHBondContact O-N 3.15Å; H211-C238 WeakPolarHBondContact CA-O 3.47Å; H211-C238 WeakPolarHBondContact CB-O 3.47Å; H211-C238 PolarHBondContact CD2-O 3.06Å; H211-C238 VanDerWaalsContact CD2-O 3.24Å; H211-R241 WeakPolarHBondContact CB-O 3.39Å; H211-R241 PolarHBondContact CD2-O 2.7Å; H211-R241 VanDerWaalsContact CD2-O 3.27Å; H211-M242 WeakPolarHBondContact ND1-CG 3Å; H211-C243 PolarHBondContact N-O 3.38Å; H211-C243 VanDerWaalsContact N-O 3.12Å
212	S	95	Very high	94.7	Very high	22 Å²	22	40.9 Å²	40.9	15%	0.154	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-9.2	-172.4	60.6	0	0	0	0	116.2	K228 L229	S212-K228 CarbonylContact O-C 3.58Å; S212-K228 WeakPolarHBondContact O-CA 3.34Å; S212-L229 PolarHBondContact O-N 3.27Å
213	N	94.1	Very high	94.9	Very high	30 Å²	30	39 Å²	39	16%	0.16	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	24	177.2	-67.1	63.5	0	0	0	111.8	H211 Y225 S226	H211-N213 PolarHBondContact ND1-N 2.82Å; H211-N213 PolarHBondContact O-N 2.58Å; N213-Y225 HydrophobicContact CB-CD2 4.26Å; N213-Y225 HydrophobicContact CB-CE2 3.76Å; N213-Y225 WeakPolarHBondContact O-CD2 3.3Å; N213-S226 VanDerWaalsContact C-OG 3.26Å; N213-S226 PolarHBondContact O-N 2.86Å; N213-S226 PolarHBondContact O-OG 2.75Å
214	L	95.2	Very high	94.8	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	135.8	173.7	-58.1	-179.2	0	0	0	109.5	H211 V223 Q224 S226 L229 M242 C243 V244 V359	H211-L214 HydrophobicContact CB-CD1 3.96Å; H211-L214 HydrophobicContact CB-CG 4.08Å; H211-L214 WeakPolarHBondContact O-CB 3.32Å; H211-L214 PolarHBondContact O-N 3.15Å; L214-V223 HydrophobicContact CB-CG2 4.03Å; L214-V223 HydrophobicContact CD1-CG2 4.09Å; L214-V223 HydrophobicContact CD2-CG2 4.18Å; L214-V223 HydrophobicContact CG-CG2 4.34Å; L214-Q224 WeakPolarHBondContact CA-O 3.14Å; L214-S226 PolarHBondContact N-OG 3.17Å; L214-L229 WeakPolarHBondContact O-CD1 3.46Å; L214-M242 HydrophobicContact CD2-CB 4.27Å; L214-C243 VanDerWaalsContact CD1-C 3.47Å; L214-C243 VanDerWaalsContact CD1-O 3.31Å; L214-C243 WeakPolarHBondContact CD1-O 3.26Å; L214-V244 HydrophobicContact CD1-CB 4.18Å; L214-V244 HydrophobicContact CD1-CG1 4.45Å; L214-V359 HydrophobicContact CD2-CG2 3.29Å
215	K	94.1	Very high	94.6	Very high	109 Å²	109	39.3 Å²	39.3	47%	0.474	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.2	166.7	-174.5	-179.6	-179.6	-175.5	0	109	T217 Q224	K215-T217 HydrophobicContact CD-CG2 4.2Å; K215-T217 HydrophobicContact CG-CG2 4.14Å; K215-Q224 HydrophobicContact CB-CG 4.17Å; K215-Q224 PolarHBondContact N-O 3.06Å; K215-Q224 PolarHBondContact O-N 2.73Å
216	L	95.3	Very high	94.3	Very high	28 Å²	28	39.3 Å²	39.3	15%	0.147	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	141	168.9	-54.4	-174.6	0	0	0	109.5	L205 L220 S222 V223 V244	L205-L216 HydrophobicContact CB-CD1 4.08Å; L205-L216 HydrophobicContact CB-CD2 4.22Å; L205-L216 HydrophobicContact CD1-CD2 3.94Å; L216-L220 HydrophobicContact CB-CD2 3.72Å; L216-L220 HydrophobicContact CD1-CD2 4Å; L216-S222 CarbonylContact C-O 3.5Å; L216-S222 WeakPolarHBondContact CA-O 3.46Å; L216-V223 HydrophobicContact CD2-CB 3.68Å; L216-V223 HydrophobicContact CD2-CG2 3.74Å; L216-V244 HydrophobicContact CD1-CG2 4.47Å; L216-V244 HydrophobicContact CD2-CG1 4.38Å; L216-V244 HydrophobicContact CD2-CG2 4.29Å
217	T	92.5	Very high	94	Very high	36 Å²	36	41.3 Å²	41.3	22%	0.221	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	177.9	178.4	71.3	0	0	0	0	110.7	K215 L220 T221 S222	K215-T217 HydrophobicContact CD-CG2 4.2Å; K215-T217 HydrophobicContact CG-CG2 4.14Å; T217-L220 WeakPolarHBondContact O-CA 3.27Å; T217-L220 PolarHBondContact O-N 3.22Å; T217-T221 PolarHBondContact O-N 3.22Å; T217-S222 PolarHBondContact N-O 2.93Å; T217-S222 PolarHBondContact O-N 3.3Å; T217-S222 VanDerWaalsContact O-N 3.16Å
218	Q	88.1	Confident	93.8	Very high	113 Å²	113	46.6 Å²	46.6	53%	0.528	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	65.2	176.6	-61.5	-179.6	-18	0	0	111.9	L220 T221 T372	Q218-L220 PolarHBondContact O-N 3.02Å; Q218-L220 VanDerWaalsContact O-N 3.13Å; Q218-T221 VanDerWaalsContact O-CB 3.3Å; Q218-T221 WeakPolarHBondContact O-CB 3.32Å; Q218-T221 WeakPolarHBondContact O-CG2 3.31Å; Q218-T221 PolarHBondContact O-N 3.21Å; Q218-T221 PolarHBondContact O-OG1 2.98Å; Q218-T372 VanDerWaalsContact OE1-CG2 3.27Å
219	E	88.7	Confident	93.6	Very high	148 Å²	148	46.3 Å²	46.3	69%	0.692	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	34	-179.6	-62	151.2	-115.9	0	0	113.5	T221	E219-T221 PolarHBondContact O-N 3.44Å
220	L	94.6	Very high	93.3	Very high	69 Å²	69	54 Å²	54	36%	0.361	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	23.7	-174.4	-44.7	174.6	0	0	0	114.1	V204 L205 L216 T217 Q218	V204-L220 HydrophobicContact CG1-CB 3.83Å; V204-L220 HydrophobicContact CG1-CD1 4.48Å; L205-L220 WeakPolarHBondContact CB-O 3.48Å; L205-L220 WeakPolarHBondContact CG-O 3.48Å; L205-L220 PolarHBondContact N-O 2.72Å; L216-L220 HydrophobicContact CB-CD2 3.72Å; L216-L220 HydrophobicContact CD1-CD2 4Å; T217-L220 WeakPolarHBondContact O-CA 3.27Å; T217-L220 PolarHBondContact O-N 3.22Å; Q218-L220 PolarHBondContact O-N 3.02Å; Q218-L220 VanDerWaalsContact O-N 3.13Å
221	T	95.7	Very high	93	Very high	17 Å²	17	56 Å²	56	10%	0.104	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-9.1	177.2	70.7	0	0	0	0	113.3	A201 T217 Q218 E219 V373	A201-T221 HydrophobicContact CB-CG2 3.36Å; T217-T221 PolarHBondContact O-N 3.22Å; Q218-T221 VanDerWaalsContact O-CB 3.3Å; Q218-T221 WeakPolarHBondContact O-CB 3.32Å; Q218-T221 WeakPolarHBondContact O-CG2 3.31Å; Q218-T221 PolarHBondContact O-N 3.21Å; Q218-T221 PolarHBondContact O-OG1 2.98Å; E219-T221 PolarHBondContact O-N 3.44Å; T221-V373 WeakPolarHBondContact O-CG2 3.46Å; T221-V373 PolarHBondContact O-N 2.93Å
222	S	95.4	Very high	92.8	Very high	2 Å²	2	56 Å²	56	1%	0.014	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	140.1	-178.9	-176.5	0	0	0	0	112	L216 T217 P370 L371 T372	L216-S222 CarbonylContact C-O 3.5Å; L216-S222 WeakPolarHBondContact CA-O 3.46Å; T217-S222 PolarHBondContact N-O 2.93Å; T217-S222 PolarHBondContact O-N 3.3Å; T217-S222 VanDerWaalsContact O-N 3.16Å; S222-P370 WeakPolarHBondContact OG-CB 3.4Å; S222-L371 WeakPolarHBondContact CA-O 3.29Å; S222-T372 WeakPolarHBondContact CB-OG1 3.48Å; S222-T372 PolarHBondContact OG-OG1 3.41Å
223	V	95.7	Very high	92.5	Very high	1 Å²	1	59 Å²	59	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	133	178.4	56.6	0	0	0	0	111.7	L205 L214 L216 V244 F357 P370 L371	L205-V223 HydrophobicContact CD1-CB 3.79Å; L205-V223 HydrophobicContact CD1-CG1 3.88Å; L214-V223 HydrophobicContact CB-CG2 4.03Å; L214-V223 HydrophobicContact CD1-CG2 4.09Å; L214-V223 HydrophobicContact CD2-CG2 4.18Å; L214-V223 HydrophobicContact CG-CG2 4.34Å; L216-V223 HydrophobicContact CD2-CB 3.68Å; L216-V223 HydrophobicContact CD2-CG2 3.74Å; V223-V244 HydrophobicContact CB-CG1 4.17Å; V223-V244 HydrophobicContact CG1-CG1 4.07Å; V223-V244 HydrophobicContact CG2-CG1 3.98Å; V223-F357 HydrophobicContact CG1-CB 4.17Å; V223-P370 CarbonylContact O-C 3.58Å; V223-P370 VanDerWaalsContact O-CA 3.27Å; V223-P370 WeakPolarHBondContact O-CA 3.32Å; V223-L371 HydrophobicContact CG1-CB 4.09Å; V223-L371 PolarHBondContact N-O 3.25Å; V223-L371 PolarHBondContact O-N 3.18Å
224	Q	93.5	Very high	92.5	Very high	43 Å²	43	58.9 Å²	58.9	20%	0.201	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	161.8	174.4	62.8	176	108.6	0	0	111.6	L214 K215 P370	L214-Q224 WeakPolarHBondContact CA-O 3.14Å; K215-Q224 HydrophobicContact CB-CG 4.17Å; K215-Q224 PolarHBondContact N-O 3.06Å; K215-Q224 PolarHBondContact O-N 2.73Å; Q224-P370 HydrophobicContact CB-CB 4.19Å
225	Y	92.3	Very high	92.3	Very high	36 Å²	36	63.5 Å²	63.5	14%	0.141	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	147.9	170.8	-178.3	-107.4	0	0	0	110.6	N213 M242 L361 C362 W365 S368	N213-Y225 HydrophobicContact CB-CD2 4.26Å; N213-Y225 HydrophobicContact CB-CE2 3.76Å; N213-Y225 WeakPolarHBondContact O-CD2 3.3Å; Y225-M242 HydrophobicContact CD2-SD 4.04Å; Y225-M242 HydrophobicContact CE2-SD 3.66Å; Y225-L361 HydrophobicContact CE2-CD2 4.33Å; Y225-C362 HydrophobicContact CD1-CB 3.87Å; Y225-C362 HydrophobicContact CE1-CB 4.49Å; Y225-C362 WeakPolarHBondContact CE1-O 3.12Å; Y225-C362 HydrophobicContact CG-CB 4.46Å; Y225-W365 HydrophobicContact CD1-CB 3.58Å; Y225-W365 HydrophobicContact CE1-CB 3.8Å; Y225-S368 PolarHBondContact O-OG 3.25Å
226	S	91.6	Very high	92.4	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.014	32%	0.318	C	S	.	.			trans	-144.9	171.3	-177.5	70.2	0	0	0	0	112.6	N213 L214	N213-S226 VanDerWaalsContact C-OG 3.26Å; N213-S226 PolarHBondContact O-N 2.86Å; N213-S226 PolarHBondContact O-OG 2.75Å; L214-S226 PolarHBondContact N-OG 3.17Å
227	N	90.8	Very high	92.4	Very high	82 Å²	82	61.1 Å²	61.1	44%	0.439	31%	0.312	S	S	.	.	S	Bend	trans	-54.7	157	155.8	65.2	-45.1	0	0	0	110.6	L229	N227-L229 PolarHBondContact O-N 2.93Å; N227-L229 VanDerWaalsContact O-N 3.15Å
228	K	91.4	Very high	92.5	Very high	143 Å²	143	59.5 Å²	59.5	62%	0.622	30%	0.302	S	S	*	.			trans	-66.1	115.6	178.5	-174.7	176	179.7	-177.6	0	110.6	S212	S212-K228 CarbonylContact O-C 3.58Å; S212-K228 WeakPolarHBondContact O-CA 3.34Å
229	L	91.5	Very high	92.7	Very high	53 Å²	53	57.1 Å²	57.1	28%	0.277	30%	0.295	S	S	.	.			trans	-76.4	146.2	172.5	-56.1	-177.4	0	0	0	110.5	S212 L214 N227 L231	S212-L229 PolarHBondContact O-N 3.27Å; L214-L229 WeakPolarHBondContact O-CD1 3.46Å; N227-L229 PolarHBondContact O-N 2.93Å; N227-L229 VanDerWaalsContact O-N 3.15Å; L229-L231 VanDerWaalsContact C-N 3.26Å; L229-L231 HydrophobicContact CB-CD1 4.33Å; L229-L231 HydrophobicContact CB-CD2 4.11Å; L229-L231 HydrophobicContact CB-CG 3.85Å; L229-L231 PolarHBondContact O-N 3.12Å
230	L	90.6	Very high	92.7	Very high	167 Å²	167	51.6 Å²	51.6	87%	0.874	27%	0.273	S	S	*	.			trans	-83.8	68.9	176.7	-62.3	179.5	0	0	0	110.4
231	L	90.9	Very high	92.4	Very high	44 Å²	44	51.6 Å²	51.6	23%	0.23	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-94	139.5	177	-51.9	-179	0	0	0	110.4	Y74 L229	Y74-L231 HydrophobicContact CE2-CD2 4Å; L229-L231 VanDerWaalsContact C-N 3.26Å; L229-L231 HydrophobicContact CB-CD1 4.33Å; L229-L231 HydrophobicContact CB-CD2 4.11Å; L229-L231 HydrophobicContact CB-CG 3.85Å; L229-L231 PolarHBondContact O-N 3.12Å
232	P	91.5	Very high	92.2	Very high	26 Å²	26	52.9 Å²	52.9	17%	0.169	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-67.2	151.2	171.7	28.3	-34.3	0	0	0	111.6	I71 Y74 R237	I71-P232 HydrophobicContact CG1-CB 3.59Å; I71-P232 HydrophobicContact CG1-CG 4.33Å; Y74-P232 HydrophobicContact CD1-CG 3.43Å; Y74-P232 VanDerWaalsContact CD1-CG 3.43Å; Y74-P232 HydrophobicContact CD2-CG 4.34Å; Y74-P232 HydrophobicContact CE1-CG 3.95Å; Y74-P232 VanDerWaalsContact CG-CD 3.48Å; Y74-P232 HydrophobicContact CG-CG 3.65Å; P232-R237 PolarHBondContact O-NE 3.16Å; P232-R237 PolarHBondContact O-NH2 3.29Å
233	D	89.8	Confident	92.2	Very high	87 Å²	87	53 Å²	53	47%	0.465	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-76.5	134.1	171.8	-170.3	47.2	0	0	0	110.7	K279	D233-K279 IonicContact OD1-NZ 2.74Å; D233-K279 PolarHBondContact OD1-NZ 3.46Å; D233-K279 IonicContact OD2-NZ 2.7Å; D233-K279 PolarHBondContact OD2-NZ 2.9Å
234	N	92.5	Very high	92.3	Very high	26 Å²	26	52.9 Å²	52.9	14%	0.139	27%	0.274	C	S	.	.			trans	-137.2	165.1	175	67.5	26.3	0	0	0	108.5	N208 E236 R237 K279	N208-N234 PolarHBondContact O-ND2 2.98Å; N208-N234 PolarHBondContact O-OD1 3.48Å; N234-E236 VanDerWaalsContact CB-OE2 3.32Å; N234-E236 WeakPolarHBondContact CB-OE2 3.29Å; N234-E236 PolarHBondContact O-N 2.93Å; N234-E236 PolarHBondContact OD1-N 2.9Å; N234-E236 PolarHBondContact OD1-OE2 3.49Å; N234-R237 WeakPolarHBondContact OD1-CB 3.48Å; N234-R237 PolarHBondContact OD1-N 3.42Å; N234-K279 WeakPolarHBondContact O-CE 3.28Å; N234-K279 PolarHBondContact O-NZ 2.92Å
235	P	92.8	Very high	92.6	Very high	101 Å²	101	51 Å²	51	66%	0.656	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.1	178.2	-23.6	33.7	0	0	0	114.3
236	E	94.9	Very high	92.8	Very high	81 Å²	81	49.3 Å²	49.3	38%	0.379	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-20.8	-170.8	-58.4	67.4	-139.4	0	0	113.5	T209 N234 R278	T209-E236 HydrophobicContact CG2-CB 4.39Å; N234-E236 VanDerWaalsContact CB-OE2 3.32Å; N234-E236 WeakPolarHBondContact CB-OE2 3.29Å; N234-E236 PolarHBondContact O-N 2.93Å; N234-E236 PolarHBondContact OD1-N 2.9Å; N234-E236 PolarHBondContact OD1-OE2 3.49Å; E236-R278 WeakPolarHBondContact O-CD 3.32Å; E236-R278 PolarHBondContact O-NH1 3Å
237	R	95.4	Very high	93.1	Very high	7 Å²	7	51.9 Å²	51.9	3%	0.026	28%	0.281	C	S	.	.			trans	-72.7	128.4	-171.3	-164.5	172.6	-57.3	-63.6	-1.7	112.6	S207 N208 A210 P232 N234 T239	S207-R237 PolarHBondContact O-NH1 3.42Å; N208-R237 WeakPolarHBondContact O-CA 3.43Å; N208-R237 WeakPolarHBondContact O-CB 3.22Å; N208-R237 PolarHBondContact O-NH1 2.92Å; A210-R237 VanDerWaalsContact O-CG 3.29Å; A210-R237 WeakPolarHBondContact O-CG 3.27Å; A210-R237 PolarHBondContact O-NH1 3.01Å; P232-R237 PolarHBondContact O-NE 3.16Å; P232-R237 PolarHBondContact O-NH2 3.29Å; N234-R237 WeakPolarHBondContact OD1-CB 3.48Å; N234-R237 PolarHBondContact OD1-N 3.42Å; R237-T239 HydrophobicContact CG-CG2 4.33Å; R237-T239 PolarHBondContact O-N 3.37Å
238	C	94.9	Very high	93.4	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.014	29%	0.287	C	S	.	.			trans	-69.7	114.9	167.9	-64.7	0	0	0	0	109.7	T209 H211 C243	T209-C238 WeakPolarHBondContact O-CB 3.04Å; T209-C238 PolarHBondContact O-N 2.81Å; H211-C238 WeakPolarHBondContact CA-O 3.47Å; H211-C238 WeakPolarHBondContact CB-O 3.47Å; H211-C238 PolarHBondContact CD2-O 3.06Å; H211-C238 VanDerWaalsContact CD2-O 3.24Å; C238-C243 VanDerWaalsContact SG-SG 3.61Å
239	T	92.9	Very high	93.6	Very high	62 Å²	62	46.6 Å²	46.6	38%	0.38	27%	0.267	S	S	.	.			trans	-119.7	-12.9	175.9	64.3	0	0	0	0	112.9	R237 R278 K279	R237-T239 HydrophobicContact CG-CG2 4.33Å; R237-T239 PolarHBondContact O-N 3.37Å; T239-R278 PolarHBondContact N-O 2.86Å; T239-K279 WeakPolarHBondContact OG1-CA 3.09Å
240	S	87.8	Confident	93.9	Very high	32 Å²	32	45.3 Å²	45.3	22%	0.224	26%	0.26	C	S	.	.	S	Bend	trans	-87.3	-17.7	176	62.2	0	0	0	0	114.7	R278 S280	S240-R278 PolarHBondContact N-O 3.39Å; S240-R278 PolarHBondContact OG-O 3.32Å; S240-S280 WeakPolarHBondContact CB-O 3.32Å; S240-S280 PolarHBondContact OG-O 3.11Å
241	R	88.3	Confident	94.2	Very high	70 Å²	70	42.3 Å²	42.3	26%	0.264	25%	0.248	S	C	.	.	S	Bend	trans	-145.9	151.6	179.7	-67.2	-173	171.4	-75	-7	110.6	H211 C243 T282	H211-R241 WeakPolarHBondContact CB-O 3.39Å; H211-R241 PolarHBondContact CD2-O 2.7Å; H211-R241 VanDerWaalsContact CD2-O 3.27Å; R241-C243 PolarHBondContact O-N 3.27Å; R241-T282 PolarHBondContact NE-O 2.88Å; R241-T282 PolarHBondContact NH2-O 3.47Å
242	M	92.1	Very high	94.4	Very high	43 Å²	43	43.6 Å²	43.6	21%	0.212	26%	0.261	C	S	.	.	S	Bend	trans	-76.9	72.4	172.3	-80.4	156.4	-73.8	0	0	110.4	H211 L214 Y225 S358 V359 L361	H211-M242 WeakPolarHBondContact ND1-CG 3Å; L214-M242 HydrophobicContact CD2-CB 4.27Å; Y225-M242 HydrophobicContact CD2-SD 4.04Å; Y225-M242 HydrophobicContact CE2-SD 3.66Å; M242-S358 VanDerWaalsContact O-CA 3.29Å; M242-S358 WeakPolarHBondContact O-CA 3.3Å; M242-S358 WeakPolarHBondContact O-CB 3.33Å; M242-S358 PolarHBondContact O-OG 3.38Å; M242-V359 PolarHBondContact O-N 2.84Å; M242-L361 HydrophobicContact CE-CD1 4.48Å; M242-L361 HydrophobicContact CE-CD2 3.7Å; M242-L361 HydrophobicContact CE-CG 3.81Å; M242-L361 HydrophobicContact SD-CD2 3.74Å; M242-L361 HydrophobicContact SD-CG 4.32Å
243	C	95.4	Very high	94.7	Very high	4 Å²	4	43.4 Å²	43.4	3%	0.027	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	166.2	179.6	59	0	0	0	0	113.4	H211 L214 C238 R241 Y356 F357	H211-C243 PolarHBondContact N-O 3.38Å; H211-C243 VanDerWaalsContact N-O 3.12Å; L214-C243 VanDerWaalsContact CD1-C 3.47Å; L214-C243 VanDerWaalsContact CD1-O 3.31Å; L214-C243 WeakPolarHBondContact CD1-O 3.26Å; C238-C243 VanDerWaalsContact SG-SG 3.61Å; R241-C243 PolarHBondContact O-N 3.27Å; C243-Y356 HydrophobicContact CB-CE1 4.32Å; C243-Y356 HydrophobicContact CB-CE2 3.68Å; C243-Y356 VanDerWaalsContact CB-OH 3.32Å; C243-Y356 WeakPolarHBondContact CB-OH 3.32Å; C243-F357 CarbonylContact C-O 3.23Å; C243-F357 WeakPolarHBondContact CA-O 3.43Å; C243-F357 WeakPolarHBondContact CB-O 3.22Å
244	V	98	Very high	95	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	149.4	177.1	61.7	0	0	0	0	108.3	L205 D206 A210 L214 L216 V223 F357	L205-V244 HydrophobicContact CB-CG2 4.09Å; L205-V244 HydrophobicContact CD1-CG1 4.21Å; L205-V244 HydrophobicContact CD2-CG1 4.29Å; D206-V244 WeakPolarHBondContact O-CG2 3.46Å; A210-V244 HydrophobicContact CB-CB 4.1Å; A210-V244 HydrophobicContact CB-CG2 3.77Å; L214-V244 HydrophobicContact CD1-CB 4.18Å; L214-V244 HydrophobicContact CD1-CG1 4.45Å; L216-V244 HydrophobicContact CD1-CG2 4.47Å; L216-V244 HydrophobicContact CD2-CG1 4.38Å; L216-V244 HydrophobicContact CD2-CG2 4.29Å; V223-V244 HydrophobicContact CB-CG1 4.17Å; V223-V244 HydrophobicContact CG1-CG1 4.07Å; V223-V244 HydrophobicContact CG2-CG1 3.98Å; V244-F357 HydrophobicContact CG1-CB 4Å; V244-F357 PolarHBondContact N-O 2.85Å; V244-F357 PolarHBondContact O-N 3.48Å
245	L	98.3	Very high	95.2	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	158.1	175.3	-56.9	-178.8	0	0	0	110.9	D206 T209 A272 I276 F354 P355 Y356	D206-L245 PolarHBondContact N-O 3.22Å; T209-L245 HydrophobicContact CG2-CB 4.14Å; T209-L245 HydrophobicContact CG2-CD1 4.17Å; T209-L245 HydrophobicContact CG2-CG 4.32Å; T209-L245 PolarHBondContact OG1-N 2.76Å; L245-A272 HydrophobicContact CD2-CB 4.21Å; L245-I276 HydrophobicContact CD1-CD1 4.49Å; L245-I276 HydrophobicContact CD2-CD1 4.34Å; L245-F354 HydrophobicContact CB-CB 4.19Å; L245-F354 HydrophobicContact CD1-CB 4.37Å; L245-F354 HydrophobicContact CD1-CG 4.49Å; L245-F354 HydrophobicContact CD2-CB 4.46Å; L245-P355 CarbonylContact C-O 3.58Å; L245-P355 VanDerWaalsContact CA-O 3.29Å; L245-P355 WeakPolarHBondContact CA-O 3.3Å; L245-Y356 HydrophobicContact CD2-CD2 3.76Å
246	G	98.1	Very high	95.4	Very high	2 Å²	2	45.1 Å²	45.1	2%	0.021	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-64.9	147.8	162.9	0	0	0	0	0	111.3	V204 T248 F354 P355	V204-G246 CarbonylContact O-C 3.53Å; V204-G246 VanDerWaalsContact O-CA 3.27Å; V204-G246 WeakPolarHBondContact O-CA 3.3Å; G246-T248 VanDerWaalsContact C-N 3.33Å; G246-F354 WeakPolarHBondContact O-CD1 3.41Å; G246-P355 PolarHBondContact N-O 3.08Å
247	A	97.1	Very high	95.5	Very high	56 Å²	56	41.4 Å²	41.4	46%	0.463	25%	0.246	S	C	.	.	S	Bend	trans	-72.1	-27.1	178	0	0	0	0	0	112.9	V204 D206	V204-A247 PolarHBondContact O-N 3.04Å; D206-A247 HydrophobicContact CB-CB 4.13Å
248	T	96.7	Very high	95.6	Very high	92 Å²	92	42.2 Å²	42.2	56%	0.564	25%	0.252	S	S	*	.	S	Bend	trans	-99.5	129	173.1	-56.3	0	0	0	0	109.9	G246 F250 P355	G246-T248 VanDerWaalsContact C-N 3.33Å; T248-F250 HydrophobicContact CG2-CD1 4.31Å; T248-F250 HydrophobicContact CG2-CE1 3.79Å; T248-F250 HydrophobicContact CG2-CZ 4.3Å; T248-P355 VanDerWaalsContact O-CD 3.29Å; T248-P355 WeakPolarHBondContact O-CD 3.42Å
249	G	96.7	Very high	95.7	Very high	21 Å²	21	42.1 Å²	42.1	22%	0.216	25%	0.251	C	S	.	.			trans	-115.2	151.1	171.4	0	0	0	0	0	111.7	L353 F354	G249-L353 CarbonylContact C-O 3.6Å; G249-L353 VanDerWaalsContact CA-O 3.26Å; G249-L353 WeakPolarHBondContact CA-O 3.42Å; G249-F354 VanDerWaalsContact CA-CD1 3.44Å
250	F	97.4	Very high	95.8	Very high	27 Å²	27	43.2 Å²	43.2	12%	0.118	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-115.5	140.6	-167.6	-49.3	-69.5	0	0	0	112	T248 H255 W257 L324 K352 L353 P355	T248-F250 HydrophobicContact CG2-CD1 4.31Å; T248-F250 HydrophobicContact CG2-CE1 3.79Å; T248-F250 HydrophobicContact CG2-CZ 4.3Å; F250-H255 HydrophobicContact CD1-CB 4.38Å; F250-H255 AromaticContact CD1-CD2 3.54Å; F250-H255 AromaticContact CD1-CE1 3.44Å; F250-H255 VanDerWaalsContact CD1-CE1 3.44Å; F250-H255 WeakPolarHBondContact CD1-CE1 3.38Å; F250-H255 AromaticContact CD1-CG 3.49Å; F250-H255 VanDerWaalsContact CD1-CG 3.49Å; F250-H255 AromaticContact CD1-ND1 3.45Å; F250-H255 WeakPolarHBondContact CD1-ND1 3.49Å; F250-H255 AromaticContact CD1-NE2 3.5Å; F250-H255 HydrophobicContact CD2-CB 4.21Å; F250-H255 HydrophobicContact CE1-CB 4.24Å; F250-H255 AromaticContact CE1-CE1 3.85Å; F250-H255 AromaticContact CE1-CG 3.65Å; F250-H255 AromaticContact CE1-ND1 3.44Å; F250-H255 WeakPolarHBondContact CE1-ND1 3.4Å; F250-H255 HydrophobicContact CE2-CB 4.05Å; F250-H255 HydrophobicContact CG-CB 4.36Å; F250-H255 AromaticContact CG-CD2 3.46Å; F250-H255 VanDerWaalsContact CG-CD2 3.46Å; F250-H255 WeakPolarHBondContact CG-CD2 3.36Å; F250-H255 AromaticContact CG-CG 3.68Å; F250-H255 AromaticContact CG-NE2 3.77Å; F250-H255 HydrophobicContact CZ-CB 4.07Å; F250-H255 AromaticContact CZ-CG 3.99Å; F250-W257 HydrophobicContact CE2-CZ3 4.22Å; F250-L324 HydrophobicContact CB-CD2 3.98Å; F250-L324 HydrophobicContact CD2-CD2 3.76Å; F250-L324 HydrophobicContact CG-CD2 4.24Å; F250-K352 WeakPolarHBondContact O-CA 3.5Å; F250-L353 PolarHBondContact N-O 2.95Å; F250-L353 PolarHBondContact O-N 3.46Å; F250-P355 HydrophobicContact CE2-CG 3.8Å
251	T	96.8	Very high	96	Very high	103 Å²	103	41.8 Å²	41.8	63%	0.632	24%	0.242	S	C	*	.	S	Bend	trans	-118.5	-19.3	176.8	50.3	0	0	0	0	113.6	K352	T251-K352 HydrophobicContact CG2-CB 3.9Å; T251-K352 HydrophobicContact CG2-CG 4.02Å
252	S	96	Very high	95.6	Very high	71 Å²	71	40.5 Å²	40.5	50%	0.497	25%	0.251	S	S	.	.	S	Bend	trans	-155.1	168.5	-177.5	59.6	0	0	0	0	111	H255	S252-H255 PolarHBondContact O-NE2 2.89Å
253	G	96	Very high	94.9	Very high	22 Å²	22	45.7 Å²	45.7	23%	0.227	27%	0.274	C	S	.	.	S	Bend	trans	80.1	-161.2	178.7	0	0	0	0	0	114.2	C326 D327	G253-C326 WeakPolarHBondContact O-CB 3.44Å; G253-C326 PolarHBondContact O-N 3.28Å; G253-D327 VanDerWaalsContact CA-OD2 3.26Å; G253-D327 WeakPolarHBondContact CA-OD2 3.44Å; G253-D327 PolarHBondContact N-OD1 3Å; G253-D327 PolarHBondContact N-OD2 3.38Å
254	K	96.9	Very high	94.3	Very high	139 Å²	139	46 Å²	46	60%	0.604	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128	130.7	-179.2	-66.5	172.9	-171.5	158.3	0	110.8	L324 D325	K254-L324 CarbonylContact C-O 3.44Å; K254-L324 VanDerWaalsContact CA-O 3.27Å; K254-L324 WeakPolarHBondContact CA-O 3.47Å; K254-D325 WeakPolarHBondContact CE-OD1 3.48Å; K254-D325 WeakPolarHBondContact CE-OD2 3.38Å; K254-D325 HydrophobicContact CG-CB 4.23Å
255	H	97.1	Very high	93.5	Very high	55 Å²	55	52.8 Å²	52.8	26%	0.255	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	141.9	-173.9	-53.7	-72.9	0	0	0	109.3	F250 S252 W257 L324	F250-H255 HydrophobicContact CD1-CB 4.38Å; F250-H255 AromaticContact CD1-CD2 3.54Å; F250-H255 AromaticContact CD1-CE1 3.44Å; F250-H255 VanDerWaalsContact CD1-CE1 3.44Å; F250-H255 WeakPolarHBondContact CD1-CE1 3.38Å; F250-H255 AromaticContact CD1-CG 3.49Å; F250-H255 VanDerWaalsContact CD1-CG 3.49Å; F250-H255 AromaticContact CD1-ND1 3.45Å; F250-H255 WeakPolarHBondContact CD1-ND1 3.49Å; F250-H255 AromaticContact CD1-NE2 3.5Å; F250-H255 HydrophobicContact CD2-CB 4.21Å; F250-H255 HydrophobicContact CE1-CB 4.24Å; F250-H255 AromaticContact CE1-CE1 3.85Å; F250-H255 AromaticContact CE1-CG 3.65Å; F250-H255 AromaticContact CE1-ND1 3.44Å; F250-H255 WeakPolarHBondContact CE1-ND1 3.4Å; F250-H255 HydrophobicContact CE2-CB 4.05Å; F250-H255 HydrophobicContact CG-CB 4.36Å; F250-H255 AromaticContact CG-CD2 3.46Å; F250-H255 VanDerWaalsContact CG-CD2 3.46Å; F250-H255 WeakPolarHBondContact CG-CD2 3.36Å; F250-H255 AromaticContact CG-CG 3.68Å; F250-H255 AromaticContact CG-NE2 3.77Å; F250-H255 HydrophobicContact CZ-CB 4.07Å; F250-H255 AromaticContact CZ-CG 3.99Å; S252-H255 PolarHBondContact O-NE2 2.89Å; H255-W257 HydrophobicContact CB-CZ3 4.27Å; H255-L324 HydrophobicContact CB-CB 4.44Å; H255-L324 PolarHBondContact N-O 3.16Å; H255-L324 PolarHBondContact O-N 2.91Å
256	S	96.5	Very high	93.1	Very high	57 Å²	57	55.2 Å²	55.2	40%	0.399	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	131.5	-175.8	-174.1	0	0	0	0	110.9	V322	S256-V322 WeakPolarHBondContact CA-O 3.46Å
257	W	97.3	Very high	92.8	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.008	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	150.9	172.9	60.3	101.9	0	0	0	110.2	S202 V203 F250 H255 V271 T321 V322 L324 P355 F357 V373	S202-W257 WeakPolarHBondContact OG-CA 3.19Å; S202-W257 VanDerWaalsContact OG-CB 3.24Å; S202-W257 WeakPolarHBondContact OG-CB 3.48Å; V203-W257 HydrophobicContact CG2-CB 3.81Å; V203-W257 HydrophobicContact CG2-CD2 3.73Å; V203-W257 HydrophobicContact CG2-CE3 4.05Å; V203-W257 HydrophobicContact CG2-CG 3.62Å; F250-W257 HydrophobicContact CE2-CZ3 4.22Å; H255-W257 HydrophobicContact CB-CZ3 4.27Å; W257-V271 HydrophobicContact CH2-CG1 3.51Å; W257-V271 HydrophobicContact CZ2-CG1 3.88Å; W257-T321 CarbonylContact O-C 3.09Å; W257-T321 WeakPolarHBondContact O-CA 3.43Å; W257-V322 HydrophobicContact CD2-CB 4.17Å; W257-V322 HydrophobicContact CH2-CB 4.33Å; W257-V322 HydrophobicContact CH2-CG1 3.91Å; W257-V322 HydrophobicContact CZ2-CB 3.77Å; W257-V322 HydrophobicContact CZ2-CG1 3.58Å; W257-V322 HydrophobicContact CZ2-CG2 4.35Å; W257-V322 PolarHBondContact N-O 3.37Å; W257-V322 VanDerWaalsContact N-O 3.09Å; W257-V322 PolarHBondContact O-N 2.89Å; W257-L324 HydrophobicContact CH2-CB 4.3Å; W257-L324 HydrophobicContact CZ3-CB 4.2Å; W257-P355 HydrophobicContact CH2-CB 4.35Å; W257-P355 HydrophobicContact CH2-CG 4.1Å; W257-P355 HydrophobicContact CZ2-CB 3.82Å; W257-P355 HydrophobicContact CZ2-CG 4.05Å; W257-P355 HydrophobicContact CZ3-CG 4.41Å; W257-F357 AromaticContact NE1-CZ 3.84Å; W257-V373 HydrophobicContact CB-CG1 4.44Å
258	T	97.3	Very high	92.7	Very high	24 Å²	24	53.4 Å²	53.4	15%	0.147	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	139.8	175.3	-51.2	0	0	0	0	108.8	R319 L320 T321 A336 V373 C374	T258-R319 HydrophobicContact CG2-CB 4.03Å; T258-L320 CarbonylContact C-O 3.59Å; T258-L320 WeakPolarHBondContact CA-O 3.2Å; T258-T321 WeakPolarHBondContact CG2-OG1 3.44Å; T258-T321 PolarHBondContact OG1-OG1 3.07Å; T258-A336 HydrophobicContact CG2-CB 3.66Å; T258-V373 CarbonylContact O-C 3.54Å; T258-V373 WeakPolarHBondContact O-CA 3.31Å; T258-C374 HydrophobicContact CG2-CB 4.42Å; T258-C374 VanDerWaalsContact CG2-SG 3.6Å; T258-C374 PolarHBondContact O-N 3.05Å
259	V	96.8	Very high	92.8	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	133.6	-178.3	-165.7	0	0	0	0	109	V261 V269 R319 L320 F357 L371 T372	V259-V261 HydrophobicContact CB-CG1 4.1Å; V259-V261 HydrophobicContact CG1-CG1 3.99Å; V259-V269 HydrophobicContact CG1-CG1 4.36Å; V259-R319 CarbonylContact O-C 3.36Å; V259-R319 VanDerWaalsContact O-CA 3.25Å; V259-R319 WeakPolarHBondContact O-CA 3.47Å; V259-L320 PolarHBondContact N-O 2.92Å; V259-L320 PolarHBondContact O-N 3.22Å; V259-F357 HydrophobicContact CB-CE1 4.49Å; V259-F357 HydrophobicContact CG1-CD1 4.27Å; V259-F357 HydrophobicContact CG1-CE1 3.97Å; V259-F357 HydrophobicContact CG2-CD1 4.49Å; V259-F357 HydrophobicContact CG2-CE1 3.63Å; V259-F357 HydrophobicContact CG2-CZ 4.36Å; V259-L371 HydrophobicContact CG1-CB 4.12Å; V259-T372 CarbonylContact C-O 3.57Å; V259-T372 WeakPolarHBondContact CA-O 3.33Å
260	E	95.9	Very high	92.8	Very high	86 Å²	86	48 Å²	48	40%	0.402	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	121.3	171	-51	-170.8	156.5	0	0	108.5	R319 T372 C374	E260-R319 HydrophobicContact CB-CG 4.48Å; E260-R319 HydrophobicContact CG-CG 4.11Å; E260-T372 PolarHBondContact N-O 3.07Å; E260-T372 PolarHBondContact O-N 3Å; E260-C374 WeakPolarHBondContact CG-SG 3.28Å
261	V	91.7	Very high	92.9	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.006	26%	0.257	C	S	.	.			trans	-132.4	-19.2	-170.7	-55	0	0	0	0	113.6	V259 H263 S264 W267 P317 E318 L320 L371	V259-V261 HydrophobicContact CB-CG1 4.1Å; V259-V261 HydrophobicContact CG1-CG1 3.99Å; V261-H263 PolarHBondContact O-N 3.38Å; V261-S264 WeakPolarHBondContact O-CB 3.4Å; V261-S264 PolarHBondContact O-N 3.11Å; V261-W267 HydrophobicContact CB-CD2 4.11Å; V261-W267 HydrophobicContact CB-CH2 4.31Å; V261-W267 HydrophobicContact CB-CZ2 3.83Å; V261-W267 HydrophobicContact CG1-CD2 4.29Å; V261-W267 HydrophobicContact CG1-CE3 4.28Å; V261-W267 HydrophobicContact CG1-CH2 4.39Å; V261-W267 HydrophobicContact CG1-CZ2 4.38Å; V261-W267 HydrophobicContact CG1-CZ3 4.35Å; V261-W267 HydrophobicContact CG2-CH2 4.01Å; V261-W267 HydrophobicContact CG2-CZ2 3.58Å; V261-P317 WeakPolarHBondContact CG2-O 3.48Å; V261-E318 PolarHBondContact N-O 2.89Å; V261-L320 HydrophobicContact CG1-CB 4.43Å; V261-L320 HydrophobicContact CG2-CB 4.38Å; V261-L371 HydrophobicContact CB-CD2 4.27Å; V261-L371 HydrophobicContact CG1-CD2 3.98Å
262	G	78.7	Confident	92.9	Very high	44 Å²	44	41.9 Å²	41.9	45%	0.454	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-18.5	-167.6	0	0	0	0	0	117.1	E318	G262-E318 PolarHBondContact N-O 3.14Å
263	H	78.4	Confident	93	Very high	152 Å²	152	41.1 Å²	41.1	70%	0.704	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	-20.4	175	-56.6	-47.5	0	0	0	112.7	V261 S369	V261-H263 PolarHBondContact O-N 3.38Å; H263-S369 PolarHBondContact O-OG 3.29Å
264	S	81.9	Confident	93	Very high	10 Å²	10	43.5 Å²	43.5	7%	0.07	22%	0.219	C	C	.	.			trans	-91	130.2	-172.7	-67.4	0	0	0	0	111.8	V261 W267 S369 P370	V261-S264 WeakPolarHBondContact O-CB 3.4Å; V261-S264 PolarHBondContact O-N 3.11Å; S264-W267 PolarHBondContact O-NE1 3.02Å; S264-S369 VanDerWaalsContact OG-CB 3.27Å; S264-S369 WeakPolarHBondContact OG-CB 3.39Å; S264-S369 PolarHBondContact OG-O 3.19Å; S264-P370 PolarHBondContact OG-O 2.87Å; S264-P370 VanDerWaalsContact OG-O 3.13Å
265	K	82.1	Confident	92.9	Very high	142 Å²	142	40 Å²	40	62%	0.617	21%	0.212	S	C	*	.	S	Bend	trans	-94.2	-14.5	-171.6	-62.2	161.8	-170	156.4	0	114.6
266	D	88.7	Confident	92.8	Very high	54 Å²	54	37.8 Å²	37.8	29%	0.289	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	119	176.7	-178.4	42.8	0	0	0	106.8	Q295 C296 G360	D266-Q295 WeakPolarHBondContact CA-O 3.42Å; D266-C296 PolarHBondContact OD1-SG 3.09Å; D266-C296 VanDerWaalsContact OD1-SG 3.37Å; D266-G360 WeakPolarHBondContact O-CA 3.25Å; D266-G360 PolarHBondContact O-N 2.94Å; D266-G360 WeakPolarHBondContact OD2-CA 3.14Å
267	W	93	Very high	92.7	Very high	1 Å²	1	39.7 Å²	39.7	0%	0.004	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	152.9	-174.5	55.2	-94.4	0	0	0	111.2	V261 S264 V269 G294 Q295 L301 L320 S358 L371	V261-W267 HydrophobicContact CB-CD2 4.11Å; V261-W267 HydrophobicContact CB-CH2 4.31Å; V261-W267 HydrophobicContact CB-CZ2 3.83Å; V261-W267 HydrophobicContact CG1-CD2 4.29Å; V261-W267 HydrophobicContact CG1-CE3 4.28Å; V261-W267 HydrophobicContact CG1-CH2 4.39Å; V261-W267 HydrophobicContact CG1-CZ2 4.38Å; V261-W267 HydrophobicContact CG1-CZ3 4.35Å; V261-W267 HydrophobicContact CG2-CH2 4.01Å; V261-W267 HydrophobicContact CG2-CZ2 3.58Å; S264-W267 PolarHBondContact O-NE1 3.02Å; W267-V269 HydrophobicContact CE3-CG1 4.33Å; W267-V269 HydrophobicContact CE3-CG2 4.3Å; W267-V269 HydrophobicContact CZ3-CG2 3.97Å; W267-G294 CarbonylContact O-C 3.5Å; W267-G294 WeakPolarHBondContact O-CA 3.37Å; W267-Q295 HydrophobicContact CD2-CB 4.23Å; W267-Q295 HydrophobicContact CG-CB 4.42Å; W267-Q295 HydrophobicContact CZ2-CB 3.94Å; W267-Q295 PolarHBondContact N-O 3.12Å; W267-Q295 PolarHBondContact O-N 3.33Å; W267-L301 HydrophobicContact CH2-CD1 3.81Å; W267-L301 HydrophobicContact CZ2-CD1 3.98Å; W267-L320 HydrophobicContact CH2-CD2 4.01Å; W267-L320 HydrophobicContact CZ3-CD2 3.92Å; W267-S358 CarbonylContact C-O 3.59Å; W267-S358 VanDerWaalsContact CA-O 3.28Å; W267-S358 WeakPolarHBondContact CA-O 3.43Å; W267-L371 HydrophobicContact CB-CD1 4.02Å; W267-L371 HydrophobicContact CB-CD2 3.82Å; W267-L371 HydrophobicContact CB-CG 4.46Å; W267-L371 HydrophobicContact CG-CD2 4.1Å
268	F	95	Very high	92.6	Very high	18 Å²	18	41.7 Å²	41.7	8%	0.079	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	131.7	169.9	-62.5	-89.5	0	0	0	110.2	L284 M293 C296 Q304 Y356 F357 S358	F268-L284 HydrophobicContact CB-CD1 4.41Å; F268-L284 HydrophobicContact CD1-CD1 4Å; F268-L284 HydrophobicContact CD2-CD1 4.22Å; F268-L284 HydrophobicContact CE1-CD1 4.4Å; F268-L284 HydrophobicContact CG-CD1 3.92Å; F268-M293 WeakPolarHBondContact CA-O 3.22Å; F268-C296 HydrophobicContact CZ-CB 4.11Å; F268-Q304 HydrophobicContact CD1-CG 3.77Å; F268-Q304 HydrophobicContact CE1-CG 3.76Å; F268-Y356 HydrophobicContact CB-CE1 4.31Å; F268-F357 CarbonylContact O-C 3.55Å; F268-S358 PolarHBondContact N-O 2.86Å; F268-S358 PolarHBondContact O-N 3.36Å
269	V	97.6	Very high	92.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	158.4	172.1	-54.1	0	0	0	0	111.3	V259 W267 V292 M293 L320 V322 F333 Y356 F357 L371	V259-V269 HydrophobicContact CG1-CG1 4.36Å; W267-V269 HydrophobicContact CE3-CG1 4.33Å; W267-V269 HydrophobicContact CE3-CG2 4.3Å; W267-V269 HydrophobicContact CZ3-CG2 3.97Å; V269-V292 WeakPolarHBondContact O-CA 3.28Å; V269-M293 PolarHBondContact N-O 3.04Å; V269-M293 PolarHBondContact O-N 2.96Å; V269-M293 VanDerWaalsContact O-O 3.04Å; V269-L320 HydrophobicContact CG2-CD2 3.53Å; V269-V322 HydrophobicContact CG2-CG2 4.22Å; V269-F333 WeakPolarHBondContact O-CE1 3.32Å; V269-Y356 VanDerWaalsContact CA-O 3.28Å; V269-Y356 WeakPolarHBondContact CA-O 3.27Å; V269-F357 HydrophobicContact CG1-CD1 3.98Å; V269-L371 HydrophobicContact CG1-CD1 4.11Å
270	G	98.1	Very high	92.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.4	-135.3	-179.6	0	0	0	0	0	110.6	Y356	G270-Y356 PolarHBondContact N-O 3.5Å; G270-Y356 VanDerWaalsContact N-O 3.12Å; G270-Y356 PolarHBondContact O-N 2.79Å
271	V	98.4	Very high	91.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	151.6	174.4	-65.4	0	0	0	0	112.7	W257 W291 L324 V331 L353 F354	W257-V271 HydrophobicContact CH2-CG1 3.51Å; W257-V271 HydrophobicContact CZ2-CG1 3.88Å; V271-W291 HydrophobicContact CG2-CB 3.93Å; V271-W291 HydrophobicContact CG2-CE3 4.1Å; V271-W291 PolarHBondContact N-O 3.43Å; V271-W291 VanDerWaalsContact N-O 3.08Å; V271-W291 PolarHBondContact O-N 3.32Å; V271-L324 HydrophobicContact CG1-CD2 4.34Å; V271-V331 HydrophobicContact CG2-CG1 4.27Å; V271-V331 HydrophobicContact CG2-CG2 3.64Å; V271-L353 HydrophobicContact CB-CB 4.44Å; V271-L353 HydrophobicContact CG2-CD1 4.18Å; V271-F354 CarbonylContact C-O 3.6Å; V271-F354 VanDerWaalsContact CA-O 3.23Å; V271-F354 WeakPolarHBondContact CA-O 3.33Å; V271-F354 WeakPolarHBondContact CB-O 3.5Å
272	A	97.9	Very high	91.5	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	147.9	172.8	0	0	0	0	0	110.5	L245 I276 G289 Y290 F354 Y356	L245-A272 HydrophobicContact CD2-CB 4.21Å; A272-I276 HydrophobicContact CB-CD1 4.09Å; A272-I276 HydrophobicContact CB-CG2 4.1Å; A272-G289 CarbonylContact C-O 3.51Å; A272-G289 WeakPolarHBondContact CA-O 3.41Å; A272-Y290 HydrophobicContact CB-CD1 3.87Å; A272-Y290 HydrophobicContact CB-CE1 4.16Å; A272-F354 PolarHBondContact N-O 3.21Å; A272-F354 PolarHBondContact O-N 3.46Å; A272-Y356 HydrophobicContact CB-CD2 3.72Å; A272-Y356 HydrophobicContact CB-CG 4.2Å
273	R	96.8	Very high	92	Very high	55 Å²	55	55.2 Å²	55.2	21%	0.208	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	151.9	175.3	79.6	179.7	169.1	-140.8	-9.1	111.9	S275 I276 E287 E288 G289 W291 E351 L353	R273-S275 VanDerWaalsContact CD-OG 3.28Å; R273-S275 WeakPolarHBondContact CD-OG 3.43Å; R273-S275 PolarHBondContact NE-OG 3.24Å; R273-S275 PolarHBondContact O-N 3.23Å; R273-I276 HydrophobicContact CG-CG2 3.89Å; R273-I276 WeakPolarHBondContact O-CG1 3.45Å; R273-I276 WeakPolarHBondContact O-CG2 3.31Å; R273-I276 PolarHBondContact O-N 2.83Å; R273-E287 PolarHBondContact NH1-O 3.14Å; R273-E287 PolarHBondContact NH2-O 3.03Å; R273-E288 VanDerWaalsContact CZ-C 3.44Å; R273-E288 PolarHBondContact NH2-O 3.26Å; R273-G289 PolarHBondContact N-O 2.96Å; R273-W291 HydrophobicContact CB-CH2 4.39Å; R273-W291 HydrophobicContact CB-CZ3 4.08Å; R273-E351 HydrophobicContact CB-CG 3.96Å; R273-E351 WeakPolarHBondContact CB-OE1 3.36Å; R273-E351 VanDerWaalsContact CG-OE1 3.3Å; R273-E351 WeakPolarHBondContact CG-OE1 3.26Å; R273-L353 HydrophobicContact CB-CD2 4.02Å
274	E	96.3	Very high	92.7	Very high	73 Å²	73	48.4 Å²	48.4	34%	0.341	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-38.6	178.7	-174.7	149.3	-122.5	0	0	113.4	I276 R278 E351 K352 F354	E274-I276 PolarHBondContact O-N 3.22Å; E274-R278 PolarHBondContact O-NH2 3.17Å; E274-E351 WeakPolarHBondContact CA-OE1 3.33Å; E274-E351 PolarHBondContact N-OE1 3.18Å; E274-K352 HydrophobicContact CB-CB 4.28Å; E274-K352 PolarHBondContact N-O 3.1Å; E274-K352 IonicContact OE1-NZ 2.83Å; E274-K352 PolarHBondContact OE1-NZ 2.82Å; E274-K352 WeakPolarHBondContact OE2-CB 3.22Å; E274-K352 IonicContact OE2-NZ 3.01Å; E274-K352 PolarHBondContact OE2-NZ 3.33Å; E274-F354 HydrophobicContact CB-CD2 4.35Å; E274-F354 HydrophobicContact CB-CE2 3.81Å; E274-F354 HydrophobicContact CG-CE2 3.83Å; E274-F354 WeakPolarHBondContact OE1-CE2 3.34Å; E274-F354 WeakPolarHBondContact OE1-CZ 3.39Å
275	S	95.2	Very high	93.3	Very high	65 Å²	65	48.1 Å²	48.1	46%	0.455	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	11.4	-175.5	69.9	0	0	0	0	116	R273 E351	R273-S275 VanDerWaalsContact CD-OG 3.28Å; R273-S275 WeakPolarHBondContact CD-OG 3.43Å; R273-S275 PolarHBondContact NE-OG 3.24Å; R273-S275 PolarHBondContact O-N 3.23Å; S275-E351 WeakPolarHBondContact CB-OE1 3.4Å; S275-E351 PolarHBondContact N-OE1 2.94Å; S275-E351 VanDerWaalsContact OG-CD 3.27Å; S275-E351 PolarHBondContact OG-OE1 3.24Å; S275-E351 PolarHBondContact OG-OE2 3.27Å
276	I	95.3	Very high	94	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.041	22%	0.217	C	C	.	.			trans	-56.4	143.7	177.4	54.3	159.3	0	0	0	112.8	L245 A272 R273 E274 R278 Y290	L245-I276 HydrophobicContact CD1-CD1 4.49Å; L245-I276 HydrophobicContact CD2-CD1 4.34Å; A272-I276 HydrophobicContact CB-CD1 4.09Å; A272-I276 HydrophobicContact CB-CG2 4.1Å; R273-I276 HydrophobicContact CG-CG2 3.89Å; R273-I276 WeakPolarHBondContact O-CG1 3.45Å; R273-I276 WeakPolarHBondContact O-CG2 3.31Å; R273-I276 PolarHBondContact O-N 2.83Å; E274-I276 PolarHBondContact O-N 3.22Å; I276-R278 HydrophobicContact CD1-CG 4.4Å; I276-R278 HydrophobicContact CG1-CG 4.13Å; I276-R278 VanDerWaalsContact O-CG 3.22Å; I276-R278 WeakPolarHBondContact O-CG 3.33Å; I276-R278 PolarHBondContact O-N 3.15Å; I276-Y290 HydrophobicContact CB-CE1 4.3Å; I276-Y290 HydrophobicContact CD1-CE1 3.91Å; I276-Y290 HydrophobicContact CG2-CD1 4.3Å; I276-Y290 HydrophobicContact CG2-CD2 4.43Å; I276-Y290 HydrophobicContact CG2-CE1 3.78Å; I276-Y290 HydrophobicContact CG2-CE2 3.92Å
277	K	94.5	Very high	94.3	Very high	98 Å²	98	46 Å²	46	43%	0.426	23%	0.231	S	C	.	.			trans	-77.6	81.3	-177.8	-46.1	-174.4	-175.6	91.5	0	112	K279 S280 T282 E288	K277-K279 PolarHBondContact O-N 2.77Å; K277-K279 VanDerWaalsContact O-N 3.11Å; K277-S280 WeakPolarHBondContact CB-OG 3.37Å; K277-S280 PolarHBondContact O-N 3.22Å; K277-T282 HydrophobicContact CB-CG2 3.78Å; K277-T282 HydrophobicContact CD-CG2 3.87Å; K277-T282 HydrophobicContact CG-CG2 3.98Å; K277-E288 IonicContact NZ-OE1 3.9Å; K277-E288 PolarHBondContact NZ-OE1 2.77Å; K277-E288 IonicContact NZ-OE2 3.57Å; K277-E288 PolarHBondContact NZ-OE2 2.7Å
278	R	94.4	Very high	94.4	Very high	43 Å²	43	48.1 Å²	48.1	16%	0.162	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-21.7	-169.6	-46	-168.3	-170.7	-176	3.2	115.5	E236 T239 S240 E274 I276	E236-R278 WeakPolarHBondContact O-CD 3.32Å; E236-R278 PolarHBondContact O-NH1 3Å; T239-R278 PolarHBondContact N-O 2.86Å; S240-R278 PolarHBondContact N-O 3.39Å; S240-R278 PolarHBondContact OG-O 3.32Å; E274-R278 PolarHBondContact O-NH2 3.17Å; I276-R278 HydrophobicContact CD1-CG 4.4Å; I276-R278 HydrophobicContact CG1-CG 4.13Å; I276-R278 VanDerWaalsContact O-CG 3.22Å; I276-R278 WeakPolarHBondContact O-CG 3.33Å; I276-R278 PolarHBondContact O-N 3.15Å
279	K	93.1	Very high	94.4	Very high	91 Å²	91	47.3 Å²	47.3	40%	0.396	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115	8.9	-174.9	-53.3	-161.5	-179.6	-166.8	0	115.6	D233 N234 T239 K277	D233-K279 IonicContact OD1-NZ 2.74Å; D233-K279 PolarHBondContact OD1-NZ 3.46Å; D233-K279 IonicContact OD2-NZ 2.7Å; D233-K279 PolarHBondContact OD2-NZ 2.9Å; N234-K279 WeakPolarHBondContact O-CE 3.28Å; N234-K279 PolarHBondContact O-NZ 2.92Å; T239-K279 WeakPolarHBondContact OG1-CA 3.09Å; K277-K279 PolarHBondContact O-N 2.77Å; K277-K279 VanDerWaalsContact O-N 3.11Å
280	S	90.9	Very high	94.4	Very high	53 Å²	53	47.5 Å²	47.5	37%	0.371	24%	0.238	S	C	.	.	S	Bend	trans	-131.8	149.9	176	62.3	0	0	0	0	110.9	S240 K277 T282	S240-S280 WeakPolarHBondContact CB-O 3.32Å; S240-S280 PolarHBondContact OG-O 3.11Å; K277-S280 WeakPolarHBondContact CB-OG 3.37Å; K277-S280 PolarHBondContact O-N 3.22Å; S280-T282 PolarHBondContact O-N 3.27Å
281	T	87.3	Confident	94.4	Very high	129 Å²	129	48.1 Å²	48.1	79%	0.791	24%	0.24	S	C	*	.			trans	-67.4	106.1	178	-50	0	0	0	0	111.3
282	T	87.3	Confident	94.3	Very high	5 Å²	5	48.1 Å²	48.1	3%	0.031	24%	0.24	C	C	.	.			trans	-105.8	153.6	170.2	47.9	0	0	0	0	110.5	R241 K277 S280 E288 Y290	R241-T282 PolarHBondContact NE-O 2.88Å; R241-T282 PolarHBondContact NH2-O 3.47Å; K277-T282 HydrophobicContact CB-CG2 3.78Å; K277-T282 HydrophobicContact CD-CG2 3.87Å; K277-T282 HydrophobicContact CG-CG2 3.98Å; S280-T282 PolarHBondContact O-N 3.27Å; T282-E288 HydrophobicContact CG2-CG 4.34Å; T282-E288 WeakPolarHBondContact CG2-OE2 3.32Å; T282-Y290 PolarHBondContact OG1-OH 3.4Å
283	F	89.8	Confident	94.2	Very high	162 Å²	162	48 Å²	48	71%	0.711	24%	0.24	S	C	*	.			trans	-74	152.2	163.6	-65.5	-75.8	0	0	0	110	S285 E288	F283-S285 PolarHBondContact O-N 3.04Å; F283-E288 WeakPolarHBondContact O-CB 3.31Å
284	L	92.9	Very high	94	Very high	8 Å²	8	45.4 Å²	45.4	4%	0.042	23%	0.23	C	C	.	.	S	Bend	trans	-79.6	104.8	164.8	-60.8	176	0	0	0	106.3	F268 Y290 V292 Q304	F268-L284 HydrophobicContact CB-CD1 4.41Å; F268-L284 HydrophobicContact CD1-CD1 4Å; F268-L284 HydrophobicContact CD2-CD1 4.22Å; F268-L284 HydrophobicContact CE1-CD1 4.4Å; F268-L284 HydrophobicContact CG-CD1 3.92Å; L284-Y290 HydrophobicContact CD2-CD1 3.6Å; L284-Y290 HydrophobicContact CD2-CD2 4.16Å; L284-Y290 HydrophobicContact CD2-CE1 3.87Å; L284-Y290 HydrophobicContact CD2-CE2 4.39Å; L284-Y290 HydrophobicContact CD2-CG 3.75Å; L284-V292 HydrophobicContact CB-CG2 4.11Å; L284-V292 HydrophobicContact CD1-CG2 4.12Å; L284-V292 HydrophobicContact CD2-CG2 4.36Å; L284-V292 HydrophobicContact CG-CG2 4.42Å; L284-Q304 HydrophobicContact CB-CB 3.77Å; L284-Q304 HydrophobicContact CB-CG 3.8Å; L284-Q304 HydrophobicContact CD1-CG 4.13Å
285	S	95.4	Very high	93.7	Very high	5 Å²	5	42.8 Å²	42.8	4%	0.035	22%	0.218	C	C	.	.	S	Bend	trans	-152.7	159.9	171.9	77.4	0	0	0	0	110.4	F283 E287 E288 G289 Y290 Q304	F283-S285 PolarHBondContact O-N 3.04Å; S285-E287 WeakPolarHBondContact CB-OE2 3.2Å; S285-E287 PolarHBondContact O-N 3.41Å; S285-E287 PolarHBondContact OG-N 2.98Å; S285-E287 PolarHBondContact OG-OE2 2.92Å; S285-E288 CarbonylContact O-C 3.56Å; S285-E288 PolarHBondContact O-N 3.2Å; S285-E288 PolarHBondContact OG-N 2.87Å; S285-G289 PolarHBondContact O-N 3.43Å; S285-Y290 CarbonylContact C-O 3.58Å; S285-Y290 VanDerWaalsContact C-O 3.23Å; S285-Y290 PolarHBondContact O-N 3.01Å; S285-Q304 WeakPolarHBondContact CA-O 3.18Å
286	P	96.1	Very high	92.8	Very high	26 Å²	26	42 Å²	42	17%	0.169	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-35	172.5	-29.2	38.3	0	0	0	113.5	E288 G289 Q304 F345	P286-E288 PolarHBondContact O-N 2.67Å; P286-G289 WeakPolarHBondContact O-CA 3.09Å; P286-G289 PolarHBondContact O-N 2.9Å; P286-Q304 WeakPolarHBondContact CD-O 3.11Å; P286-F345 HydrophobicContact CG-CD1 4.21Å; P286-F345 HydrophobicContact CG-CE1 4.22Å
287	E	94.4	Very high	91.6	Very high	126 Å²	126	45.4 Å²	45.4	59%	0.589	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-44.8	179.2	-52.5	136.8	162	0	0	111.1	R273 S285 G289 S306	R273-E287 PolarHBondContact NH1-O 3.14Å; R273-E287 PolarHBondContact NH2-O 3.03Å; S285-E287 WeakPolarHBondContact CB-OE2 3.2Å; S285-E287 PolarHBondContact O-N 3.41Å; S285-E287 PolarHBondContact OG-N 2.98Å; S285-E287 PolarHBondContact OG-OE2 2.92Å; E287-G289 PolarHBondContact O-N 3.35Å; E287-S306 VanDerWaalsContact OE1-CB 3.27Å; E287-S306 WeakPolarHBondContact OE1-CB 3.32Å; E287-S306 PolarHBondContact OE1-OG 3.29Å; E287-S306 VanDerWaalsContact OE1-OG 3.07Å; E287-S306 WeakPolarHBondContact OE2-CB 3.27Å; E287-S306 PolarHBondContact OE2-OG 2.75Å
288	E	95.1	Very high	90.3	Very high	45 Å²	45	47.6 Å²	47.6	21%	0.21	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-2.7	172.8	-76.3	-69	-177.5	0	0	113.3	R273 K277 T282 F283 S285 P286 Y290	R273-E288 VanDerWaalsContact CZ-C 3.44Å; R273-E288 PolarHBondContact NH2-O 3.26Å; K277-E288 IonicContact NZ-OE1 3.9Å; K277-E288 PolarHBondContact NZ-OE1 2.77Å; K277-E288 IonicContact NZ-OE2 3.57Å; K277-E288 PolarHBondContact NZ-OE2 2.7Å; T282-E288 HydrophobicContact CG2-CG 4.34Å; T282-E288 WeakPolarHBondContact CG2-OE2 3.32Å; F283-E288 WeakPolarHBondContact O-CB 3.31Å; S285-E288 CarbonylContact O-C 3.56Å; S285-E288 PolarHBondContact O-N 3.2Å; S285-E288 PolarHBondContact OG-N 2.87Å; P286-E288 PolarHBondContact O-N 2.67Å; E288-Y290 HydrophobicContact CB-CD2 3.95Å; E288-Y290 HydrophobicContact CB-CE2 3.94Å
289	G	96	Very high	89.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.2	29.5	170.1	0	0	0	0	0	115.3	A272 R273 S285 P286 E287 W291	A272-G289 CarbonylContact C-O 3.51Å; A272-G289 WeakPolarHBondContact CA-O 3.41Å; R273-G289 PolarHBondContact N-O 2.96Å; S285-G289 PolarHBondContact O-N 3.43Å; P286-G289 WeakPolarHBondContact O-CA 3.09Å; P286-G289 PolarHBondContact O-N 2.9Å; E287-G289 PolarHBondContact O-N 3.35Å; G289-W291 WeakPolarHBondContact O-CZ3 3.29Å
290	Y	97.3	Very high	88.7	Confident	4 Å²	4	48.2 Å²	48.2	2%	0.016	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	118.6	179.9	-55.9	-92.2	0	0	0	111.2	A272 I276 T282 L284 S285 E288 Y356	A272-Y290 HydrophobicContact CB-CD1 3.87Å; A272-Y290 HydrophobicContact CB-CE1 4.16Å; I276-Y290 HydrophobicContact CB-CE1 4.3Å; I276-Y290 HydrophobicContact CD1-CE1 3.91Å; I276-Y290 HydrophobicContact CG2-CD1 4.3Å; I276-Y290 HydrophobicContact CG2-CD2 4.43Å; I276-Y290 HydrophobicContact CG2-CE1 3.78Å; I276-Y290 HydrophobicContact CG2-CE2 3.92Å; T282-Y290 PolarHBondContact OG1-OH 3.4Å; L284-Y290 HydrophobicContact CD2-CD1 3.6Å; L284-Y290 HydrophobicContact CD2-CD2 4.16Å; L284-Y290 HydrophobicContact CD2-CE1 3.87Å; L284-Y290 HydrophobicContact CD2-CE2 4.39Å; L284-Y290 HydrophobicContact CD2-CG 3.75Å; S285-Y290 CarbonylContact C-O 3.58Å; S285-Y290 VanDerWaalsContact C-O 3.23Å; S285-Y290 PolarHBondContact O-N 3.01Å; E288-Y290 HydrophobicContact CB-CD2 3.95Å; E288-Y290 HydrophobicContact CB-CE2 3.94Å; Y290-Y356 HydrophobicContact CD1-CD2 4.26Å; Y290-Y356 HydrophobicContact CD1-CE2 4.05Å; Y290-Y356 HydrophobicContact CE1-CD2 4.26Å; Y290-Y356 AromaticContact CE1-CE2 3.77Å; Y290-Y356 HydrophobicContact CE1-CE2 3.77Å
291	W	98.1	Very high	88.7	Confident	13 Å²	13	45.8 Å²	45.8	5%	0.049	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	76.5	171.1	-56.3	-91.2	0	0	0	107.7	V271 R273 G289 V331 F345 D347 F349 L353	V271-W291 HydrophobicContact CG2-CB 3.93Å; V271-W291 HydrophobicContact CG2-CE3 4.1Å; V271-W291 PolarHBondContact N-O 3.43Å; V271-W291 VanDerWaalsContact N-O 3.08Å; V271-W291 PolarHBondContact O-N 3.32Å; R273-W291 HydrophobicContact CB-CH2 4.39Å; R273-W291 HydrophobicContact CB-CZ3 4.08Å; G289-W291 WeakPolarHBondContact O-CZ3 3.29Å; W291-V331 HydrophobicContact CB-CB 4.4Å; W291-V331 HydrophobicContact CB-CG2 3.73Å; W291-V331 HydrophobicContact CG-CG2 4.27Å; W291-F345 HydrophobicContact CB-CB 4.36Å; W291-F345 HydrophobicContact CB-CD1 4.33Å; W291-F345 HydrophobicContact CB-CD2 4.3Å; W291-F345 HydrophobicContact CB-CG 4.1Å; W291-F345 AromaticContact CD1-CD1 3.83Å; W291-F345 HydrophobicContact CG-CB 4.49Å; W291-F345 HydrophobicContact CG-CD1 4.49Å; W291-F345 HydrophobicContact CG-CG 4.5Å; W291-D347 HydrophobicContact CZ2-CB 4.31Å; W291-D347 PolarHBondContact NE1-OD2 2.83Å; W291-F349 HydrophobicContact CD2-CE1 4.05Å; W291-F349 AromaticContact CE2-CE1 3.86Å; W291-F349 HydrophobicContact CG-CE1 4.42Å; W291-F349 HydrophobicContact CH2-CD1 4.23Å; W291-F349 HydrophobicContact CZ2-CD1 4.02Å; W291-F349 HydrophobicContact CZ2-CE1 4.15Å; W291-L353 HydrophobicContact CE3-CD2 4.13Å; W291-L353 HydrophobicContact CH2-CD2 4.1Å; W291-L353 HydrophobicContact CZ3-CD2 3.44Å; W291-L353 VanDerWaalsContact CZ3-CD2 3.44Å
292	V	97.3	Very high	89	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	148.2	-170.9	-57.7	0	0	0	0	110.6	V269 L284 Q304 F345 Y356	V269-V292 WeakPolarHBondContact O-CA 3.28Å; L284-V292 HydrophobicContact CB-CG2 4.11Å; L284-V292 HydrophobicContact CD1-CG2 4.12Å; L284-V292 HydrophobicContact CD2-CG2 4.36Å; L284-V292 HydrophobicContact CG-CG2 4.42Å; V292-Q304 HydrophobicContact CG2-CB 3.84Å; V292-Q304 HydrophobicContact CG2-CG 3.81Å; V292-Q304 WeakPolarHBondContact O-CB 3.46Å; V292-Q304 PolarHBondContact O-N 3.3Å; V292-F345 WeakPolarHBondContact O-CZ 3.36Å; V292-Y356 HydrophobicContact CB-CD1 4.48Å; V292-Y356 HydrophobicContact CG1-CD1 3.61Å; V292-Y356 HydrophobicContact CG1-CE1 4.25Å; V292-Y356 HydrophobicContact CG1-CG 4.01Å
293	M	95.7	Very high	89.4	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	158.7	167.1	68.7	169.2	-77.3	0	0	110.1	F268 V269 L301 W302 A303 L320 F333 I342	F268-M293 WeakPolarHBondContact CA-O 3.22Å; V269-M293 PolarHBondContact N-O 3.04Å; V269-M293 PolarHBondContact O-N 2.96Å; V269-M293 VanDerWaalsContact O-O 3.04Å; M293-L301 HydrophobicContact CE-CD1 3.7Å; M293-L301 HydrophobicContact CE-CD2 3.49Å; M293-L301 VanDerWaalsContact CE-CD2 3.49Å; M293-L301 HydrophobicContact CE-CG 3.47Å; M293-L301 VanDerWaalsContact CE-CG 3.47Å; M293-W302 CarbonylContact C-O 3.54Å; M293-W302 VanDerWaalsContact CA-O 3.27Å; M293-W302 WeakPolarHBondContact CA-O 3.44Å; M293-W302 WeakPolarHBondContact CB-O 3.29Å; M293-A303 HydrophobicContact CB-CB 4.5Å; M293-L320 HydrophobicContact CE-CD1 4.49Å; M293-L320 HydrophobicContact CG-CD2 4.18Å; M293-L320 HydrophobicContact SD-CD2 4.37Å; M293-F333 HydrophobicContact CG-CB 4.33Å; M293-F333 HydrophobicContact CG-CD1 3.57Å; M293-F333 HydrophobicContact CG-CD2 4.04Å; M293-F333 HydrophobicContact CG-CE1 3.7Å; M293-F333 HydrophobicContact CG-CE2 4.18Å; M293-F333 HydrophobicContact CG-CG 3.72Å; M293-F333 HydrophobicContact CG-CZ 4Å; M293-F333 HydrophobicContact SD-CB 3.39Å; M293-F333 WeakPolarHBondContact SD-CB 3.36Å; M293-F333 HydrophobicContact SD-CD1 3.78Å; M293-F333 HydrophobicContact SD-CD2 3.93Å; M293-F333 HydrophobicContact SD-CE1 4.49Å; M293-F333 HydrophobicContact SD-CG 3.43Å; M293-F333 WeakPolarHBondContact SD-CG 3.48Å; M293-I342 HydrophobicContact CE-CG2 3.65Å; M293-I342 HydrophobicContact SD-CG2 4.2Å
294	G	92.7	Very high	89.7	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	159.5	-170.3	0	0	0	0	0	113.7	W267 W302	W267-G294 CarbonylContact O-C 3.5Å; W267-G294 WeakPolarHBondContact O-CA 3.37Å; G294-W302 PolarHBondContact N-O 3.27Å; G294-W302 PolarHBondContact O-N 3.21Å
295	Q	89.1	Confident	89.8	Confident	17 Å²	17	35.3 Å²	35.3	8%	0.079	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	136.3	169	-178.6	168.5	-6.9	0	0	108.7	D266 W267 S297 K298 L301	D266-Q295 WeakPolarHBondContact CA-O 3.42Å; W267-Q295 HydrophobicContact CD2-CB 4.23Å; W267-Q295 HydrophobicContact CG-CB 4.42Å; W267-Q295 HydrophobicContact CZ2-CB 3.94Å; W267-Q295 PolarHBondContact N-O 3.12Å; W267-Q295 PolarHBondContact O-N 3.33Å; Q295-S297 WeakPolarHBondContact CG-O 3.25Å; Q295-S297 PolarHBondContact NE2-O 3.15Å; Q295-K298 PolarHBondContact NE2-O 2.92Å; Q295-L301 HydrophobicContact CB-CD1 4.33Å
296	C	76	Confident	89.6	Confident	50 Å²	50	38.5 Å²	38.5	34%	0.338	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	111.5	172.4	-161.7	0	0	0	0	107.5	D266 F268 S300	D266-C296 PolarHBondContact OD1-SG 3.09Å; D266-C296 VanDerWaalsContact OD1-SG 3.37Å; F268-C296 HydrophobicContact CZ-CB 4.11Å; C296-S300 PolarHBondContact N-O 3.48Å
297	S	70.2	Confident	89.4	Confident	79 Å²	79	42.8 Å²	42.8	55%	0.552	23%	0.234	S	C	*	.	S	Bend	trans	69.4	162.2	-158.5	81.1	0	0	0	0	115.1	Q295 D299	Q295-S297 WeakPolarHBondContact CG-O 3.25Å; Q295-S297 PolarHBondContact NE2-O 3.15Å; S297-D299 VanDerWaalsContact C-N 3.29Å; S297-D299 PolarHBondContact O-N 3.23Å; S297-D299 VanDerWaalsContact O-N 3.12Å
298	K	66.5	Low	89.3	Confident	144 Å²	144	43.4 Å²	43.4	63%	0.626	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-27.5	-164	-85.8	-174.7	169.7	-175.9	0	116.4	Q295	Q295-K298 PolarHBondContact NE2-O 2.92Å
299	D	70.6	Confident	89.2	Confident	130 Å²	130	44 Å²	44	70%	0.695	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-133.8	29.4	-165.2	-54	-80.2	0	0	0	112.3	S297 M316	S297-D299 VanDerWaalsContact C-N 3.29Å; S297-D299 PolarHBondContact O-N 3.23Å; S297-D299 VanDerWaalsContact O-N 3.12Å; D299-M316 VanDerWaalsContact C-CE 3.46Å
300	S	83.7	Confident	89.1	Confident	17 Å²	17	50.6 Å²	50.6	12%	0.119	26%	0.263	C	S	.	.			trans	-148.9	117.4	-178.4	-68.6	0	0	0	0	114	C296 R310	C296-S300 PolarHBondContact N-O 3.48Å; S300-R310 PolarHBondContact OG-NH1 3.37Å
301	L	91.3	Very high	88.9	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	136.7	178	-164.8	64.8	0	0	0	109.9	W267 M293 Q295 V311 V313 M316 P317 I342	W267-L301 HydrophobicContact CH2-CD1 3.81Å; W267-L301 HydrophobicContact CZ2-CD1 3.98Å; M293-L301 HydrophobicContact CE-CD1 3.7Å; M293-L301 HydrophobicContact CE-CD2 3.49Å; M293-L301 VanDerWaalsContact CE-CD2 3.49Å; M293-L301 HydrophobicContact CE-CG 3.47Å; M293-L301 VanDerWaalsContact CE-CG 3.47Å; Q295-L301 HydrophobicContact CB-CD1 4.33Å; L301-V311 PolarHBondContact O-N 2.86Å; L301-V313 HydrophobicContact CD2-CG1 3.88Å; L301-V313 HydrophobicContact CD2-CG2 4.22Å; L301-M316 HydrophobicContact CB-CE 4.49Å; L301-M316 HydrophobicContact CB-SD 4.29Å; L301-P317 HydrophobicContact CD2-CG 4.44Å; L301-I342 HydrophobicContact CD2-CG2 3.79Å
302	W	93.8	Very high	88.4	Confident	58 Å²	58	56.1 Å²	56.1	22%	0.22	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	126.7	-170.4	-63.7	91.9	0	0	0	112.3	M293 G294 R308 T309 R310	M293-W302 CarbonylContact C-O 3.54Å; M293-W302 VanDerWaalsContact CA-O 3.27Å; M293-W302 WeakPolarHBondContact CA-O 3.44Å; M293-W302 WeakPolarHBondContact CB-O 3.29Å; G294-W302 PolarHBondContact N-O 3.27Å; G294-W302 PolarHBondContact O-N 3.21Å; W302-R308 HydrophobicContact CE3-CB 4.05Å; W302-R308 HydrophobicContact CZ3-CB 4.31Å; W302-T309 WeakPolarHBondContact CA-O 3.4Å; W302-R310 HydrophobicContact CD2-CB 4.47Å; W302-R310 HydrophobicContact CE3-CB 3.9Å; W302-R310 HydrophobicContact CH2-CB 4Å; W302-R310 HydrophobicContact CZ3-CB 3.65Å
303	A	96.3	Very high	87.9	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	130.9	160.2	0	0	0	0	0	108.8	M293 T305 T309 V311 Y343 F345	M293-A303 HydrophobicContact CB-CB 4.5Å; A303-T305 PolarHBondContact O-N 3.09Å; A303-T305 PolarHBondContact O-OG1 3.34Å; A303-T309 PolarHBondContact N-O 2.95Å; A303-T309 PolarHBondContact O-N 3.22Å; A303-V311 HydrophobicContact CB-CG2 4.08Å; A303-Y343 HydrophobicContact CB-CD1 3.62Å; A303-Y343 HydrophobicContact CB-CD2 3.88Å; A303-Y343 HydrophobicContact CB-CE1 3.54Å; A303-Y343 HydrophobicContact CB-CE2 3.8Å; A303-Y343 HydrophobicContact CB-CG 3.8Å; A303-F345 HydrophobicContact CB-CE2 4.35Å; A303-F345 HydrophobicContact CB-CZ 3.96Å
304	Q	95.5	Very high	87.3	Confident	1 Å²	1	69 Å²	69	1%	0.005	36%	0.363	C	S	.	.			trans	-82.8	64.2	179.8	-63.3	-58	-76.8	0	0	111	F268 L284 S285 P286 V292	F268-Q304 HydrophobicContact CD1-CG 3.77Å; F268-Q304 HydrophobicContact CE1-CG 3.76Å; L284-Q304 HydrophobicContact CB-CB 3.77Å; L284-Q304 HydrophobicContact CB-CG 3.8Å; L284-Q304 HydrophobicContact CD1-CG 4.13Å; S285-Q304 WeakPolarHBondContact CA-O 3.18Å; P286-Q304 WeakPolarHBondContact CD-O 3.11Å; V292-Q304 HydrophobicContact CG2-CB 3.84Å; V292-Q304 HydrophobicContact CG2-CG 3.81Å; V292-Q304 WeakPolarHBondContact O-CB 3.46Å; V292-Q304 PolarHBondContact O-N 3.3Å
305	T	94.5	Very high	87	Confident	24 Å²	24	75.3 Å²	75.3	15%	0.147	39%	0.393	C	S	.	.			trans	-85.1	170.7	169	35	0	0	0	0	111.8	A303 P307 R308 T309 Y343 F345	A303-T305 PolarHBondContact O-N 3.09Å; A303-T305 PolarHBondContact O-OG1 3.34Å; T305-P307 VanDerWaalsContact C-C 3.42Å; T305-P307 CarbonylContact C-O 3.52Å; T305-P307 VanDerWaalsContact C-O 3.31Å; T305-P307 WeakPolarHBondContact CB-O 3.4Å; T305-P307 CarbonylContact O-C 3.58Å; T305-P307 PolarHBondContact OG1-O 3.31Å; T305-R308 WeakPolarHBondContact O-CA 3.48Å; T305-R308 PolarHBondContact O-N 2.92Å; T305-R308 VanDerWaalsContact O-N 3.08Å; T305-T309 WeakPolarHBondContact OG1-CB 3.48Å; T305-T309 PolarHBondContact OG1-N 3.23Å; T305-T309 PolarHBondContact OG1-OG1 3.36Å; T305-Y343 WeakPolarHBondContact CG2-OH 3.26Å; T305-F345 HydrophobicContact CG2-CD1 4.33Å; T305-F345 HydrophobicContact CG2-CE1 3.77Å
306	S	91.3	Very high	86.9	Confident	72 Å²	72	77.6 Å²	77.6	50%	0.503	40%	0.404	S	S	.	.	S	Bend	trans	-113.4	106.5	172.6	-169.7	0	0	0	0	108.8	E287	E287-S306 VanDerWaalsContact OE1-CB 3.27Å; E287-S306 WeakPolarHBondContact OE1-CB 3.32Å; E287-S306 PolarHBondContact OE1-OG 3.29Å; E287-S306 VanDerWaalsContact OE1-OG 3.07Å; E287-S306 WeakPolarHBondContact OE2-CB 3.27Å; E287-S306 PolarHBondContact OE2-OG 2.75Å
307	P	91.1	Very high	87.6	Confident	117 Å²	117	75.5 Å²	75.5	76%	0.76	39%	0.39	S	S	*	.	S	Bend	cis	-70.6	164.1	-12.5	33.9	-36.9	0	0	0	112.7	T305 T309	T305-P307 VanDerWaalsContact C-C 3.42Å; T305-P307 CarbonylContact C-O 3.52Å; T305-P307 VanDerWaalsContact C-O 3.31Å; T305-P307 WeakPolarHBondContact CB-O 3.4Å; T305-P307 CarbonylContact O-C 3.58Å; T305-P307 PolarHBondContact OG1-O 3.31Å; P307-T309 PolarHBondContact O-N 2.84Å
308	R	92.4	Very high	88.7	Confident	138 Å²	138	78.1 Å²	78.1	52%	0.521	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-59.9	125.9	-175.6	-74.4	173.4	161.7	175	-8.8	113.1	W302 T305	W302-R308 HydrophobicContact CE3-CB 4.05Å; W302-R308 HydrophobicContact CZ3-CB 4.31Å; T305-R308 WeakPolarHBondContact O-CA 3.48Å; T305-R308 PolarHBondContact O-N 2.92Å; T305-R308 VanDerWaalsContact O-N 3.08Å
309	T	94.3	Very high	90.1	Very high	57 Å²	57	76.3 Å²	76.3	35%	0.35	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	117.4	175.7	-55	0	0	0	0	110.7	W302 A303 T305 P307 Y343	W302-T309 WeakPolarHBondContact CA-O 3.4Å; A303-T309 PolarHBondContact N-O 2.95Å; A303-T309 PolarHBondContact O-N 3.22Å; T305-T309 WeakPolarHBondContact OG1-CB 3.48Å; T305-T309 PolarHBondContact OG1-N 3.23Å; T305-T309 PolarHBondContact OG1-OG1 3.36Å; P307-T309 PolarHBondContact O-N 2.84Å; T309-Y343 HydrophobicContact CG2-CE2 4.16Å
310	R	93.3	Very high	91.3	Very high	139 Å²	139	70.1 Å²	70.1	53%	0.525	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	133	166.4	-178.6	-176	-75.1	-89.5	1.2	108.9	S300 W302	S300-R310 PolarHBondContact OG-NH1 3.37Å; W302-R310 HydrophobicContact CD2-CB 4.47Å; W302-R310 HydrophobicContact CE3-CB 3.9Å; W302-R310 HydrophobicContact CH2-CB 4Å; W302-R310 HydrophobicContact CZ3-CB 3.65Å
311	V	92.9	Very high	91.9	Very high	17 Å²	17	69.9 Å²	69.9	10%	0.103	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	117.4	180	-172.2	0	0	0	0	109.7	L301 A303 V313 I342 Y343	L301-V311 PolarHBondContact O-N 2.86Å; A303-V311 HydrophobicContact CB-CG2 4.08Å; V311-V313 HydrophobicContact CG1-CG1 4.45Å; V311-I342 HydrophobicContact CG1-CG2 3.58Å; V311-I342 VanDerWaalsContact CG1-O 3.29Å; V311-I342 WeakPolarHBondContact CG1-O 3.47Å; V311-Y343 HydrophobicContact CG2-CD2 3.91Å; V311-Y343 HydrophobicContact CG2-CG 4.47Å
312	S	87.8	Confident	92.2	Very high	116 Å²	116	69.8 Å²	69.8	81%	0.811	35%	0.347	S	S	*	.			trans	-86.8	121.9	177.4	-59.8	0	0	0	0	110.5
313	V	86.6	Confident	92.5	Very high	47 Å²	47	71.1 Å²	71.1	29%	0.285	36%	0.355	S	S	.	.			trans	-121.1	149.5	175.7	-67.3	0	0	0	0	110	L301 V311 Q315 M316 I342	L301-V313 HydrophobicContact CD2-CG1 3.88Å; L301-V313 HydrophobicContact CD2-CG2 4.22Å; V311-V313 HydrophobicContact CG1-CG1 4.45Å; V313-Q315 VanDerWaalsContact C-N 3.32Å; V313-Q315 WeakPolarHBondContact CB-O 3.44Å; V313-Q315 VanDerWaalsContact CG2-O 3.27Å; V313-Q315 WeakPolarHBondContact CG2-O 3.09Å; V313-M316 HydrophobicContact CG2-SD 3.8Å; V313-I342 HydrophobicContact CG1-CG1 4.16Å; V313-I342 HydrophobicContact CG1-CG2 3.74Å
314	K	84.1	Confident	92.5	Very high	224 Å²	224	71.2 Å²	71.2	97%	0.974	36%	0.356	S	S	*	.	S	Bend	trans	-69.8	-31.4	178	-68.2	-177.9	177.8	179.2	0	112.8
315	Q	85.5	Confident	92.7	Very high	133 Å²	133	71.6 Å²	71.6	62%	0.621	36%	0.358	S	S	*	.	S	Bend	trans	-144.2	144.2	177.7	-176.5	179.7	-1.3	0	0	106.6	V313	V313-Q315 VanDerWaalsContact C-N 3.32Å; V313-Q315 WeakPolarHBondContact CB-O 3.44Å; V313-Q315 VanDerWaalsContact CG2-O 3.27Å; V313-Q315 WeakPolarHBondContact CG2-O 3.09Å
316	M	88.1	Confident	92.8	Very high	65 Å²	65	71.2 Å²	71.2	32%	0.32	36%	0.356	S	S	.	.			trans	-67.9	134.6	172.9	-72.2	-61.4	-175	0	0	109.9	D299 L301 V313 E318	D299-M316 VanDerWaalsContact C-CE 3.46Å; L301-M316 HydrophobicContact CB-CE 4.49Å; L301-M316 HydrophobicContact CB-SD 4.29Å; V313-M316 HydrophobicContact CG2-SD 3.8Å; M316-E318 PolarHBondContact O-N 3.42Å
317	P	90.5	Very high	92.9	Very high	6 Å²	6	73 Å²	73	4%	0.039	36%	0.36	C	S	.	.			trans	-71.1	121.9	-179.4	28.7	-33.7	0	0	0	110.1	V261 L301 L320 N335 I342	V261-P317 WeakPolarHBondContact CG2-O 3.48Å; L301-P317 HydrophobicContact CD2-CG 4.44Å; P317-L320 HydrophobicContact CB-CD1 4.32Å; P317-L320 HydrophobicContact CG-CD1 4.01Å; P317-N335 HydrophobicContact CB-CB 4.31Å; P317-I342 HydrophobicContact CB-CD1 4.17Å; P317-I342 HydrophobicContact CG-CD1 4.01Å
318	E	92.9	Very high	93.2	Very high	134 Å²	134	74.1 Å²	74.1	63%	0.626	35%	0.353	S	S	*	.	S	Bend	trans	-68.6	-30.3	169.2	-66.5	179.8	167.9	0	0	111.7	V261 G262 M316	V261-E318 PolarHBondContact N-O 2.89Å; G262-E318 PolarHBondContact N-O 3.14Å; M316-E318 PolarHBondContact O-N 3.42Å
319	R	95.1	Very high	93.4	Very high	105 Å²	105	68 Å²	68	40%	0.396	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	126.3	-179.9	-65.2	-174.6	-63.5	149.9	7	109.9	T258 V259 E260 A336	T258-R319 HydrophobicContact CG2-CB 4.03Å; V259-R319 CarbonylContact O-C 3.36Å; V259-R319 VanDerWaalsContact O-CA 3.25Å; V259-R319 WeakPolarHBondContact O-CA 3.47Å; E260-R319 HydrophobicContact CB-CG 4.48Å; E260-R319 HydrophobicContact CG-CG 4.11Å; R319-A336 HydrophobicContact CB-CB 3.82Å; R319-A336 WeakPolarHBondContact O-CB 3.34Å; R319-A336 PolarHBondContact O-N 3.29Å
320	L	95.8	Very high	93.6	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.8	-177.5	-165.7	78.5	0	0	0	109.9	T258 V259 V261 W267 V269 M293 P317 F333 I342	T258-L320 CarbonylContact C-O 3.59Å; T258-L320 WeakPolarHBondContact CA-O 3.2Å; V259-L320 PolarHBondContact N-O 2.92Å; V259-L320 PolarHBondContact O-N 3.22Å; V261-L320 HydrophobicContact CG1-CB 4.43Å; V261-L320 HydrophobicContact CG2-CB 4.38Å; W267-L320 HydrophobicContact CH2-CD2 4.01Å; W267-L320 HydrophobicContact CZ3-CD2 3.92Å; V269-L320 HydrophobicContact CG2-CD2 3.53Å; M293-L320 HydrophobicContact CE-CD1 4.49Å; M293-L320 HydrophobicContact CG-CD2 4.18Å; M293-L320 HydrophobicContact SD-CD2 4.37Å; P317-L320 HydrophobicContact CB-CD1 4.32Å; P317-L320 HydrophobicContact CG-CD1 4.01Å; L320-F333 HydrophobicContact CD2-CD1 3.69Å; L320-F333 HydrophobicContact CD2-CE1 4.29Å; L320-F333 HydrophobicContact CG-CD1 4.31Å; L320-I342 HydrophobicContact CD1-CD1 3.31Å
321	T	97.2	Very high	93.8	Very high	13 Å²	13	62.7 Å²	62.7	8%	0.08	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	126.4	171.5	-57.1	0	0	0	0	109.8	W257 T258 Q323 F333 T334	W257-T321 CarbonylContact O-C 3.09Å; W257-T321 WeakPolarHBondContact O-CA 3.43Å; T258-T321 WeakPolarHBondContact CG2-OG1 3.44Å; T258-T321 PolarHBondContact OG1-OG1 3.07Å; T321-Q323 HydrophobicContact CG2-CG 4.11Å; T321-F333 WeakPolarHBondContact O-CA 3.41Å; T321-T334 PolarHBondContact N-O 3.41Å; T321-T334 PolarHBondContact O-N 2.82Å
322	V	98.3	Very high	94.1	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	125	172.4	-168.9	0	0	0	0	107.9	S256 W257 V269 V331 F333	S256-V322 WeakPolarHBondContact CA-O 3.46Å; W257-V322 HydrophobicContact CD2-CB 4.17Å; W257-V322 HydrophobicContact CH2-CB 4.33Å; W257-V322 HydrophobicContact CH2-CG1 3.91Å; W257-V322 HydrophobicContact CZ2-CB 3.77Å; W257-V322 HydrophobicContact CZ2-CG1 3.58Å; W257-V322 HydrophobicContact CZ2-CG2 4.35Å; W257-V322 PolarHBondContact N-O 3.37Å; W257-V322 VanDerWaalsContact N-O 3.09Å; W257-V322 PolarHBondContact O-N 2.89Å; V269-V322 HydrophobicContact CG2-CG2 4.22Å; V322-V331 HydrophobicContact CG1-CG1 3.82Å; V322-F333 HydrophobicContact CB-CD1 4.41Å; V322-F333 HydrophobicContact CB-CE1 4.26Å; V322-F333 HydrophobicContact CG1-CD1 4.24Å; V322-F333 HydrophobicContact CG1-CE1 3.78Å; V322-F333 HydrophobicContact CG1-CZ 4.14Å; V322-F333 HydrophobicContact CG2-CD1 3.87Å; V322-F333 HydrophobicContact CG2-CE1 3.66Å
323	Q	98.2	Very high	94.5	Very high	85 Å²	85	57 Å²	57	40%	0.397	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	111.1	176	-63.8	-178.9	-17.7	0	0	109.4	T321 V331 V332	T321-Q323 HydrophobicContact CG2-CG 4.11Å; Q323-V331 WeakPolarHBondContact O-CA 3.48Å; Q323-V332 HydrophobicContact CB-CB 4.23Å; Q323-V332 PolarHBondContact N-O 3.33Å; Q323-V332 PolarHBondContact O-N 2.87Å
324	L	98.3	Very high	95	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	124	173	175.4	62.8	0	0	0	109.3	F250 K254 H255 W257 V271 C326 V331 F349 L353	F250-L324 HydrophobicContact CB-CD2 3.98Å; F250-L324 HydrophobicContact CD2-CD2 3.76Å; F250-L324 HydrophobicContact CG-CD2 4.24Å; K254-L324 CarbonylContact C-O 3.44Å; K254-L324 VanDerWaalsContact CA-O 3.27Å; K254-L324 WeakPolarHBondContact CA-O 3.47Å; H255-L324 HydrophobicContact CB-CB 4.44Å; H255-L324 PolarHBondContact N-O 3.16Å; H255-L324 PolarHBondContact O-N 2.91Å; W257-L324 HydrophobicContact CH2-CB 4.3Å; W257-L324 HydrophobicContact CZ3-CB 4.2Å; V271-L324 HydrophobicContact CG1-CD2 4.34Å; L324-C326 VanDerWaalsContact CD2-SG 3.58Å; L324-V331 HydrophobicContact CD1-CG2 4.18Å; L324-F349 HydrophobicContact CD1-CD2 4.31Å; L324-F349 HydrophobicContact CD1-CE2 3.63Å; L324-F349 HydrophobicContact CD1-CZ 4.15Å; L324-L353 HydrophobicContact CD1-CD1 3.75Å; L324-L353 HydrophobicContact CD2-CB 4.26Å; L324-L353 HydrophobicContact CD2-CD1 4.4Å
325	D	97.9	Very high	95.5	Very high	9 Å²	9	45.2 Å²	45.2	5%	0.048	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	89.4	171.7	-172.6	-14.7	0	0	0	106.9	K254 D327 K328 G329 R330	K254-D325 WeakPolarHBondContact CE-OD1 3.48Å; K254-D325 WeakPolarHBondContact CE-OD2 3.38Å; K254-D325 HydrophobicContact CG-CB 4.23Å; D325-D327 VanDerWaalsContact C-N 3.35Å; D325-K328 PolarHBondContact O-N 2.85Å; D325-K328 PolarHBondContact OD1-N 3.34Å; D325-G329 PolarHBondContact O-N 3.18Å; D325-R330 HydrophobicContact CB-CB 4.29Å; D325-R330 PolarHBondContact N-O 2.96Å; D325-R330 PolarHBondContact O-N 3.49Å; D325-R330 IonicContact OD2-CZ 2.72Å; D325-R330 IonicContact OD2-NE 2.77Å; D325-R330 IonicContact OD2-NH2 3.32Å; D325-R330 PolarHBondContact OD2-NH2 3.29Å
326	C	96.4	Very high	95.9	Very high	17 Å²	17	40.1 Å²	40.1	12%	0.115	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-47.1	-176	-69.4	0	0	0	0	110.5	G253 L324 K328 G329	G253-C326 WeakPolarHBondContact O-CB 3.44Å; G253-C326 PolarHBondContact O-N 3.28Å; L324-C326 VanDerWaalsContact CD2-SG 3.58Å; C326-K328 PolarHBondContact O-N 3.42Å; C326-G329 PolarHBondContact O-N 2.88Å; C326-G329 VanDerWaalsContact O-N 3.1Å
327	D	95.3	Very high	96.1	Very high	108 Å²	108	40.9 Å²	40.9	58%	0.578	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-28.7	-174.2	-48.3	-36.5	0	0	0	112.7	G253 D325	G253-D327 VanDerWaalsContact CA-OD2 3.26Å; G253-D327 WeakPolarHBondContact CA-OD2 3.44Å; G253-D327 PolarHBondContact N-OD1 3Å; G253-D327 PolarHBondContact N-OD2 3.38Å; D325-D327 VanDerWaalsContact C-N 3.35Å
328	K	96.1	Very high	96.1	Very high	142 Å²	142	45.3 Å²	45.3	62%	0.617	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.3	2.2	177.2	-58.1	-165.3	177.1	-164	0	114.3	D325 C326 R330	D325-K328 PolarHBondContact O-N 2.85Å; D325-K328 PolarHBondContact OD1-N 3.34Å; C326-K328 PolarHBondContact O-N 3.42Å; K328-R330 HydrophobicContact CB-CG 4.36Å; K328-R330 WeakPolarHBondContact O-CG 3.44Å
329	G	96.8	Very high	96.1	Very high	8 Å²	8	43.4 Å²	43.4	8%	0.082	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	47.5	178	0	0	0	0	0	114	D325 C326 K346 D347 F349	D325-G329 PolarHBondContact O-N 3.18Å; C326-G329 PolarHBondContact O-N 2.88Å; C326-G329 VanDerWaalsContact O-N 3.1Å; G329-K346 CarbonylContact O-C 3.56Å; G329-K346 WeakPolarHBondContact O-CA 3.47Å; G329-D347 CarbonylContact C-O 3.31Å; G329-D347 WeakPolarHBondContact CA-O 3.42Å; G329-D347 PolarHBondContact O-N 3.28Å; G329-D347 VanDerWaalsContact O-O 3.05Å; G329-F349 VanDerWaalsContact C-CE2 3.46Å
330	R	97.8	Very high	96	Very high	86 Å²	86	40.6 Å²	40.6	33%	0.325	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	145.6	-176.3	-51	-177.2	-65.5	150.2	2.8	113.8	D325 K328 F345 K346 F349	D325-R330 HydrophobicContact CB-CB 4.29Å; D325-R330 PolarHBondContact N-O 2.96Å; D325-R330 PolarHBondContact O-N 3.49Å; D325-R330 IonicContact OD2-CZ 2.72Å; D325-R330 IonicContact OD2-NE 2.77Å; D325-R330 IonicContact OD2-NH2 3.32Å; D325-R330 PolarHBondContact OD2-NH2 3.29Å; K328-R330 HydrophobicContact CB-CG 4.36Å; K328-R330 WeakPolarHBondContact O-CG 3.44Å; R330-F345 WeakPolarHBondContact CA-O 3.35Å; R330-K346 HydrophobicContact CG-CG 4.39Å; R330-F349 VanDerWaalsContact N-CE2 3.34Å
331	V	98.4	Very high	96	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	108.3	164.8	-163.3	0	0	0	0	107.9	V271 W291 V322 Q323 L324 F333 T344 F345 F349	V271-V331 HydrophobicContact CG2-CG1 4.27Å; V271-V331 HydrophobicContact CG2-CG2 3.64Å; W291-V331 HydrophobicContact CB-CB 4.4Å; W291-V331 HydrophobicContact CB-CG2 3.73Å; W291-V331 HydrophobicContact CG-CG2 4.27Å; V322-V331 HydrophobicContact CG1-CG1 3.82Å; Q323-V331 WeakPolarHBondContact O-CA 3.48Å; L324-V331 HydrophobicContact CD1-CG2 4.18Å; V331-F333 HydrophobicContact CB-CE2 4.16Å; V331-F333 HydrophobicContact CG1-CD2 4.31Å; V331-F333 HydrophobicContact CG1-CE2 3.55Å; V331-F333 HydrophobicContact CG1-CZ 3.77Å; V331-T344 CarbonylContact O-C 3.57Å; V331-T344 WeakPolarHBondContact O-CA 3.32Å; V331-F345 HydrophobicContact CB-CB 4.31Å; V331-F345 PolarHBondContact N-O 3.21Å; V331-F345 VanDerWaalsContact N-O 3.09Å; V331-F345 PolarHBondContact O-N 3.21Å; V331-F349 HydrophobicContact CG2-CE1 4.38Å; V331-F349 HydrophobicContact CG2-CZ 3.72Å
332	V	98.3	Very high	96	Very high	14 Å²	14	45.6 Å²	45.6	9%	0.085	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	135.6	178.5	-177.3	0	0	0	0	108.6	Q323 T334 V341 T344	Q323-V332 HydrophobicContact CB-CB 4.23Å; Q323-V332 PolarHBondContact N-O 3.33Å; Q323-V332 PolarHBondContact O-N 2.87Å; V332-T334 HydrophobicContact CG1-CG2 4.02Å; V332-V341 HydrophobicContact CG1-CG1 4.1Å; V332-V341 HydrophobicContact CG1-CG2 4.33Å; V332-T344 HydrophobicContact CG2-CG2 3.92Å
333	F	98.1	Very high	95.9	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	125.3	175.7	-67.2	-91.8	0	0	0	109.4	V269 M293 L320 T321 V322 V331 I342 Y343 F345	V269-F333 WeakPolarHBondContact O-CE1 3.32Å; M293-F333 HydrophobicContact CG-CB 4.33Å; M293-F333 HydrophobicContact CG-CD1 3.57Å; M293-F333 HydrophobicContact CG-CD2 4.04Å; M293-F333 HydrophobicContact CG-CE1 3.7Å; M293-F333 HydrophobicContact CG-CE2 4.18Å; M293-F333 HydrophobicContact CG-CG 3.72Å; M293-F333 HydrophobicContact CG-CZ 4Å; M293-F333 HydrophobicContact SD-CB 3.39Å; M293-F333 WeakPolarHBondContact SD-CB 3.36Å; M293-F333 HydrophobicContact SD-CD1 3.78Å; M293-F333 HydrophobicContact SD-CD2 3.93Å; M293-F333 HydrophobicContact SD-CE1 4.49Å; M293-F333 HydrophobicContact SD-CG 3.43Å; M293-F333 WeakPolarHBondContact SD-CG 3.48Å; L320-F333 HydrophobicContact CD2-CD1 3.69Å; L320-F333 HydrophobicContact CD2-CE1 4.29Å; L320-F333 HydrophobicContact CG-CD1 4.31Å; T321-F333 WeakPolarHBondContact O-CA 3.41Å; V322-F333 HydrophobicContact CB-CD1 4.41Å; V322-F333 HydrophobicContact CB-CE1 4.26Å; V322-F333 HydrophobicContact CG1-CD1 4.24Å; V322-F333 HydrophobicContact CG1-CE1 3.78Å; V322-F333 HydrophobicContact CG1-CZ 4.14Å; V322-F333 HydrophobicContact CG2-CD1 3.87Å; V322-F333 HydrophobicContact CG2-CE1 3.66Å; V331-F333 HydrophobicContact CB-CE2 4.16Å; V331-F333 HydrophobicContact CG1-CD2 4.31Å; V331-F333 HydrophobicContact CG1-CE2 3.55Å; V331-F333 HydrophobicContact CG1-CZ 3.77Å; F333-I342 PolarHBondContact O-N 3.29Å; F333-Y343 PolarHBondContact N-O 2.79Å; F333-Y343 PolarHBondContact O-N 3.49Å; F333-F345 HydrophobicContact CD2-CD2 4.28Å; F333-F345 HydrophobicContact CD2-CE2 4.34Å; F333-F345 AromaticContact CE2-CD2 3.71Å; F333-F345 HydrophobicContact CE2-CD2 3.71Å; F333-F345 AromaticContact CE2-CE2 3.7Å; F333-F345 HydrophobicContact CE2-CE2 3.7Å
334	T	96.6	Very high	95.9	Very high	13 Å²	13	46.1 Å²	46.1	8%	0.08	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	151	178.6	70.1	0	0	0	0	112.3	T321 V332 A340 V341	T321-T334 PolarHBondContact N-O 3.41Å; T321-T334 PolarHBondContact O-N 2.82Å; V332-T334 HydrophobicContact CG1-CG2 4.02Å; T334-A340 CarbonylContact C-O 3.56Å; T334-A340 WeakPolarHBondContact CA-O 3.22Å; T334-A340 WeakPolarHBondContact CB-O 3.22Å; T334-V341 HydrophobicContact CG2-CG2 4.11Å
335	N	94.6	Very high	95.9	Very high	10 Å²	10	46.5 Å²	46.5	5%	0.053	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	124.7	167.3	173	19.4	0	0	0	108.3	P317 A337 D338 S339 A340 I342	P317-N335 HydrophobicContact CB-CB 4.31Å; N335-A337 PolarHBondContact O-N 2.89Å; N335-A337 PolarHBondContact OD1-N 2.92Å; N335-A337 VanDerWaalsContact OD1-N 3.16Å; N335-D338 VanDerWaalsContact CB-OD1 3.23Å; N335-D338 WeakPolarHBondContact CB-OD1 3.43Å; N335-D338 PolarHBondContact ND2-OD1 3.3Å; N335-D338 PolarHBondContact ND2-OD2 3.46Å; N335-S339 WeakPolarHBondContact O-CA 3.26Å; N335-S339 PolarHBondContact O-N 3.12Å; N335-A340 PolarHBondContact N-O 2.88Å; N335-I342 HydrophobicContact CB-CD1 3.9Å; N335-I342 HydrophobicContact CB-CG1 4.28Å
336	A	93.5	Very high	95.9	Very high	25 Å²	25	54.1 Å²	54.1	21%	0.207	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-3.8	-176.9	0	0	0	0	0	114	T258 R319	T258-A336 HydrophobicContact CG2-CB 3.66Å; R319-A336 HydrophobicContact CB-CB 3.82Å; R319-A336 WeakPolarHBondContact O-CB 3.34Å; R319-A336 PolarHBondContact O-N 3.29Å
337	A	91.9	Very high	95.9	Very high	82 Å²	82	56.6 Å²	56.6	68%	0.678	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-40.8	176	0	0	0	0	0	113.4	N335	N335-A337 PolarHBondContact O-N 2.89Å; N335-A337 PolarHBondContact OD1-N 2.92Å; N335-A337 VanDerWaalsContact OD1-N 3.16Å
338	D	91.9	Very high	95.8	Very high	99 Å²	99	59.5 Å²	59.5	53%	0.529	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121	-2.5	-175.2	59.8	13	0	0	0	113.5	N335 A340	N335-D338 VanDerWaalsContact CB-OD1 3.23Å; N335-D338 WeakPolarHBondContact CB-OD1 3.43Å; N335-D338 PolarHBondContact ND2-OD1 3.3Å; N335-D338 PolarHBondContact ND2-OD2 3.46Å; D338-A340 PolarHBondContact O-N 2.89Å; D338-A340 WeakPolarHBondContact OD1-CB 3.38Å; D338-A340 PolarHBondContact OD1-N 3.49Å
339	S	91.8	Very high	95.8	Very high	93 Å²	93	54.5 Å²	54.5	65%	0.65	30%	0.299	S	S	*	.			trans	60.5	14.2	-172	-55.3	0	0	0	0	115.2	N335	N335-S339 WeakPolarHBondContact O-CA 3.26Å; N335-S339 PolarHBondContact O-N 3.12Å
340	A	93.9	Very high	95.5	Very high	47 Å²	47	59.6 Å²	59.6	39%	0.388	33%	0.329	S	S	.	.			trans	-66.5	134.2	179	0	0	0	0	0	111.1	T334 N335 D338 I342	T334-A340 CarbonylContact C-O 3.56Å; T334-A340 WeakPolarHBondContact CA-O 3.22Å; T334-A340 WeakPolarHBondContact CB-O 3.22Å; N335-A340 PolarHBondContact N-O 2.88Å; D338-A340 PolarHBondContact O-N 2.89Å; D338-A340 WeakPolarHBondContact OD1-CB 3.38Å; D338-A340 PolarHBondContact OD1-N 3.49Å; A340-I342 PolarHBondContact O-N 3.09Å
341	V	96	Very high	95.4	Very high	94 Å²	94	58.6 Å²	58.6	57%	0.57	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	118.6	173.6	-179.6	0	0	0	0	109.1	V332 T334	V332-V341 HydrophobicContact CG1-CG1 4.1Å; V332-V341 HydrophobicContact CG1-CG2 4.33Å; T334-V341 HydrophobicContact CG2-CG2 4.11Å
342	I	95.8	Very high	95.3	Very high	23 Å²	23	61.6 Å²	61.6	12%	0.118	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-46.1	176.6	-62.6	159.8	0	0	0	109.8	M293 L301 V311 V313 P317 L320 F333 N335 A340	M293-I342 HydrophobicContact CE-CG2 3.65Å; M293-I342 HydrophobicContact SD-CG2 4.2Å; L301-I342 HydrophobicContact CD2-CG2 3.79Å; V311-I342 HydrophobicContact CG1-CG2 3.58Å; V311-I342 VanDerWaalsContact CG1-O 3.29Å; V311-I342 WeakPolarHBondContact CG1-O 3.47Å; V313-I342 HydrophobicContact CG1-CG1 4.16Å; V313-I342 HydrophobicContact CG1-CG2 3.74Å; P317-I342 HydrophobicContact CB-CD1 4.17Å; P317-I342 HydrophobicContact CG-CD1 4.01Å; L320-I342 HydrophobicContact CD1-CD1 3.31Å; F333-I342 PolarHBondContact O-N 3.29Å; N335-I342 HydrophobicContact CB-CD1 3.9Å; N335-I342 HydrophobicContact CB-CG1 4.28Å; A340-I342 PolarHBondContact O-N 3.09Å
343	Y	97.1	Very high	95.3	Very high	52 Å²	52	61 Å²	61	20%	0.204	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	163.3	178.6	-161.1	-103	0	0	0	112.3	A303 T305 T309 V311 F333 F345	A303-Y343 HydrophobicContact CB-CD1 3.62Å; A303-Y343 HydrophobicContact CB-CD2 3.88Å; A303-Y343 HydrophobicContact CB-CE1 3.54Å; A303-Y343 HydrophobicContact CB-CE2 3.8Å; A303-Y343 HydrophobicContact CB-CG 3.8Å; T305-Y343 WeakPolarHBondContact CG2-OH 3.26Å; T309-Y343 HydrophobicContact CG2-CE2 4.16Å; V311-Y343 HydrophobicContact CG2-CD2 3.91Å; V311-Y343 HydrophobicContact CG2-CG 4.47Å; F333-Y343 PolarHBondContact N-O 2.79Å; F333-Y343 PolarHBondContact O-N 3.49Å; Y343-F345 AromaticContact CD1-CD2 3.62Å; Y343-F345 HydrophobicContact CD1-CD2 3.62Å; Y343-F345 AromaticContact CD1-CE2 3.54Å; Y343-F345 HydrophobicContact CD1-CE2 3.54Å; Y343-F345 HydrophobicContact CD1-CG 4.28Å; Y343-F345 HydrophobicContact CD1-CZ 4.13Å; Y343-F345 HydrophobicContact CE1-CD1 4.07Å; Y343-F345 AromaticContact CE1-CD2 3.69Å; Y343-F345 HydrophobicContact CE1-CD2 3.69Å; Y343-F345 HydrophobicContact CE1-CE1 4.05Å; Y343-F345 AromaticContact CE1-CE2 3.66Å; Y343-F345 HydrophobicContact CE1-CE2 3.66Å; Y343-F345 AromaticContact CE1-CG 3.91Å; Y343-F345 HydrophobicContact CE1-CG 3.91Å; Y343-F345 AromaticContact CE1-CZ 3.85Å; Y343-F345 HydrophobicContact CE1-CZ 3.85Å
344	T	97.9	Very high	95.4	Very high	45 Å²	45	62.2 Å²	62.2	28%	0.276	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	117.2	171.8	-64.9	0	0	0	0	110.6	V331 V332 K346	V331-T344 CarbonylContact O-C 3.57Å; V331-T344 WeakPolarHBondContact O-CA 3.32Å; V332-T344 HydrophobicContact CG2-CG2 3.92Å; T344-K346 HydrophobicContact CG2-CG 4.27Å
345	F	98.1	Very high	95.4	Very high	9 Å²	9	61.6 Å²	61.6	4%	0.039	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	146.3	163.4	-64.9	-98.9	0	0	0	109.8	P286 W291 V292 A303 T305 R330 V331 F333 Y343	P286-F345 HydrophobicContact CG-CD1 4.21Å; P286-F345 HydrophobicContact CG-CE1 4.22Å; W291-F345 HydrophobicContact CB-CB 4.36Å; W291-F345 HydrophobicContact CB-CD1 4.33Å; W291-F345 HydrophobicContact CB-CD2 4.3Å; W291-F345 HydrophobicContact CB-CG 4.1Å; W291-F345 AromaticContact CD1-CD1 3.83Å; W291-F345 HydrophobicContact CG-CB 4.49Å; W291-F345 HydrophobicContact CG-CD1 4.49Å; W291-F345 HydrophobicContact CG-CG 4.5Å; V292-F345 WeakPolarHBondContact O-CZ 3.36Å; A303-F345 HydrophobicContact CB-CE2 4.35Å; A303-F345 HydrophobicContact CB-CZ 3.96Å; T305-F345 HydrophobicContact CG2-CD1 4.33Å; T305-F345 HydrophobicContact CG2-CE1 3.77Å; R330-F345 WeakPolarHBondContact CA-O 3.35Å; V331-F345 HydrophobicContact CB-CB 4.31Å; V331-F345 PolarHBondContact N-O 3.21Å; V331-F345 VanDerWaalsContact N-O 3.09Å; V331-F345 PolarHBondContact O-N 3.21Å; F333-F345 HydrophobicContact CD2-CD2 4.28Å; F333-F345 HydrophobicContact CD2-CE2 4.34Å; F333-F345 AromaticContact CE2-CD2 3.71Å; F333-F345 HydrophobicContact CE2-CD2 3.71Å; F333-F345 AromaticContact CE2-CE2 3.7Å; F333-F345 HydrophobicContact CE2-CE2 3.7Å; Y343-F345 AromaticContact CD1-CD2 3.62Å; Y343-F345 HydrophobicContact CD1-CD2 3.62Å; Y343-F345 AromaticContact CD1-CE2 3.54Å; Y343-F345 HydrophobicContact CD1-CE2 3.54Å; Y343-F345 HydrophobicContact CD1-CG 4.28Å; Y343-F345 HydrophobicContact CD1-CZ 4.13Å; Y343-F345 HydrophobicContact CE1-CD1 4.07Å; Y343-F345 AromaticContact CE1-CD2 3.69Å; Y343-F345 HydrophobicContact CE1-CD2 3.69Å; Y343-F345 HydrophobicContact CE1-CE1 4.05Å; Y343-F345 AromaticContact CE1-CE2 3.66Å; Y343-F345 HydrophobicContact CE1-CE2 3.66Å; Y343-F345 AromaticContact CE1-CG 3.91Å; Y343-F345 HydrophobicContact CE1-CG 3.91Å; Y343-F345 AromaticContact CE1-CZ 3.85Å; Y343-F345 HydrophobicContact CE1-CZ 3.85Å
346	K	97.1	Very high	95.6	Very high	170 Å²	170	61.1 Å²	61.1	74%	0.739	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.1	128.5	168.8	-58.5	179.9	-174.4	173.8	0	107.6	G329 R330 T344	G329-K346 CarbonylContact O-C 3.56Å; G329-K346 WeakPolarHBondContact O-CA 3.47Å; R330-K346 HydrophobicContact CG-CG 4.39Å; T344-K346 HydrophobicContact CG2-CG 4.27Å
347	D	96.3	Very high	95.8	Very high	68 Å²	68	60 Å²	60	36%	0.364	33%	0.327	S	S	.	.			trans	-159.7	169.5	-176.6	-146.5	-34.9	0	0	0	111	W291 G329 F349	W291-D347 HydrophobicContact CZ2-CB 4.31Å; W291-D347 PolarHBondContact NE1-OD2 2.83Å; G329-D347 CarbonylContact C-O 3.31Å; G329-D347 WeakPolarHBondContact CA-O 3.42Å; G329-D347 PolarHBondContact O-N 3.28Å; G329-D347 VanDerWaalsContact O-O 3.05Å; D347-F349 HydrophobicContact CB-CD1 4.28Å; D347-F349 HydrophobicContact CB-CE1 3.89Å
348	K	94	Very high	96	Very high	169 Å²	169	56.6 Å²	56.6	74%	0.735	30%	0.298	S	S	*	.			trans	-98.4	98.3	172.6	-173.6	-176	178.3	-176.4	0	110	T350	K348-T350 HydrophobicContact CD-CG2 4.47Å; K348-T350 HydrophobicContact CG-CG2 4.33Å; K348-T350 PolarHBondContact O-N 3.44Å
349	F	95.3	Very high	95.9	Very high	37 Å²	37	52.3 Å²	52.3	16%	0.162	28%	0.276	C	S	.	.			trans	-70.7	122.6	174.4	-46.2	-39.8	0	0	0	110.4	W291 L324 G329 R330 V331 D347 L353	W291-F349 HydrophobicContact CD2-CE1 4.05Å; W291-F349 AromaticContact CE2-CE1 3.86Å; W291-F349 HydrophobicContact CG-CE1 4.42Å; W291-F349 HydrophobicContact CH2-CD1 4.23Å; W291-F349 HydrophobicContact CZ2-CD1 4.02Å; W291-F349 HydrophobicContact CZ2-CE1 4.15Å; L324-F349 HydrophobicContact CD1-CD2 4.31Å; L324-F349 HydrophobicContact CD1-CE2 3.63Å; L324-F349 HydrophobicContact CD1-CZ 4.15Å; G329-F349 VanDerWaalsContact C-CE2 3.46Å; R330-F349 VanDerWaalsContact N-CE2 3.34Å; V331-F349 HydrophobicContact CG2-CE1 4.38Å; V331-F349 HydrophobicContact CG2-CZ 3.72Å; D347-F349 HydrophobicContact CB-CD1 4.28Å; D347-F349 HydrophobicContact CB-CE1 3.89Å; F349-L353 HydrophobicContact CB-CD1 4.09Å; F349-L353 HydrophobicContact CD1-CD1 3.7Å; F349-L353 HydrophobicContact CD2-CD1 3.63Å; F349-L353 HydrophobicContact CE1-CD1 3.97Å; F349-L353 HydrophobicContact CE2-CD1 3.9Å; F349-L353 HydrophobicContact CG-CD1 3.53Å; F349-L353 HydrophobicContact CG-CG 4.43Å; F349-L353 HydrophobicContact CZ-CD1 4.07Å
350	T	91.6	Very high	95.5	Very high	116 Å²	116	48.5 Å²	48.5	71%	0.712	25%	0.251	S	S	*	.			trans	-112.8	-6.9	-177.9	54.5	0	0	0	0	114	K348	K348-T350 HydrophobicContact CD-CG2 4.47Å; K348-T350 HydrophobicContact CG-CG2 4.33Å; K348-T350 PolarHBondContact O-N 3.44Å
351	E	94.9	Very high	94.6	Very high	64 Å²	64	52.3 Å²	52.3	30%	0.299	26%	0.264	S	S	.	.	S	Bend	trans	-144.3	176.3	-178.8	62.1	173.2	-111.4	0	0	110.6	R273 E274 S275	R273-E351 HydrophobicContact CB-CG 3.96Å; R273-E351 WeakPolarHBondContact CB-OE1 3.36Å; R273-E351 VanDerWaalsContact CG-OE1 3.3Å; R273-E351 WeakPolarHBondContact CG-OE1 3.26Å; E274-E351 WeakPolarHBondContact CA-OE1 3.33Å; E274-E351 PolarHBondContact N-OE1 3.18Å; S275-E351 WeakPolarHBondContact CB-OE1 3.4Å; S275-E351 PolarHBondContact N-OE1 2.94Å; S275-E351 VanDerWaalsContact OG-CD 3.27Å; S275-E351 PolarHBondContact OG-OE1 3.24Å; S275-E351 PolarHBondContact OG-OE2 3.27Å
352	K	97.6	Very high	93.3	Very high	63 Å²	63	49.9 Å²	49.9	27%	0.274	25%	0.251	S	S	.	.			trans	-63.2	134.4	-179.3	-167.6	-172.9	-58.8	104.7	0	110.9	F250 T251 E274 F354	F250-K352 WeakPolarHBondContact O-CA 3.5Å; T251-K352 HydrophobicContact CG2-CB 3.9Å; T251-K352 HydrophobicContact CG2-CG 4.02Å; E274-K352 HydrophobicContact CB-CB 4.28Å; E274-K352 PolarHBondContact N-O 3.1Å; E274-K352 IonicContact OE1-NZ 2.83Å; E274-K352 PolarHBondContact OE1-NZ 2.82Å; E274-K352 WeakPolarHBondContact OE2-CB 3.22Å; E274-K352 IonicContact OE2-NZ 3.01Å; E274-K352 PolarHBondContact OE2-NZ 3.33Å; K352-F354 HydrophobicContact CD-CE1 4.23Å; K352-F354 HydrophobicContact CD-CE2 3.83Å; K352-F354 HydrophobicContact CD-CZ 3.57Å; K352-F354 HydrophobicContact CG-CE2 4.2Å; K352-F354 HydrophobicContact CG-CZ 4.38Å
353	L	98.3	Very high	92	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.01	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	129.8	176.7	-62.9	-174	0	0	0	111.1	G249 F250 V271 R273 W291 L324 F349	G249-L353 CarbonylContact C-O 3.6Å; G249-L353 VanDerWaalsContact CA-O 3.26Å; G249-L353 WeakPolarHBondContact CA-O 3.42Å; F250-L353 PolarHBondContact N-O 2.95Å; F250-L353 PolarHBondContact O-N 3.46Å; V271-L353 HydrophobicContact CB-CB 4.44Å; V271-L353 HydrophobicContact CG2-CD1 4.18Å; R273-L353 HydrophobicContact CB-CD2 4.02Å; W291-L353 HydrophobicContact CE3-CD2 4.13Å; W291-L353 HydrophobicContact CH2-CD2 4.1Å; W291-L353 HydrophobicContact CZ3-CD2 3.44Å; W291-L353 VanDerWaalsContact CZ3-CD2 3.44Å; L324-L353 HydrophobicContact CD1-CD1 3.75Å; L324-L353 HydrophobicContact CD2-CB 4.26Å; L324-L353 HydrophobicContact CD2-CD1 4.4Å; F349-L353 HydrophobicContact CB-CD1 4.09Å; F349-L353 HydrophobicContact CD1-CD1 3.7Å; F349-L353 HydrophobicContact CD2-CD1 3.63Å; F349-L353 HydrophobicContact CE1-CD1 3.97Å; F349-L353 HydrophobicContact CE2-CD1 3.9Å; F349-L353 HydrophobicContact CG-CD1 3.53Å; F349-L353 HydrophobicContact CG-CG 4.43Å; F349-L353 HydrophobicContact CZ-CD1 4.07Å
354	F	98.5	Very high	91	Very high	25 Å²	25	59.3 Å²	59.3	11%	0.11	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	143	174.9	-66.9	-90.2	0	0	0	110.7	L245 G246 G249 V271 A272 E274 K352 Y356	L245-F354 HydrophobicContact CB-CB 4.19Å; L245-F354 HydrophobicContact CD1-CB 4.37Å; L245-F354 HydrophobicContact CD1-CG 4.49Å; L245-F354 HydrophobicContact CD2-CB 4.46Å; G246-F354 WeakPolarHBondContact O-CD1 3.41Å; G249-F354 VanDerWaalsContact CA-CD1 3.44Å; V271-F354 CarbonylContact C-O 3.6Å; V271-F354 VanDerWaalsContact CA-O 3.23Å; V271-F354 WeakPolarHBondContact CA-O 3.33Å; V271-F354 WeakPolarHBondContact CB-O 3.5Å; A272-F354 PolarHBondContact N-O 3.21Å; A272-F354 PolarHBondContact O-N 3.46Å; E274-F354 HydrophobicContact CB-CD2 4.35Å; E274-F354 HydrophobicContact CB-CE2 3.81Å; E274-F354 HydrophobicContact CG-CE2 3.83Å; E274-F354 WeakPolarHBondContact OE1-CE2 3.34Å; E274-F354 WeakPolarHBondContact OE1-CZ 3.39Å; K352-F354 HydrophobicContact CD-CE1 4.23Å; K352-F354 HydrophobicContact CD-CE2 3.83Å; K352-F354 HydrophobicContact CD-CZ 3.57Å; K352-F354 HydrophobicContact CG-CE2 4.2Å; K352-F354 HydrophobicContact CG-CZ 4.38Å; F354-Y356 PolarHBondContact O-N 2.9Å
355	P	98.4	Very high	89.9	Confident	1 Å²	1	62 Å²	62	1%	0.006	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.2	133.7	161.6	-27.3	37	0	0	0	110.5	V203 L245 G246 T248 F250 W257 F357	V203-P355 HydrophobicContact CG1-CB 3.8Å; V203-P355 HydrophobicContact CG1-CG 3.89Å; V203-P355 HydrophobicContact CG2-CB 4.15Å; V203-P355 HydrophobicContact CG2-CG 3.72Å; L245-P355 CarbonylContact C-O 3.58Å; L245-P355 VanDerWaalsContact CA-O 3.29Å; L245-P355 WeakPolarHBondContact CA-O 3.3Å; G246-P355 PolarHBondContact N-O 3.08Å; T248-P355 VanDerWaalsContact O-CD 3.29Å; T248-P355 WeakPolarHBondContact O-CD 3.42Å; F250-P355 HydrophobicContact CE2-CG 3.8Å; W257-P355 HydrophobicContact CH2-CB 4.35Å; W257-P355 HydrophobicContact CH2-CG 4.1Å; W257-P355 HydrophobicContact CZ2-CB 3.82Å; W257-P355 HydrophobicContact CZ2-CG 4.05Å; W257-P355 HydrophobicContact CZ3-CG 4.41Å; P355-F357 HydrophobicContact CB-CE2 3.68Å; P355-F357 HydrophobicContact CB-CZ 4.37Å
356	Y	98.3	Very high	88.6	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	133.2	-177.9	178.2	-85.1	0	0	0	110	C243 L245 F268 V269 G270 A272 Y290 V292 F354	C243-Y356 HydrophobicContact CB-CE1 4.32Å; C243-Y356 HydrophobicContact CB-CE2 3.68Å; C243-Y356 VanDerWaalsContact CB-OH 3.32Å; C243-Y356 WeakPolarHBondContact CB-OH 3.32Å; L245-Y356 HydrophobicContact CD2-CD2 3.76Å; F268-Y356 HydrophobicContact CB-CE1 4.31Å; V269-Y356 VanDerWaalsContact CA-O 3.28Å; V269-Y356 WeakPolarHBondContact CA-O 3.27Å; G270-Y356 PolarHBondContact N-O 3.5Å; G270-Y356 VanDerWaalsContact N-O 3.12Å; G270-Y356 PolarHBondContact O-N 2.79Å; A272-Y356 HydrophobicContact CB-CD2 3.72Å; A272-Y356 HydrophobicContact CB-CG 4.2Å; Y290-Y356 HydrophobicContact CD1-CD2 4.26Å; Y290-Y356 HydrophobicContact CD1-CE2 4.05Å; Y290-Y356 HydrophobicContact CE1-CD2 4.26Å; Y290-Y356 AromaticContact CE1-CE2 3.77Å; Y290-Y356 HydrophobicContact CE1-CE2 3.77Å; V292-Y356 HydrophobicContact CB-CD1 4.48Å; V292-Y356 HydrophobicContact CG1-CD1 3.61Å; V292-Y356 HydrophobicContact CG1-CE1 4.25Å; V292-Y356 HydrophobicContact CG1-CG 4.01Å; F354-Y356 PolarHBondContact O-N 2.9Å
357	F	97.7	Very high	87.4	Confident	1 Å²	1	66.5 Å²	66.5	0%	0.004	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	133.2	176.9	-56.9	-103.7	0	0	0	109.6	V203 L205 V223 C243 V244 W257 V259 F268 V269 P355 V373	V203-F357 HydrophobicContact CG1-CE2 3.92Å; V203-F357 HydrophobicContact CG1-CZ 4.08Å; L205-F357 HydrophobicContact CD2-CD2 3.35Å; L205-F357 HydrophobicContact CD2-CE2 3.36Å; L205-F357 HydrophobicContact CD2-CG 4.03Å; L205-F357 HydrophobicContact CD2-CZ 4.03Å; V223-F357 HydrophobicContact CG1-CB 4.17Å; C243-F357 CarbonylContact C-O 3.23Å; C243-F357 WeakPolarHBondContact CA-O 3.43Å; C243-F357 WeakPolarHBondContact CB-O 3.22Å; V244-F357 HydrophobicContact CG1-CB 4Å; V244-F357 PolarHBondContact N-O 2.85Å; V244-F357 PolarHBondContact O-N 3.48Å; W257-F357 AromaticContact NE1-CZ 3.84Å; V259-F357 HydrophobicContact CB-CE1 4.49Å; V259-F357 HydrophobicContact CG1-CD1 4.27Å; V259-F357 HydrophobicContact CG1-CE1 3.97Å; V259-F357 HydrophobicContact CG2-CD1 4.49Å; V259-F357 HydrophobicContact CG2-CE1 3.63Å; V259-F357 HydrophobicContact CG2-CZ 4.36Å; F268-F357 CarbonylContact O-C 3.55Å; V269-F357 HydrophobicContact CG1-CD1 3.98Å; P355-F357 HydrophobicContact CB-CE2 3.68Å; P355-F357 HydrophobicContact CB-CZ 4.37Å; F357-V373 HydrophobicContact CE1-CG2 3.8Å; F357-V373 HydrophobicContact CZ-CG2 3.67Å
358	S	94.8	Very high	86.7	Confident	11 Å²	11	63.8 Å²	63.8	8%	0.077	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	128.6	174.7	-166.9	0	0	0	0	109.5	M242 W267 F268 L371	M242-S358 VanDerWaalsContact O-CA 3.29Å; M242-S358 WeakPolarHBondContact O-CA 3.3Å; M242-S358 WeakPolarHBondContact O-CB 3.33Å; M242-S358 PolarHBondContact O-OG 3.38Å; W267-S358 CarbonylContact C-O 3.59Å; W267-S358 VanDerWaalsContact CA-O 3.28Å; W267-S358 WeakPolarHBondContact CA-O 3.43Å; F268-S358 PolarHBondContact N-O 2.86Å; F268-S358 PolarHBondContact O-N 3.36Å; S358-L371 WeakPolarHBondContact O-CD1 3.35Å
359	V	91.4	Very high	86.4	Confident	9 Å²	9	57.7 Å²	57.7	6%	0.055	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	148	169.7	-68	0	0	0	0	109.6	L214 M242 L371	L214-V359 HydrophobicContact CD2-CG2 3.29Å; M242-V359 PolarHBondContact O-N 2.84Å; V359-L371 HydrophobicContact CG1-CD1 3.68Å; V359-L371 HydrophobicContact CG1-CG 3.79Å
360	G	81.8	Confident	86.2	Confident	12 Å²	12	58.2 Å²	58.2	12%	0.124	30%	0.301	C	S	.	.			trans	-69.7	174.2	171.3	0	0	0	0	0	113.8	D266	D266-G360 WeakPolarHBondContact O-CA 3.25Å; D266-G360 PolarHBondContact O-N 2.94Å; D266-G360 WeakPolarHBondContact OD2-CA 3.14Å
361	L	75.6	Confident	86.4	Confident	127 Å²	127	52.7 Å²	52.7	67%	0.665	27%	0.267	S	S	*	.			trans	-68.6	139.3	169.9	-81	166.5	0	0	0	110.6	Y225 M242	Y225-L361 HydrophobicContact CE2-CD2 4.33Å; M242-L361 HydrophobicContact CE-CD1 4.48Å; M242-L361 HydrophobicContact CE-CD2 3.7Å; M242-L361 HydrophobicContact CE-CG 3.81Å; M242-L361 HydrophobicContact SD-CD2 3.74Å; M242-L361 HydrophobicContact SD-CG 4.32Å
362	C	69.3	Low	86.5	Confident	43 Å²	43	50.2 Å²	50.2	29%	0.291	26%	0.257	S	S	.	.			trans	-131.3	124.5	172.6	-159.9	0	0	0	0	109.6	Y225 D364	Y225-C362 HydrophobicContact CD1-CB 3.87Å; Y225-C362 HydrophobicContact CE1-CB 4.49Å; Y225-C362 WeakPolarHBondContact CE1-O 3.12Å; Y225-C362 HydrophobicContact CG-CB 4.46Å; C362-D364 VanDerWaalsContact C-N 3.32Å; C362-D364 PolarHBondContact O-N 3.43Å; C362-D364 PolarHBondContact SG-O 2.85Å; C362-D364 VanDerWaalsContact SG-O 3.37Å
363	E	67.7	Low	86.4	Confident	207 Å²	207	47.3 Å²	47.3	97%	0.967	24%	0.244	S	C	*	.	S	Bend	trans	-66.2	-36.4	-179.3	-62.5	179.2	155.5	0	0	111.5
364	D	76.9	Confident	86.2	Confident	67 Å²	67	47.9 Å²	47.9	36%	0.358	25%	0.248	S	C	.	.			trans	-108.6	93.6	170	-177.9	7	0	0	0	111	C362 K366 N367 S368	C362-D364 VanDerWaalsContact C-N 3.32Å; C362-D364 PolarHBondContact O-N 3.43Å; C362-D364 PolarHBondContact SG-O 2.85Å; C362-D364 VanDerWaalsContact SG-O 3.37Å; D364-K366 PolarHBondContact O-N 3.42Å; D364-K366 VanDerWaalsContact O-N 3.16Å; D364-K366 VanDerWaalsContact OD1-CB 3.32Å; D364-K366 WeakPolarHBondContact OD1-CB 3.37Å; D364-K366 PolarHBondContact OD1-N 3.32Å; D364-N367 CarbonylContact O-C 3.54Å; D364-N367 PolarHBondContact O-N 2.89Å; D364-N367 VanDerWaalsContact O-N 3.15Å; D364-N367 PolarHBondContact OD2-ND2 3.29Å; D364-S368 PolarHBondContact O-N 3.4Å
365	W	73.8	Confident	85.8	Confident	101 Å²	101	49.5 Å²	49.5	38%	0.383	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-60.1	-23.3	178.6	67.9	-92.2	0	0	0	113.9	Y225 N367 S368	Y225-W365 HydrophobicContact CD1-CB 3.58Å; Y225-W365 HydrophobicContact CE1-CB 3.8Å; W365-N367 VanDerWaalsContact C-N 3.32Å; W365-S368 WeakPolarHBondContact O-CB 3.41Å; W365-S368 PolarHBondContact O-N 3.35Å; W365-S368 PolarHBondContact O-OG 3.48Å
366	K	70.8	Confident	85.1	Confident	148 Å²	148	53.2 Å²	53.2	64%	0.643	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-70.6	-32.4	178.7	-59.8	178.4	178.9	177.5	0	111.9	D364	D364-K366 PolarHBondContact O-N 3.42Å; D364-K366 VanDerWaalsContact O-N 3.16Å; D364-K366 VanDerWaalsContact OD1-CB 3.32Å; D364-K366 WeakPolarHBondContact OD1-CB 3.37Å; D364-K366 PolarHBondContact OD1-N 3.32Å
367	N	73.1	Confident	84.2	Confident	125 Å²	125	57 Å²	57	67%	0.668	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-100.3	16.3	175.7	-73.5	-55.1	0	0	0	112.3	D364 W365	D364-N367 CarbonylContact O-C 3.54Å; D364-N367 PolarHBondContact O-N 2.89Å; D364-N367 VanDerWaalsContact O-N 3.15Å; D364-N367 PolarHBondContact OD2-ND2 3.29Å; W365-N367 VanDerWaalsContact C-N 3.32Å
368	S	80.6	Confident	83.1	Confident	12 Å²	12	60.9 Å²	60.9	8%	0.084	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-70.6	131.8	173.6	68.4	0	0	0	0	110.8	Y225 D364 W365	Y225-S368 PolarHBondContact O-OG 3.25Å; D364-S368 PolarHBondContact O-N 3.4Å; W365-S368 WeakPolarHBondContact O-CB 3.41Å; W365-S368 PolarHBondContact O-N 3.35Å; W365-S368 PolarHBondContact O-OG 3.48Å
369	S	87.4	Confident	81.8	Confident	40 Å²	40	69 Å²	69	28%	0.28	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-80.7	138	177.8	-58	0	0	0	0	110.6	H263 S264	H263-S369 PolarHBondContact O-OG 3.29Å; S264-S369 VanDerWaalsContact OG-CB 3.27Å; S264-S369 WeakPolarHBondContact OG-CB 3.39Å; S264-S369 PolarHBondContact OG-O 3.19Å
370	P	92.7	Very high	80.6	Confident	48 Å²	48	71 Å²	71	31%	0.312	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-75.1	166.6	176.7	30.7	-34.8	0	0	0	112.4	S222 V223 Q224 S264	S222-P370 WeakPolarHBondContact OG-CB 3.4Å; V223-P370 CarbonylContact O-C 3.58Å; V223-P370 VanDerWaalsContact O-CA 3.27Å; V223-P370 WeakPolarHBondContact O-CA 3.32Å; Q224-P370 HydrophobicContact CB-CB 4.19Å; S264-P370 PolarHBondContact OG-O 2.87Å; S264-P370 VanDerWaalsContact OG-O 3.13Å
371	L	95.3	Very high	79.8	Confident	0 Å²	0	76 Å²	76	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117	153.7	-58.5	171.8	0	0	0	107	S222 V223 V259 V261 W267 V269 S358 V359	S222-L371 WeakPolarHBondContact CA-O 3.29Å; V223-L371 HydrophobicContact CG1-CB 4.09Å; V223-L371 PolarHBondContact N-O 3.25Å; V223-L371 PolarHBondContact O-N 3.18Å; V259-L371 HydrophobicContact CG1-CB 4.12Å; V261-L371 HydrophobicContact CB-CD2 4.27Å; V261-L371 HydrophobicContact CG1-CD2 3.98Å; W267-L371 HydrophobicContact CB-CD1 4.02Å; W267-L371 HydrophobicContact CB-CD2 3.82Å; W267-L371 HydrophobicContact CB-CG 4.46Å; W267-L371 HydrophobicContact CG-CD2 4.1Å; V269-L371 HydrophobicContact CG1-CD1 4.11Å; S358-L371 WeakPolarHBondContact O-CD1 3.35Å; V359-L371 HydrophobicContact CG1-CD1 3.68Å; V359-L371 HydrophobicContact CG1-CG 3.79Å
372	T	95.9	Very high	79	Confident	13 Å²	13	74.2 Å²	74.2	8%	0.08	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	128.5	-174.9	-63	0	0	0	0	110.1	Q218 S222 V259 E260 C374	Q218-T372 VanDerWaalsContact OE1-CG2 3.27Å; S222-T372 WeakPolarHBondContact CB-OG1 3.48Å; S222-T372 PolarHBondContact OG-OG1 3.41Å; V259-T372 CarbonylContact C-O 3.57Å; V259-T372 WeakPolarHBondContact CA-O 3.33Å; E260-T372 PolarHBondContact N-O 3.07Å; E260-T372 PolarHBondContact O-N 3Å; T372-C374 PolarHBondContact O-N 2.86Å
373	V	96.9	Very high	78.6	Confident	1 Å²	1	81.3 Å²	81.3	1%	0.006	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	122	170.4	-179.5	0	0	0	0	108.5	A201 V203 T221 W257 T258 F357 A375	A201-V373 HydrophobicContact CB-CB 4.34Å; A201-V373 HydrophobicContact CB-CG1 3.96Å; V203-V373 HydrophobicContact CB-CG1 4.35Å; V203-V373 HydrophobicContact CB-CG2 4.22Å; T221-V373 WeakPolarHBondContact O-CG2 3.46Å; T221-V373 PolarHBondContact O-N 2.93Å; W257-V373 HydrophobicContact CB-CG1 4.44Å; T258-V373 CarbonylContact O-C 3.54Å; T258-V373 WeakPolarHBondContact O-CA 3.31Å; F357-V373 HydrophobicContact CE1-CG2 3.8Å; F357-V373 HydrophobicContact CZ-CG2 3.67Å; V373-A375 PolarHBondContact O-N 3.31Å; V373-A375 VanDerWaalsContact O-N 3.09Å
374	C	93.8	Very high	77.7	Confident	14 Å²	14	81.5 Å²	81.5	10%	0.095	42%	0.422	C	S	.	.			trans	-59.3	116	-177.7	-62.2	0	0	0	0	111.2	T258 E260 T372	T258-C374 HydrophobicContact CG2-CB 4.42Å; T258-C374 VanDerWaalsContact CG2-SG 3.6Å; T258-C374 PolarHBondContact O-N 3.05Å; E260-C374 WeakPolarHBondContact CG-SG 3.28Å; T372-C374 PolarHBondContact O-N 2.86Å
375	A	89.6	Confident	76	Confident	60 Å²	60	86.5 Å²	86.5	50%	0.496	47%	0.473	S	S	.	.			trans	-66.1	138.7	174.6	0	0	0	0	0	111.6	K199 V373	K199-A375 HydrophobicContact CB-CB 4.21Å; K199-A375 HydrophobicContact CD-CB 4.29Å; V373-A375 PolarHBondContact O-N 3.31Å; V373-A375 VanDerWaalsContact O-N 3.09Å
376	Q	84.1	Confident	76.1	Confident	79 Å²	79	85.8 Å²	85.8	37%	0.369	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	151.6	178.2	-58.4	-174	29.8	0	0	110.1	K199 Y200	K199-Q376 WeakPolarHBondContact CA-O 3.49Å; Y200-Q376 HydrophobicContact CD1-CB 4.11Å; Y200-Q376 VanDerWaalsContact CD1-O 3.3Å; Y200-Q376 WeakPolarHBondContact CD1-O 3.3Å; Y200-Q376 HydrophobicContact CE1-CB 3.59Å; Y200-Q376 PolarHBondContact N-O 3.03Å; Y200-Q376 PolarHBondContact O-N 3.13Å; Y200-Q376 PolarHBondContact OH-OE1 3.47Å
377	T	78.9	Confident	76.4	Confident	79 Å²	79	82.5 Å²	82.5	49%	0.485	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	141	174.2	48.2	0	0	0	0	110.8	K199 K379	K199-T377 HydrophobicContact CG-CG2 4.48Å; T377-K379 PolarHBondContact O-N 3.44Å
378	M	74.1	Confident	76.6	Confident	82 Å²	82	80.2 Å²	80.2	40%	0.404	46%	0.458	S	S	.	.			trans	-77.8	108.3	-177	-60.5	-171.3	75.6	0	0	110.9	L195 Y200 V380	L195-M378 HydrophobicContact CB-CB 4.33Å; L195-M378 HydrophobicContact CD2-CE 4.27Å; L195-M378 HydrophobicContact CD2-SD 3.67Å; Y200-M378 HydrophobicContact CD1-CG 3.64Å; Y200-M378 HydrophobicContact CE1-CG 3.84Å; M378-V380 PolarHBondContact O-N 2.84Å
379	K	68.3	Low	76.3	Confident	181 Å²	181	84.2 Å²	84.2	79%	0.787	48%	0.48	S	S	*	.			trans	-84.5	99.1	174.2	-67.2	-175.8	-177.9	178	0	110.1	T377 V381	T377-K379 PolarHBondContact O-N 3.44Å; K379-V381 VanDerWaalsContact C-N 3.32Å; K379-V381 HydrophobicContact CB-CG2 4.48Å; K379-V381 PolarHBondContact O-N 2.95Å
380	V	66.2	Low	75.6	Confident	51 Å²	51	86.9 Å²	86.9	31%	0.309	49%	0.492	S	S	.	.			trans	-68.3	92.7	166.3	-177.2	0	0	0	0	108.5	F188 Q192 L195 M378 P382	F188-V380 HydrophobicContact CE2-CG1 4.01Å; F188-V380 HydrophobicContact CZ-CG1 3.9Å; Q192-V380 HydrophobicContact CG-CB 4.01Å; Q192-V380 HydrophobicContact CG-CG1 4.35Å; Q192-V380 HydrophobicContact CG-CG2 4.1Å; L195-V380 HydrophobicContact CB-CG2 4.24Å; L195-V380 HydrophobicContact CD1-CG2 3.69Å; M378-V380 PolarHBondContact O-N 2.84Å; V380-P382 WeakPolarHBondContact O-CD 3.46Å
381	V	64.3	Low	74.5	Confident	118 Å²	118	89.5 Å²	89.5	72%	0.715	50%	0.504	S	S	*	.			trans	-84.4	112.3	168.4	-179.4	0	0	0	0	107	K379	K379-V381 VanDerWaalsContact C-N 3.32Å; K379-V381 HydrophobicContact CB-CG2 4.48Å; K379-V381 PolarHBondContact O-N 2.95Å
382	P	59.6	Low	73	Confident	90 Å²	90	95.9 Å²	95.9	58%	0.584	54%	0.54	S	S	*	.			trans	-64.7	139.5	166.9	29.1	-33	0	0	0	108.6	V380	V380-P382 WeakPolarHBondContact O-CD 3.46Å
383	E	60.2	Low	71.3	Confident	192 Å²	192	102.3 Å²	102.3	90%	0.897	58%	0.576	S	S	*	*			trans	-57.8	142.6	170.3	-76.6	-177.6	121.6	0	0	110	A385	E383-A385 PolarHBondContact O-N 3.48Å
384	K	48.5	Very low	69.1	Low	211 Å²	211	110.8 Å²	110.8	92%	0.917	62%	0.623	S	S	*	*			trans	-75.6	105.6	172.1	-68.7	-175.6	177.5	-175.9	0	108.1
385	A	41.8	Very low	66.9	Low	172 Å²	172	119.5 Å²	119.5	100%	1.421	67%	0.671	S	S	*	*			trans	-69.4	0	158.8	0	0	0	0	0	110.6	E383	E383-A385 PolarHBondContact O-N 3.48Å

Retrieved 385 of 385 residues in 730.4 ms (Link to these results)

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