A0A096NWM7_PAPAN Loading...

NMDA receptor synaptonuclear signaling and neuronal migration factor

AlphaFold DB (A0A2K6NE23), UniProt , Accession A0A096NWM7, Species PAPAN (Papio anubis, Olive baboon), Gene NSMF, Length 530 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	41.6	Very low	38.2	Very low	253 Å²	253	157.6 Å²	157.6	100%	1.246	89%	0.893	S	S	*	*				0	122.5	0	-69.1	-177.5	-82.4	0	0	108.2
2	G	36.6	Very low	38.4	Very low	83 Å²	83	162.7 Å²	162.7	86%	0.856	89%	0.887	S	S	*	*			trans	-111.4	133.4	179	0	0	0	0	0	111.2
3	A	35.7	Very low	38.7	Very low	111 Å²	111	159.7 Å²	159.7	92%	0.917	89%	0.885	S	S	*	*			trans	-83.3	130.9	-178.7	0	0	0	0	0	111.7
4	A	34	Very low	38.8	Very low	102 Å²	102	160.9 Å²	160.9	84%	0.843	88%	0.881	S	S	*	*			trans	-81.7	128.9	-179	0	0	0	0	0	112.3	S6	A4-S6 PolarHBondContact O-N 3.43Å
5	A	37.4	Very low	39.6	Very low	99 Å²	99	154.7 Å²	154.7	82%	0.818	86%	0.86	S	S	*	*			trans	-78.4	109	178.9	0	0	0	0	0	112.1	R7	A5-R7 PolarHBondContact O-N 3.3Å
6	S	37.1	Very low	40.2	Very low	109 Å²	109	155.4 Å²	155.4	76%	0.762	86%	0.858	S	S	*	*			trans	-78.4	109	179.9	-166.8	0	0	0	0	112.4	A4 R8	A4-S6 PolarHBondContact O-N 3.43Å; S6-R8 PolarHBondContact O-N 3.5Å
7	R	43.5	Very low	41.1	Very low	245 Å²	245	152.8 Å²	152.8	93%	0.925	85%	0.853	S	S	*	*			trans	-78.5	101.3	172.3	-65.8	-178.9	-180	-179.3	0	110.8	A5	A5-R7 PolarHBondContact O-N 3.3Å
8	R	39	Very low	42.2	Very low	235 Å²	235	147.7 Å²	147.7	89%	0.887	83%	0.829	S	S	*	*			trans	-92.3	121.7	161.5	-72.4	-165.6	177.4	-146.5	-0.7	110.4	S6	S6-R8 PolarHBondContact O-N 3.5Å
9	R	40	Very low	43.2	Very low	229 Å²	229	145.8 Å²	145.8	86%	0.864	82%	0.821	S	S	*	*			trans	-70.8	138.6	176.3	-67.4	174.6	176.1	150.2	-2.3	110	L11	R9-L11 PolarHBondContact O-N 3.4Å
10	A	34.6	Very low	43.9	Very low	99 Å²	99	140.9 Å²	140.9	82%	0.818	80%	0.8	S	S	*	*			trans	-70.7	111.7	162.7	0	0	0	0	0	108.9
11	L	40.6	Very low	45	Very low	169 Å²	169	136 Å²	136	89%	0.885	78%	0.776	S	S	*	*			trans	-72.5	126.8	169.3	-71.7	172.1	0	0	0	108.6	R9	R9-L11 PolarHBondContact O-N 3.4Å
12	R	40.6	Very low	46.2	Very low	218 Å²	218	131 Å²	131	82%	0.823	75%	0.748	S	S	*	*			trans	-71.2	147.5	-179	-73.8	179	168.6	138.8	-3.3	110.6	E14	R12-E14 PolarHBondContact O-N 3.28Å
13	S	42.9	Very low	47.7	Very low	124 Å²	124	131.1 Å²	131.1	87%	0.867	73%	0.732	S	S	*	*			trans	-73.5	66.6	172.8	176.7	0	0	0	0	111.1	A15	S13-A15 VanDerWaalsContact C-N 3.34Å; S13-A15 PolarHBondContact O-N 3.06Å
14	E	39.4	Very low	49.2	Very low	176 Å²	176	134.1 Å²	134.1	82%	0.822	72%	0.719	S	S	*	*			trans	-99.6	45.9	-174.7	-156.6	147.8	-129.3	0	0	112	R12	R12-E14 PolarHBondContact O-N 3.28Å
15	A	51.5	Low	50.9	Low	69 Å²	69	132.3 Å²	132.3	57%	0.57	70%	0.704	S	S	*	*	S	Bend	trans	-133.9	148.1	172	0	0	0	0	0	109.9	S13	S13-A15 VanDerWaalsContact C-N 3.34Å; S13-A15 PolarHBondContact O-N 3.06Å
16	M	48.5	Very low	52.5	Low	166 Å²	166	130.7 Å²	130.7	82%	0.818	69%	0.691	S	S	*	*	S	Bend	trans	70.8	32.1	178.1	-53.3	-55.4	131.1	0	0	117.9
17	S	56.4	Low	54	Low	111 Å²	111	134.3 Å²	134.3	78%	0.776	69%	0.688	S	S	*	*			trans	-113.3	39.4	156.8	-168.1	0	0	0	0	113.5
18	S	60.3	Low	55.1	Low	61 Å²	61	125.3 Å²	125.3	43%	0.427	67%	0.666	S	S	.	*			trans	-90.2	129	170	-179.2	0	0	0	0	111.3	A20 A21 K22	S18-A20 PolarHBondContact O-N 3.45Å; S18-A20 PolarHBondContact OG-N 2.75Å; S18-A21 WeakPolarHBondContact O-CB 3.22Å; S18-A21 PolarHBondContact O-N 3.07Å; S18-A21 VanDerWaalsContact O-N 3.09Å; S18-K22 PolarHBondContact O-N 3.33Å
19	V	61.1	Low	56.5	Low	112 Å²	112	120.4 Å²	120.4	68%	0.679	65%	0.651	S	S	*	*	H	α-helix	trans	-58.9	-36.2	171.8	177.4	0	0	0	0	110.7	A21 K22 V23	V19-A21 PolarHBondContact O-N 3.37Å; V19-K22 PolarHBondContact O-N 2.99Å; V19-K22 VanDerWaalsContact O-N 3.07Å; V19-V23 HydrophobicContact CG1-CG2 4.11Å; V19-V23 WeakPolarHBondContact O-CG2 3.49Å; V19-V23 PolarHBondContact O-N 3.26Å
20	A	57.9	Low	57.9	Low	47 Å²	47	111.3 Å²	111.3	39%	0.388	63%	0.628	S	S	.	*	H	α-helix	trans	-67.3	-17.6	177.7	0	0	0	0	0	114.1	S18 R24	S18-A20 PolarHBondContact O-N 3.45Å; S18-A20 PolarHBondContact OG-N 2.75Å; A20-R24 WeakPolarHBondContact O-CB 3.41Å; A20-R24 WeakPolarHBondContact O-CG 3.33Å; A20-R24 PolarHBondContact O-N 3.5Å; A20-R24 PolarHBondContact O-NE 2.77Å
21	A	65.8	Low	59	Low	38 Å²	38	111.3 Å²	111.3	31%	0.314	61%	0.611	S	S	.	*	H	α-helix	trans	-77.9	-42.8	168.6	0	0	0	0	0	111.1	S18 V19 R24 A25	S18-A21 WeakPolarHBondContact O-CB 3.22Å; S18-A21 PolarHBondContact O-N 3.07Å; S18-A21 VanDerWaalsContact O-N 3.09Å; V19-A21 PolarHBondContact O-N 3.37Å; A21-R24 PolarHBondContact O-N 2.95Å; A21-A25 WeakPolarHBondContact O-CB 3.42Å; A21-A25 PolarHBondContact O-N 3.32Å
22	K	66.8	Low	60	Low	148 Å²	148	110.7 Å²	110.7	64%	0.643	60%	0.599	S	S	*	*	H	α-helix	trans	-65	-40.3	176.2	-68.5	178.9	178.3	173.1	0	112.4	S18 V19 A25 A26	S18-K22 PolarHBondContact O-N 3.33Å; V19-K22 PolarHBondContact O-N 2.99Å; V19-K22 VanDerWaalsContact O-N 3.07Å; K22-A25 PolarHBondContact O-N 3.01Å; K22-A26 WeakPolarHBondContact O-CB 3.43Å; K22-A26 PolarHBondContact O-N 3.41Å
23	V	69.4	Low	60.9	Low	85 Å²	85	104.6 Å²	104.6	52%	0.515	58%	0.582	S	S	.	*	H	α-helix	trans	-65	-42.5	175.6	172.9	0	0	0	0	111.5	V19 A26 R27	V19-V23 HydrophobicContact CG1-CG2 4.11Å; V19-V23 WeakPolarHBondContact O-CG2 3.49Å; V19-V23 PolarHBondContact O-N 3.26Å; V23-A26 PolarHBondContact O-N 3.02Å; V23-R27 PolarHBondContact O-N 2.9Å
24	R	66.1	Low	61.4	Low	174 Å²	174	103 Å²	103	66%	0.657	57%	0.571	S	S	*	*	H	α-helix	trans	-64.8	-41.8	175.1	-82	180	-78.8	-161.8	-1.2	112.6	A20 A21 A26 R27 A28	A20-R24 WeakPolarHBondContact O-CB 3.41Å; A20-R24 WeakPolarHBondContact O-CG 3.33Å; A20-R24 PolarHBondContact O-N 3.5Å; A20-R24 PolarHBondContact O-NE 2.77Å; A21-R24 PolarHBondContact O-N 2.95Å; R24-A26 VanDerWaalsContact C-N 3.34Å; R24-A26 PolarHBondContact O-N 3.33Å; R24-R27 PolarHBondContact O-N 3.39Å; R24-A28 PolarHBondContact O-N 3.28Å
25	A	70.8	Confident	62.1	Low	64 Å²	64	102 Å²	102	53%	0.529	57%	0.566	S	S	.	*	H	α-helix	trans	-62.2	-39.4	173.9	0	0	0	0	0	112.5	A21 K22 F29	A21-A25 WeakPolarHBondContact O-CB 3.42Å; A21-A25 PolarHBondContact O-N 3.32Å; K22-A25 PolarHBondContact O-N 3.01Å; A25-F29 WeakPolarHBondContact O-CB 3.32Å; A25-F29 PolarHBondContact O-N 3.06Å
26	A	69.9	Low	61.9	Low	66 Å²	66	101.5 Å²	101.5	55%	0.545	56%	0.558	S	S	.	*	H	α-helix	trans	-66.2	-38	175.2	0	0	0	0	0	112.6	K22 V23 R24 F29 G30	K22-A26 WeakPolarHBondContact O-CB 3.43Å; K22-A26 PolarHBondContact O-N 3.41Å; V23-A26 PolarHBondContact O-N 3.02Å; R24-A26 VanDerWaalsContact C-N 3.34Å; R24-A26 PolarHBondContact O-N 3.33Å; A26-F29 PolarHBondContact O-N 2.71Å; A26-G30 PolarHBondContact O-N 2.72Å
27	R	67.8	Low	61.5	Low	185 Å²	185	101 Å²	101	70%	0.698	55%	0.553	S	S	*	*	H	α-helix	trans	-65.2	-49.9	176.4	-141.7	179.8	-155.1	155.3	5.4	111.6	V23 R24 F29 G30 E31	V23-R27 PolarHBondContact O-N 2.9Å; R24-R27 PolarHBondContact O-N 3.39Å; R27-F29 VanDerWaalsContact C-N 3.27Å; R27-F29 PolarHBondContact O-N 2.94Å; R27-G30 WeakPolarHBondContact O-CA 3.27Å; R27-G30 PolarHBondContact O-N 2.77Å; R27-E31 WeakPolarHBondContact O-CG 3.4Å; R27-E31 PolarHBondContact O-N 3.45Å
28	A	67.8	Low	61.1	Low	55 Å²	55	101.7 Å²	101.7	46%	0.455	56%	0.555	S	S	.	*	H	α-helix	trans	-60.8	-33.6	176.1	0	0	0	0	0	112.9	R24 Y32	R24-A28 PolarHBondContact O-N 3.28Å; A28-Y32 WeakPolarHBondContact O-CB 3.45Å; A28-Y32 PolarHBondContact O-N 3.26Å
29	F	68.7	Low	60.3	Low	133 Å²	133	107.3 Å²	107.3	58%	0.583	58%	0.575	S	S	*	*	H	α-helix	trans	-71.3	-34.4	174	-167.6	-99.1	0	0	0	112.6	A25 A26 R27 L33	A25-F29 WeakPolarHBondContact O-CB 3.32Å; A25-F29 PolarHBondContact O-N 3.06Å; A26-F29 PolarHBondContact O-N 2.71Å; R27-F29 VanDerWaalsContact C-N 3.27Å; R27-F29 PolarHBondContact O-N 2.94Å; F29-L33 HydrophobicContact CD1-CD1 3.97Å; F29-L33 HydrophobicContact CE1-CD1 3.68Å; F29-L33 HydrophobicContact CE1-CG 4.29Å; F29-L33 HydrophobicContact CZ-CD1 4.48Å; F29-L33 WeakPolarHBondContact O-CG 3.46Å; F29-L33 PolarHBondContact O-N 3.48Å
30	G	68.4	Low	59.2	Low	37 Å²	37	109.3 Å²	109.3	38%	0.381	58%	0.582	S	S	.	*	H	α-helix	trans	-65.5	-45.7	170.7	0	0	0	0	0	112.5	A26 R27 Y32 L33 S34	A26-G30 PolarHBondContact O-N 2.72Å; R27-G30 WeakPolarHBondContact O-CA 3.27Å; R27-G30 PolarHBondContact O-N 2.77Å; G30-Y32 VanDerWaalsContact C-N 3.29Å; G30-Y32 PolarHBondContact O-N 3.42Å; G30-L33 PolarHBondContact O-N 2.98Å; G30-L33 VanDerWaalsContact O-N 3.16Å; G30-S34 PolarHBondContact O-N 2.69Å; G30-S34 PolarHBondContact O-OG 3.27Å
31	E	58.4	Low	58.1	Low	99 Å²	99	118.2 Å²	118.2	46%	0.463	61%	0.605	S	S	.	*	H	α-helix	trans	-63	-33	176.7	-71.9	160.4	-160.9	0	0	112.5	R27 S34 Q35	R27-E31 WeakPolarHBondContact O-CG 3.4Å; R27-E31 PolarHBondContact O-N 3.45Å; E31-S34 WeakPolarHBondContact CA-OG 3.24Å; E31-S34 PolarHBondContact O-OG 2.96Å; E31-Q35 VanDerWaalsContact O-CG 3.26Å; E31-Q35 WeakPolarHBondContact O-CG 3.45Å; E31-Q35 PolarHBondContact O-N 3.42Å; E31-Q35 PolarHBondContact O-NE2 2.65Å
32	Y	61.3	Low	56.7	Low	157 Å²	157	124.1 Å²	124.1	62%	0.616	63%	0.632	S	S	*	*	H	α-helix	trans	-66.9	-42.9	172.2	-175.3	-103.5	0	0	0	112.2	A28 G30 S34 Q35 S36	A28-Y32 WeakPolarHBondContact O-CB 3.45Å; A28-Y32 PolarHBondContact O-N 3.26Å; G30-Y32 VanDerWaalsContact C-N 3.29Å; G30-Y32 PolarHBondContact O-N 3.42Å; Y32-S34 PolarHBondContact O-N 3.12Å; Y32-Q35 PolarHBondContact O-N 3.38Å; Y32-Q35 VanDerWaalsContact O-N 3.17Å; Y32-S36 PolarHBondContact O-N 3.21Å
33	L	59.8	Low	55.4	Low	89 Å²	89	121.1 Å²	121.1	47%	0.466	64%	0.643	S	S	.	*	H	α-helix	trans	-67.7	-32.3	177.4	-72.3	172	0	0	0	112.9	F29 G30 Q35 S36	F29-L33 HydrophobicContact CD1-CD1 3.97Å; F29-L33 HydrophobicContact CE1-CD1 3.68Å; F29-L33 HydrophobicContact CE1-CG 4.29Å; F29-L33 HydrophobicContact CZ-CD1 4.48Å; F29-L33 WeakPolarHBondContact O-CG 3.46Å; F29-L33 PolarHBondContact O-N 3.48Å; G30-L33 PolarHBondContact O-N 2.98Å; G30-L33 VanDerWaalsContact O-N 3.16Å; L33-Q35 VanDerWaalsContact C-N 3.26Å; L33-Q35 PolarHBondContact O-N 3.38Å; L33-S36 PolarHBondContact O-OG 3.04Å
34	S	53.3	Low	53.7	Low	91 Å²	91	121.5 Å²	121.5	64%	0.636	66%	0.655	S	S	*	*	H	α-helix	trans	-74.2	-15.7	173.3	62.1	0	0	0	0	113.6	G30 E31 Y32	G30-S34 PolarHBondContact O-N 2.69Å; G30-S34 PolarHBondContact O-OG 3.27Å; E31-S34 WeakPolarHBondContact CA-OG 3.24Å; E31-S34 PolarHBondContact O-OG 2.96Å; Y32-S34 PolarHBondContact O-N 3.12Å
35	Q	53.2	Low	52.1	Low	154 Å²	154	120.6 Å²	120.6	72%	0.72	66%	0.663	S	S	*	*	H	α-helix	trans	-93.2	-13	175.9	-72.3	170.7	45.7	0	0	113.1	E31 Y32 L33	E31-Q35 VanDerWaalsContact O-CG 3.26Å; E31-Q35 WeakPolarHBondContact O-CG 3.45Å; E31-Q35 PolarHBondContact O-N 3.42Å; E31-Q35 PolarHBondContact O-NE2 2.65Å; Y32-Q35 PolarHBondContact O-N 3.38Å; Y32-Q35 VanDerWaalsContact O-N 3.17Å; L33-Q35 VanDerWaalsContact C-N 3.26Å; L33-Q35 PolarHBondContact O-N 3.38Å
36	S	47.3	Very low	50.3	Low	59 Å²	59	126.2 Å²	126.2	41%	0.413	68%	0.678	S	S	.	*	S	Bend	trans	-93.2	12.6	-174.7	65.3	0	0	0	0	115.6	Y32 L33	Y32-S36 PolarHBondContact O-N 3.21Å; L33-S36 PolarHBondContact O-OG 3.04Å
37	H	40.2	Very low	48.6	Very low	155 Å²	155	130.7 Å²	130.7	72%	0.718	69%	0.692	S	S	*	*			trans	-125.3	101.2	175.6	-84	-82	0	0	0	111.1	E39	H37-E39 VanDerWaalsContact C-N 3.32Å
38	P	47.7	Very low	47.1	Very low	126 Å²	126	130.5 Å²	130.5	82%	0.818	70%	0.704	S	S	*	*			trans	-84.1	0.1	178.4	33	-33.8	0	0	0	114.3
39	E	44.5	Very low	45.3	Very low	179 Å²	179	131.7 Å²	131.7	84%	0.836	71%	0.714	S	S	*	*	S	Bend	trans	-120.7	62.3	-171.1	-65.9	-174.5	139.3	0	0	113.5	H37	H37-E39 VanDerWaalsContact C-N 3.32Å
40	N	37.2	Very low	43.4	Very low	154 Å²	154	133 Å²	133	82%	0.824	73%	0.726	S	S	*	*			trans	-165.7	107.9	131.3	-152.5	-12.9	0	0	0	110.5
41	R	35.7	Very low	41.6	Very low	234 Å²	234	134.5 Å²	134.5	88%	0.883	74%	0.735	S	S	*	*			trans	-146.8	73.2	176.4	-163.5	-179.3	-172.8	-173.9	1.9	112.1
42	N	37.1	Very low	40.1	Very low	163 Å²	163	140.2 Å²	140.2	87%	0.872	75%	0.754	S	S	*	*			trans	-150.7	138.1	164.6	-90.8	-37.6	0	0	0	110.1
43	G	37.9	Very low	38.7	Very low	84 Å²	84	138.9 Å²	138.9	87%	0.866	77%	0.768	S	S	*	*	S	Bend	trans	87.2	46.2	157.3	0	0	0	0	0	119.2
44	A	35.2	Very low	37.2	Very low	93 Å²	93	138 Å²	138	77%	0.769	78%	0.781	S	S	*	*			trans	-157.5	78.5	162	0	0	0	0	0	112.8
45	D	31.6	Very low	36.1	Very low	155 Å²	155	142.2 Å²	142.2	83%	0.829	79%	0.79	S	S	*	*			trans	-177.2	161.4	145.7	-101.6	-30.7	0	0	0	109.8
46	H	32.6	Very low	35	Very low	182 Å²	182	142 Å²	142	84%	0.843	79%	0.794	S	S	*	*			trans	69.8	127.1	-160.5	-50.2	-73	0	0	0	112.8
47	L	34.3	Very low	34.1	Very low	160 Å²	160	142.1 Å²	142.1	84%	0.838	80%	0.804	S	S	*	*			cis	-130.1	145.7	7.6	-68.2	168.5	0	0	0	112.1
48	L	37.5	Very low	33.8	Very low	182 Å²	182	140.5 Å²	140.5	95%	0.953	81%	0.81	S	S	*	*			trans	-117.6	119.9	154.6	-85.7	174.8	0	0	0	108
49	A	29.9	Very low	33.9	Very low	80 Å²	80	139.7 Å²	139.7	66%	0.661	81%	0.805	S	S	*	*			trans	-163.3	141.1	159.2	0	0	0	0	0	109.1
50	D	27.9	Very low	33.2	Very low	159 Å²	159	139.3 Å²	139.3	85%	0.85	80%	0.803	S	S	*	*			trans	62.4	138.1	150.1	-58	-16	0	0	0	121.3
51	A	30.4	Very low	32.7	Very low	69 Å²	69	139 Å²	139	57%	0.57	80%	0.799	S	S	*	*			cis	-164.5	155.5	-15.7	0	0	0	0	0	113.9
52	Y	27.3	Very low	32.3	Very low	220 Å²	220	136.1 Å²	136.1	86%	0.863	80%	0.795	S	S	*	*			trans	59.6	152.8	154.3	-62.1	-58.3	0	0	0	123
53	S	32.1	Very low	32.6	Very low	128 Å²	128	133.9 Å²	133.9	90%	0.895	79%	0.789	S	S	*	*			trans	78.1	134.5	171.6	-39.5	0	0	0	0	116.6
54	G	29.3	Very low	32.3	Very low	72 Å²	72	134.2 Å²	134.2	74%	0.742	78%	0.784	S	S	*	*			cis	164.3	141.9	-11.7	0	0	0	0	0	114.4
55	H	29.3	Very low	32.5	Very low	179 Å²	179	135.3 Å²	135.3	83%	0.829	78%	0.783	S	S	*	*			trans	66.7	122.4	161.3	-119.6	-29.6	0	0	0	121.9
56	D	29.8	Very low	32.5	Very low	150 Å²	150	136.4 Å²	136.4	80%	0.802	78%	0.783	S	S	*	*			trans	58.4	170.4	140	-96.5	-71.6	0	0	0	124
57	G	29.2	Very low	32.3	Very low	61 Å²	61	136 Å²	136	63%	0.629	79%	0.787	S	S	*	*			trans	-128.1	-177.2	-165.1	0	0	0	0	0	117.4
58	S	33.7	Very low	32.5	Very low	120 Å²	120	137.5 Å²	137.5	84%	0.839	79%	0.787	S	S	*	*			trans	14.6	147.9	158.6	-57.6	0	0	0	0	121.5
59	P	50.4	Low	32.6	Very low	109 Å²	109	139.7 Å²	139.7	71%	0.708	78%	0.783	S	S	*	*			cis	-148.3	176.9	31.2	42.3	-22	0	0	0	119.5
60	E	27.8	Very low	32.7	Very low	171 Å²	171	146.7 Å²	146.7	80%	0.799	79%	0.792	S	S	*	*			trans	81.8	155.3	140.2	-105.6	-177.3	105	0	0	126.2
61	M	27.3	Very low	33	Very low	149 Å²	149	145.8 Å²	145.8	73%	0.734	79%	0.786	S	S	*	*			trans	73.4	94.2	157.9	-70.3	-73.8	-92.7	0	0	123.1
62	Q	28.7	Very low	33.1	Very low	173 Å²	173	147 Å²	147	81%	0.808	79%	0.791	S	S	*	*				21.8	163.1	125.8	-69.4	-156.6	34.3	0	0	123.6
63	P	42.8	Very low	33.3	Very low	115 Å²	115	144 Å²	144	75%	0.747	79%	0.789	S	S	*	*			cis	-133.7	-167.4	-19.8	33.3	-11	0	0	0	114.2
64	A	32.1	Very low	33.3	Very low	92 Å²	92	143.5 Å²	143.5	76%	0.76	78%	0.78	S	S	*	*			trans	-86.4	161.9	-179.8	0	0	0	0	0	115.1
65	P	38.3	Very low	33.3	Very low	116 Å²	116	145.8 Å²	145.8	75%	0.753	79%	0.785	S	S	*	*				-151.6	150.1	117.2	38.2	-21.5	0	0	0	118.8
66	Q	30.9	Very low	33.5	Very low	177 Å²	177	145 Å²	145	83%	0.827	79%	0.787	S	S	*	*			trans	27.3	134.3	137.2	-54	179.8	1.9	0	0	122.8
67	N	29.7	Very low	33.4	Very low	173 Å²	173	141.2 Å²	141.2	93%	0.925	78%	0.784	S	S	*	*			trans	-104.7	156.5	168.3	-117.3	-39.9	0	0	0	113.1
68	K	38.2	Very low	33.3	Very low	192 Å²	192	144.9 Å²	144.9	84%	0.835	80%	0.798	S	S	*	*			trans	-127.5	160	-165.5	-75.3	-178.9	-179.7	172.6	0	117.2
69	R	38.5	Very low	33.1	Very low	228 Å²	228	150.2 Å²	150.2	86%	0.86	80%	0.801	S	S	*	*			trans	-64.3	157.5	-172.7	-50.7	165.7	176.3	172.3	-4.2	118.6
70	R	33.8	Very low	31.9	Very low	227 Å²	227	154.5 Å²	154.5	86%	0.857	81%	0.812	S	S	*	*			trans	-165.7	140.9	132.4	-114	171.5	168.5	-94.3	5.7	108.2
71	L	32.4	Very low	31.9	Very low	140 Å²	140	149.3 Å²	149.3	73%	0.733	80%	0.804	S	S	*	*			cis	70.9	135.5	30	-62.5	175.5	0	0	0	114.7
72	S	34.4	Very low	32	Very low	96 Å²	96	148.3 Å²	148.3	67%	0.671	81%	0.812	S	S	*	*			cis	-130.6	-158.3	11.5	52.2	0	0	0	0	111.7
73	L	30.9	Very low	31.9	Very low	157 Å²	157	148.6 Å²	148.6	82%	0.822	82%	0.818	S	S	*	*			cis	-151.1	-144.7	10.6	-159.9	66	0	0	0	111.8
74	V	32.3	Very low	31.3	Very low	117 Å²	117	149.1 Å²	149.1	71%	0.709	82%	0.824	S	S	*	*			trans	-153.6	153.5	-165.2	168.2	0	0	0	0	111.3
75	S	29.1	Very low	31.1	Very low	120 Å²	120	153.3 Å²	153.3	84%	0.839	83%	0.828	S	S	*	*			trans	-172.6	157.4	145.8	-98.6	0	0	0	0	113.8
76	N	32.2	Very low	30.9	Very low	162 Å²	162	155.9 Å²	155.9	87%	0.866	83%	0.83	S	S	*	*			trans	-122.5	169.1	-176.4	-56	-29.9	0	0	0	111.7
77	G	28.3	Very low	31.3	Very low	71 Å²	71	152.7 Å²	152.7	73%	0.732	83%	0.825	S	S	*	*			trans	158	97.5	153	0	0	0	0	0	120.7
78	C	27.3	Very low	31.1	Very low	138 Å²	138	147.9 Å²	147.9	93%	0.932	82%	0.816	S	S	*	*			trans	56	158.5	139	-65.4	0	0	0	0	125.3
79	Y	29.1	Very low	30.8	Very low	231 Å²	231	146.9 Å²	146.9	91%	0.906	82%	0.818	S	S	*	*			trans	-76.1	155.1	167.9	-82.9	-130.7	0	0	0	111.8
80	E	26.3	Very low	30.4	Very low	200 Å²	200	147.4 Å²	147.4	94%	0.935	82%	0.82	S	S	*	*				-162.5	174.6	107.7	-142.3	165.1	-155.2	0	0	110.5
81	G	27.8	Very low	30.3	Very low	61 Å²	61	146 Å²	146	63%	0.629	82%	0.82	S	S	*	*			trans	-137.4	163.6	179.7	0	0	0	0	0	112.7
82	S	28.9	Very low	30.3	Very low	129 Å²	129	145.5 Å²	145.5	90%	0.902	83%	0.825	S	S	*	*			trans	-157.3	153.9	173.4	-81.3	0	0	0	0	111.8
83	L	27	Very low	30.2	Very low	178 Å²	178	146 Å²	146	93%	0.932	84%	0.835	S	S	*	*			trans	-96.3	156.1	-173	-65.3	162.8	0	0	0	112.1
84	S	28.9	Very low	30.2	Very low	126 Å²	126	142.4 Å²	142.4	88%	0.881	84%	0.835	S	S	*	*			trans	-155.8	148.7	150.8	-155.4	0	0	0	0	109.2
85	E	27.7	Very low	30.3	Very low	181 Å²	181	144.4 Å²	144.4	85%	0.846	84%	0.837	S	S	*	*			trans	-103.2	143.3	-164.4	-64.7	171.4	83.2	0	0	113.6
86	E	34.8	Very low	30.8	Very low	169 Å²	169	141.4 Å²	141.4	79%	0.79	83%	0.825	S	S	*	*			trans	34.1	166.6	138.1	-78.7	-70.5	90.4	0	0	123
87	P	39.8	Very low	31.3	Very low	111 Å²	111	140.3 Å²	140.3	72%	0.721	83%	0.827	S	S	*	*			cis	-123.2	159.1	-13.6	36	-21.5	0	0	0	114.3
88	G	25.5	Very low	32	Very low	71 Å²	71	143.1 Å²	143.1	73%	0.732	82%	0.821	S	S	*	*			trans	-158.1	87.7	178.8	0	0	0	0	0	116.3	R90	G88-R90 PolarHBondContact O-N 2.99Å
89	I	31.6	Very low	32.7	Very low	171 Å²	171	141.1 Å²	141.1	88%	0.877	81%	0.806	S	S	*	*			trans	-66.9	116.2	-174.5	-57.5	166.3	0	0	0	113.2
90	R	30.8	Very low	33.9	Very low	239 Å²	239	138.7 Å²	138.7	90%	0.902	80%	0.795	S	S	*	*			trans	-171	159.9	132.6	-106.6	165	-172.3	-162.7	1.2	114.4	G88	G88-R90 PolarHBondContact O-N 2.99Å
91	K	30.9	Very low	34.5	Very low	199 Å²	199	133.1 Å²	133.1	87%	0.865	78%	0.775	S	S	*	*			trans	-71	146.9	-174.1	-56.3	175.4	177.9	-178.7	0	113.3
92	P	33.4	Very low	35.6	Very low	129 Å²	129	138.4 Å²	138.4	84%	0.838	78%	0.777	S	S	*	*			trans	-77.6	163.8	153.6	35.2	-33.9	0	0	0	111.3
93	A	32.4	Very low	36.4	Very low	107 Å²	107	136.7 Å²	136.7	88%	0.884	76%	0.761	S	S	*	*			trans	-149.8	149.8	171.1	0	0	0	0	0	110.5
94	G	29.3	Very low	37.1	Very low	80 Å²	80	134.9 Å²	134.9	83%	0.825	75%	0.751	S	S	*	*			trans	92.8	84.2	169.9	0	0	0	0	0	115.3
95	E	36.1	Very low	37.6	Very low	160 Å²	160	133.9 Å²	133.9	75%	0.748	74%	0.744	S	S	*	*			trans	-65.7	156	159.4	-74.4	178	79.8	0	0	111.7	Q98	E95-Q98 PolarHBondContact OE1-NE2 3.4Å
96	G	38.7	Very low	38.3	Very low	57 Å²	57	129 Å²	129	59%	0.588	74%	0.742	S	S	*	*			trans	-72.2	168.9	163.9	0	0	0	0	0	112.6	Q98	G96-Q98 PolarHBondContact O-N 3.15Å; G96-Q98 VanDerWaalsContact O-N 3.12Å
97	P	42.8	Very low	38.2	Very low	139 Å²	139	129.9 Å²	129.9	90%	0.903	75%	0.746	S	S	*	*			trans	-70.6	108.3	-177.7	28.4	-34.2	0	0	0	112
98	Q	43.9	Very low	38	Very low	129 Å²	129	130.5 Å²	130.5	60%	0.603	75%	0.751	S	S	*	*			trans	-67	152.3	168.6	-64.7	-166	17	0	0	111.8	E95 G96	E95-Q98 PolarHBondContact OE1-NE2 3.4Å; G96-Q98 PolarHBondContact O-N 3.15Å; G96-Q98 VanDerWaalsContact O-N 3.12Å
99	P	41.8	Very low	38.3	Very low	96 Å²	96	132.2 Å²	132.2	62%	0.623	76%	0.758	S	S	*	*			trans	-61.4	145.4	175.2	27	-35.3	0	0	0	111.7
100	R	52.8	Low	38.4	Very low	181 Å²	181	132 Å²	132	68%	0.683	76%	0.757	S	S	*	*			trans	-125.9	109.6	-174.8	-69.4	-173.7	173.8	-145.2	-5.2	112.5	Y102	R100-Y102 HydrophobicContact CB-CE2 4.1Å
101	V	40	Very low	38.4	Very low	83 Å²	83	128.2 Å²	128.2	50%	0.503	75%	0.754	S	S	.	*	P	Polyproline II helix	trans	-90.3	129.1	162.3	-178.5	0	0	0	0	108.2
102	Y	50.1	Low	38.7	Very low	171 Å²	171	124.2 Å²	124.2	67%	0.671	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-96.8	120.2	-176.4	-68.9	-84	0	0	0	111.7	R100	R100-Y102 HydrophobicContact CB-CE2 4.1Å
103	T	46.7	Very low	38.6	Very low	93 Å²	93	123.3 Å²	123.3	57%	0.571	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-90.5	118.7	170	50.2	0	0	0	0	110.7	S105	T103-S105 PolarHBondContact O-N 3.47Å
104	I	41.4	Very low	39	Very low	140 Å²	140	123.7 Å²	123.7	72%	0.718	74%	0.739	S	S	*	*			trans	-88.6	105.2	169.7	-57.1	171.7	0	0	0	108.2
105	S	38.8	Very low	39	Very low	105 Å²	105	129 Å²	129	73%	0.734	74%	0.742	S	S	*	*			trans	-113.9	109.6	167.3	53.7	0	0	0	0	108.5	T103 E107	T103-S105 PolarHBondContact O-N 3.47Å; S105-E107 PolarHBondContact O-N 2.71Å
106	G	42.7	Very low	38.7	Very low	79 Å²	79	126.3 Å²	126.3	81%	0.814	75%	0.747	S	S	*	*			trans	-90.3	96	-178.4	0	0	0	0	0	112.5
107	E	32.6	Very low	38.3	Very low	187 Å²	187	132.6 Å²	132.6	87%	0.874	76%	0.761	S	S	*	*			trans	-129.9	134.9	157.4	-75.8	-156.4	132.6	0	0	110.2	S105	S105-E107 PolarHBondContact O-N 2.71Å
108	P	36.8	Very low	37.6	Very low	125 Å²	125	130.1 Å²	130.1	81%	0.812	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-81.1	136.9	174	32.6	-32.7	0	0	0	111.2
109	A	30.1	Very low	37.1	Very low	106 Å²	106	131.9 Å²	131.9	88%	0.876	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-70.8	148.5	178.5	0	0	0	0	0	113
110	L	34.2	Very low	36.6	Very low	166 Å²	166	135.8 Å²	135.8	87%	0.869	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-78	155.2	-172.1	-65.5	164.3	0	0	0	114.4
111	L	31.3	Very low	35.6	Very low	160 Å²	160	135.8 Å²	135.8	84%	0.838	79%	0.787	S	S	*	*			trans	-138.3	156.3	163.4	-82.9	-173.8	0	0	0	108.5
112	P	36.1	Very low	35.1	Very low	115 Å²	115	135.5 Å²	135.5	75%	0.747	79%	0.793	S	S	*	*				-102	170.1	-113.9	-5.1	25.1	0	0	0	117.3
113	S	32.6	Very low	34.2	Very low	110 Å²	110	133.7 Å²	133.7	77%	0.769	80%	0.8	S	S	*	*			trans	-66.2	151.7	167.9	-174	0	0	0	0	113.2
114	P	40	Very low	33.4	Very low	115 Å²	115	135.6 Å²	135.6	75%	0.747	81%	0.811	S	S	*	*			trans	-123.8	165.5	134.2	37.4	-31.2	0	0	0	113.5
115	E	29.9	Very low	32.8	Very low	193 Å²	193	138.8 Å²	138.8	90%	0.902	82%	0.82	S	S	*	*			trans	-77.4	149.8	-169.3	-56.8	141.5	123.5	0	0	114.5
116	A	29.4	Very low	32.2	Very low	103 Å²	103	137.2 Å²	137.2	85%	0.851	82%	0.82	S	S	*	*			trans	-159.7	144	146.8	0	0	0	0	0	112.7
117	E	30.2	Very low	31.5	Very low	188 Å²	188	143.7 Å²	143.7	88%	0.879	82%	0.82	S	S	*	*			trans	-64.7	150.4	-166.7	-60.5	167.6	119	0	0	118.3
118	A	28.4	Very low	31.2	Very low	87 Å²	87	146.2 Å²	146.2	72%	0.719	82%	0.822	S	S	*	*			trans	50.7	133.6	132	0	0	0	0	0	122.8
119	I	33.1	Very low	30.8	Very low	167 Å²	167	147 Å²	147	86%	0.856	82%	0.815	S	S	*	*				178.1	133.1	105.5	-89.8	161.2	0	0	0	109.7
120	E	31.4	Very low	30.7	Very low	178 Å²	178	153.4 Å²	153.4	83%	0.832	82%	0.816	S	S	*	*			trans	-81.8	151.3	164.9	-60.9	-172.8	134.2	0	0	110.8
121	L	32.4	Very low	30.5	Very low	180 Å²	180	153.8 Å²	153.8	94%	0.942	81%	0.813	S	S	*	*				-170.8	168	127.1	-105.8	166	0	0	0	113.5
122	A	29	Very low	31.1	Very low	77 Å²	77	151.3 Å²	151.3	64%	0.636	81%	0.806	S	S	*	*			trans	-111.3	152.1	-160.3	0	0	0	0	0	114.7
123	V	30.8	Very low	30.9	Very low	134 Å²	134	153.2 Å²	153.2	81%	0.812	81%	0.805	S	S	*	*			trans	51.8	121	138.9	177	0	0	0	0	119.5
124	V	30.4	Very low	30.6	Very low	133 Å²	133	157.1 Å²	157.1	81%	0.806	81%	0.811	S	S	*	*				-175.8	107.4	124.2	147.8	0	0	0	0	113.4
125	K	28.6	Very low	30.1	Very low	206 Å²	206	160.4 Å²	160.4	90%	0.896	82%	0.816	S	S	*	*				30.4	125.2	124.2	-149.8	177.6	-167.7	173.5	0	122.3
126	G	25.5	Very low	29.9	Very low	73 Å²	73	157 Å²	157	75%	0.753	81%	0.813	S	S	*	*			trans	123.4	126.9	149.4	0	0	0	0	0	115.5
127	R	27.6	Very low	30.1	Very low	214 Å²	214	161 Å²	161	81%	0.808	81%	0.814	S	S	*	*			cis	103.9	96.4	9.9	-162	-166	-166.3	-140.5	6.8	117.1
128	R	27.7	Very low	31.2	Very low	240 Å²	240	156.7 Å²	156.7	91%	0.906	80%	0.803	S	S	*	*			trans	-169.4	123.7	144.9	-98.4	163.8	-172.5	-170	2.3	106.5
129	Q	28.6	Very low	31.2	Very low	142 Å²	142	161.2 Å²	161.2	66%	0.664	81%	0.814	S	S	*	*			cis	70.8	110.4	49.5	-72.5	-164.6	-34.6	0	0	116.2
130	R	26.5	Very low	31.2	Very low	241 Å²	241	164.9 Å²	164.9	91%	0.909	82%	0.817	S	S	*	*				-171	151.4	99	-101.2	177.5	173.7	171.6	-3.3	113.7
131	H	31.8	Very low	31	Very low	174 Å²	174	161.1 Å²	161.1	81%	0.806	82%	0.816	S	S	*	*			trans	-97.4	-176.9	165.5	-54.5	-94.1	0	0	0	109.8
132	P	42.7	Very low	30.9	Very low	107 Å²	107	158.1 Å²	158.1	70%	0.695	81%	0.811	S	S	*	*				-148.9	141.1	87.1	31.1	-10.6	0	0	0	118.3
133	H	31.9	Very low	31.8	Very low	155 Å²	155	160.8 Å²	160.8	72%	0.718	82%	0.821	S	S	*	*			trans	59.3	150.1	134.7	-53.9	-43.8	0	0	0	120.8
134	H	27.1	Very low	31.6	Very low	193 Å²	193	158 Å²	158	89%	0.894	82%	0.82	S	S	*	*			cis	-129.5	170.8	45.1	-76.3	-101.2	0	0	0	117
135	H	28.9	Very low	31.3	Very low	183 Å²	183	155.1 Å²	155.1	85%	0.847	82%	0.817	S	S	*	*			trans	-126.7	152.8	175.5	-96.3	-64.9	0	0	0	110.7
136	S	26.6	Very low	31.4	Very low	121 Å²	121	151.2 Å²	151.2	85%	0.846	82%	0.815	S	S	*	*			trans	-162.2	137.5	144.9	55.8	0	0	0	0	113.9
137	Q	32.3	Very low	31.6	Very low	187 Å²	187	156.9 Å²	156.9	87%	0.874	81%	0.814	S	S	*	*			trans	-172.7	176.6	173.3	-120.2	-159.4	27.1	0	0	106.2
138	P	54.8	Low	31.7	Very low	99 Å²	99	153.6 Å²	153.6	64%	0.643	81%	0.808	S	S	*	*			cis	-125.6	-173.9	-38.7	39.7	-25.6	0	0	0	111
139	L	27.4	Very low	31.9	Very low	181 Å²	181	149.1 Å²	149.1	95%	0.948	80%	0.802	S	S	*	*			trans	-148.8	158.1	156.1	-86.9	-170.8	0	0	0	113.2
140	R	33.5	Very low	32.1	Very low	244 Å²	244	147.6 Å²	147.6	92%	0.921	80%	0.802	S	S	*	*			trans	-113	149	176.6	-83.7	175.9	158.3	-175.2	-5.2	110.9
141	A	26	Very low	32.2	Very low	99 Å²	99	141.5 Å²	141.5	82%	0.818	80%	0.796	S	S	*	*			trans	-172.2	149.5	138.6	0	0	0	0	0	113.5
142	S	30.4	Very low	32.4	Very low	118 Å²	118	144.6 Å²	144.6	83%	0.825	80%	0.801	S	S	*	*			trans	-123.7	-174.5	160	-48.5	0	0	0	0	106.8
143	P	48.9	Very low	32.6	Very low	132 Å²	132	145.2 Å²	145.2	86%	0.857	81%	0.805	S	S	*	*			cis	-143.6	-172.2	5.2	44.7	-25.7	0	0	0	116.6
144	G	26.3	Very low	32.4	Very low	77 Å²	77	143.2 Å²	143.2	79%	0.794	81%	0.807	S	S	*	*			trans	125.4	138.9	141.5	0	0	0	0	0	120.1
145	G	25.3	Very low	32.6	Very low	71 Å²	71	143.1 Å²	143.1	73%	0.732	81%	0.807	S	S	*	*			trans	87	122.1	173.2	0	0	0	0	0	114.2
146	S	29.2	Very low	32.7	Very low	124 Å²	124	138.9 Å²	138.9	87%	0.867	80%	0.798	S	S	*	*			cis	74.2	140.7	42.3	94.4	0	0	0	0	113.3
147	R	29.9	Very low	32.9	Very low	192 Å²	192	145.1 Å²	145.1	73%	0.725	80%	0.803	S	S	*	*			cis	-163.7	148	15.5	177.9	174.8	171.7	-156.9	-17.6	111.8
148	E	30.6	Very low	32.7	Very low	146 Å²	146	140.9 Å²	140.9	68%	0.682	80%	0.8	S	S	*	*			trans	59.8	165	161.1	-74.9	157.2	-174.4	0	0	120.5
149	D	31.4	Very low	31.4	Very low	145 Å²	145	139.5 Å²	139.5	78%	0.775	80%	0.804	S	S	*	*			cis	-171.8	179.8	-39.4	-169	16.2	0	0	0	110
150	V	32.5	Very low	31.4	Very low	111 Å²	111	135.7 Å²	135.7	67%	0.673	79%	0.793	S	S	*	*			trans	84.8	95.6	159	-168.9	0	0	0	0	120.2
151	S	29.1	Very low	31.4	Very low	112 Å²	112	134.5 Å²	134.5	78%	0.783	79%	0.788	S	S	*	*				56.4	127.2	124.6	-56.1	0	0	0	0	125.8
152	R	36.3	Very low	31.7	Very low	240 Å²	240	139 Å²	139	91%	0.906	79%	0.793	S	S	*	*			trans	-25.6	168.6	142.1	-61.3	176.8	176	-177.2	-0.9	117.3
153	P	47.1	Very low	31.5	Very low	120 Å²	120	137.2 Å²	137.2	78%	0.779	79%	0.792	S	S	*	*			cis	-144	171.7	20.6	37.8	-15.5	0	0	0	120.4
154	C	27.9	Very low	30.7	Very low	113 Å²	113	136.3 Å²	136.3	76%	0.764	79%	0.789	S	S	*	*			trans	-19.5	144.8	152.7	-174.2	0	0	0	0	119.9
155	Q	30.5	Very low	31.1	Very low	190 Å²	190	140 Å²	140	89%	0.888	78%	0.783	S	S	*	*				-159.9	163.4	129.7	-116.9	175.8	49.7	0	0	114.1
156	S	31.7	Very low	31.3	Very low	94 Å²	94	143.6 Å²	143.6	66%	0.657	78%	0.781	S	S	*	*			trans	-142.2	160.5	167.4	68.7	0	0	0	0	108.9
157	W	29.9	Very low	31.3	Very low	252 Å²	252	143.9 Å²	143.9	96%	0.955	78%	0.781	S	S	*	*			trans	175.9	158	146.4	-108.2	44.9	0	0	0	113.8
158	A	27.1	Very low	31.9	Very low	98 Å²	98	141 Å²	141	81%	0.81	79%	0.788	S	S	*	*			trans	60.5	157.8	161.8	0	0	0	0	0	119.7
159	G	27.8	Very low	31.7	Very low	71 Å²	71	137.8 Å²	137.8	73%	0.732	79%	0.794	S	S	*	*			cis	161.6	119	-16.3	0	0	0	0	0	116.9
160	S	29	Very low	31.9	Very low	101 Å²	101	137.4 Å²	137.4	71%	0.706	80%	0.801	S	S	*	*			trans	72.6	105.3	145.1	-178.6	0	0	0	0	123.1
161	R	33	Very low	31.9	Very low	219 Å²	219	136.5 Å²	136.5	83%	0.826	81%	0.805	S	S	*	*			trans	86.6	143.9	130.4	-70.1	174.9	-167.7	-103.2	-0.4	123.8
162	Q	32.3	Very low	32.3	Very low	194 Å²	194	139.7 Å²	139.7	91%	0.907	81%	0.807	S	S	*	*			trans	75.9	147.4	150.5	-79	177.3	1.1	0	0	120.8
163	G	26.5	Very low	31.9	Very low	79 Å²	79	136.2 Å²	136.2	81%	0.814	81%	0.806	S	S	*	*			trans	132.7	82.3	161.5	0	0	0	0	0	116.4
164	S	32.4	Very low	31	Very low	113 Å²	113	134.7 Å²	134.7	79%	0.79	80%	0.804	S	S	*	*			trans	-81.8	136.9	168.8	175.3	0	0	0	0	111.4
165	K	32.8	Very low	31.7	Very low	155 Å²	155	135.4 Å²	135.4	67%	0.674	81%	0.807	S	S	*	*				-173.3	134.3	129	-105.9	177.4	173.5	-70.9	0	115.3
166	E	30.4	Very low	31.4	Very low	146 Å²	146	129.7 Å²	129.7	68%	0.682	80%	0.798	S	S	*	*			trans	32	117.5	138.3	-67	142.1	-148.4	0	0	120.7
167	C	30.2	Very low	31.9	Very low	130 Å²	130	131.5 Å²	131.5	88%	0.878	81%	0.808	S	S	*	*			trans	-110.1	127.9	153.8	-69.1	0	0	0	0	109.6
168	P	41.5	Very low	32	Very low	133 Å²	133	125.7 Å²	125.7	86%	0.864	80%	0.8	S	S	*	*			trans	-90.3	156.5	177.5	35.7	-34.3	0	0	0	112.5
169	G	27.2	Very low	32.6	Very low	78 Å²	78	126.4 Å²	126.4	80%	0.804	80%	0.797	S	S	*	*			trans	140.5	64.5	167.1	0	0	0	0	0	116.5
170	C	34	Very low	32.6	Very low	137 Å²	137	134.4 Å²	134.4	93%	0.926	81%	0.805	S	S	*	*			trans	-133.2	124.3	170.8	-79.3	0	0	0	0	112
171	A	32.7	Very low	32.6	Very low	91 Å²	91	133.6 Å²	133.6	75%	0.752	81%	0.805	S	S	*	*			trans	-147.9	116.5	158.9	0	0	0	0	0	106.2
172	Q	37.7	Very low	32.3	Very low	180 Å²	180	133.5 Å²	133.5	84%	0.841	81%	0.81	S	S	*	*				67.9	135.2	74.4	-67.2	-173.3	-1.7	0	0	111.8
173	L	27.9	Very low	32	Very low	166 Å²	166	127.7 Å²	127.7	87%	0.869	80%	0.803	S	S	*	*			cis	-131.5	173.1	47.7	-70.6	160.6	0	0	0	115.7
174	A	29	Very low	32.3	Very low	89 Å²	89	132.9 Å²	132.9	74%	0.736	81%	0.811	S	S	*	*			trans	-123.5	175.5	168.8	0	0	0	0	0	109.3
175	P	41.5	Very low	32.1	Very low	128 Å²	128	134.8 Å²	134.8	83%	0.831	81%	0.812	S	S	*	*				-144.4	175.7	72.9	36.5	-16.8	0	0	0	115.8
176	G	25	Very low	32.1	Very low	69 Å²	69	136.2 Å²	136.2	71%	0.711	82%	0.821	S	S	*	*			trans	-93.4	-164.7	170.6	0	0	0	0	0	113.6
177	P	42	Very low	32.4	Very low	133 Å²	133	134.2 Å²	134.2	86%	0.864	82%	0.821	S	S	*	*			cis	-134.4	-169.2	38.1	40.6	-22.4	0	0	0	117.1
178	T	31.3	Very low	32.8	Very low	129 Å²	129	134 Å²	134	79%	0.791	82%	0.818	S	S	*	*			trans	-70.8	165.6	-174.3	30.1	0	0	0	0	115.3
179	P	39.9	Very low	32.4	Very low	114 Å²	114	134 Å²	134	74%	0.74	81%	0.81	S	S	*	*			cis	-151.5	160.4	41.2	42.3	-20.8	0	0	0	122.4
180	R	29.2	Very low	32.7	Very low	239 Å²	239	136.3 Å²	136.3	90%	0.902	81%	0.811	S	S	*	*			trans	65.9	113.9	146	-79.6	-177.7	171.5	175	-2.1	122.4
181	A	27.2	Very low	32.5	Very low	84 Å²	84	137 Å²	137	69%	0.694	80%	0.8	S	S	*	*				86.7	102.2	121.5	0	0	0	0	0	122.2
182	F	28.2	Very low	32.3	Very low	216 Å²	216	138 Å²	138	95%	0.947	80%	0.797	S	S	*	*			trans	41.7	106.9	134.3	-64	-75.9	0	0	0	122.3
183	G	25.7	Very low	31.9	Very low	72 Å²	72	135.4 Å²	135.4	74%	0.742	80%	0.799	S	S	*	*			trans	-151.8	127.6	134.3	0	0	0	0	0	105.5
184	L	32.2	Very low	32	Very low	189 Å²	189	131 Å²	131	99%	0.99	79%	0.793	S	S	*	*				48.4	106.8	58.1	-83	176.9	0	0	0	112.8
185	D	28.4	Very low	32.2	Very low	152 Å²	152	138.8 Å²	138.8	81%	0.813	80%	0.804	S	S	*	*			trans	-108.8	136.7	-178.9	-164.7	-16.2	0	0	0	109.3
186	Q	32.2	Very low	31.9	Very low	185 Å²	185	144.2 Å²	144.2	86%	0.864	81%	0.808	S	S	*	*			trans	-160.4	112.4	172.6	-168.6	170.5	84.2	0	0	109.9
187	P	37.9	Very low	32.3	Very low	105 Å²	105	150 Å²	150	68%	0.682	81%	0.814	S	S	*	*			trans	-89.8	171.5	175.8	36.8	-36	0	0	0	112.1
188	P	38.7	Very low	31.8	Very low	124 Å²	124	151.1 Å²	151.1	81%	0.805	80%	0.804	S	S	*	*			cis	-123.9	174.4	0.2	31.9	-12.6	0	0	0	115.2
189	L	31.8	Very low	31.8	Very low	133 Å²	133	152.6 Å²	152.6	70%	0.696	81%	0.807	S	S	*	*			trans	-76.1	163.4	167.8	-95.4	161.3	0	0	0	112.1	E191	L189-E191 HydrophobicContact CD1-CG 4.28Å; L189-E191 HydrophobicContact CD2-CG 4.2Å
190	P	35.3	Very low	31.5	Very low	127 Å²	127	153.4 Å²	153.4	83%	0.825	80%	0.801	S	S	*	*				-128.5	158.2	96.2	36.3	-29.5	0	0	0	115.7
191	E	29.4	Very low	32	Very low	151 Å²	151	153.2 Å²	153.2	71%	0.706	80%	0.8	S	S	*	*			trans	-91.2	170	178	-70.6	-162	146	0	0	112.3	L189	L189-E191 HydrophobicContact CD1-CG 4.28Å; L189-E191 HydrophobicContact CD2-CG 4.2Å
192	T	28.6	Very low	32.3	Very low	113 Å²	113	158 Å²	158	69%	0.693	81%	0.81	S	S	*	*			cis	-159.7	178.7	-18.5	31.4	0	0	0	0	108.6
193	S	29.4	Very low	32.2	Very low	125 Å²	125	157.7 Å²	157.7	87%	0.874	80%	0.804	S	S	*	*			trans	78.1	143.7	172.9	84.5	0	0	0	0	116.6
194	G	30	Very low	32.6	Very low	73 Å²	73	160 Å²	160	75%	0.753	81%	0.809	S	S	*	*			cis	-161.5	128.8	-3.9	0	0	0	0	0	114.7
195	R	32	Very low	32.6	Very low	253 Å²	253	157 Å²	157	96%	0.955	80%	0.798	S	S	*	*			trans	34.8	117.8	156.7	-116.9	178.7	-177.7	-160.4	1.3	121.4
196	R	35.1	Very low	32.7	Very low	242 Å²	242	155.4 Å²	155.4	91%	0.913	79%	0.79	S	S	*	*			trans	-43.1	144.2	163.9	-55.8	168.5	175.8	171.2	-3.3	116
197	K	34.1	Very low	32.8	Very low	192 Å²	192	156.5 Å²	156.5	84%	0.835	79%	0.786	S	S	*	*				-158.9	127.8	125.7	-100.5	169.8	-176.4	-174.5	0	107.8
198	K	30.4	Very low	32.4	Very low	155 Å²	155	157.7 Å²	157.7	67%	0.674	79%	0.791	S	S	*	*				54.6	104.8	88.1	-164.5	-163.8	176.2	-158.2	0	112.1	E200	K198-E200 HydrophobicContact CD-CG 4.46Å; K198-E200 WeakPolarHBondContact CE-OE1 3.28Å; K198-E200 IonicContact NZ-OE1 3.21Å; K198-E200 PolarHBondContact NZ-OE1 3.48Å; K198-E200 PolarHBondContact O-N 2.78Å
199	L	33.2	Very low	31.9	Very low	160 Å²	160	156.4 Å²	156.4	84%	0.838	79%	0.785	S	S	*	*			trans	-75.5	109.4	175.8	-174.8	70.9	0	0	0	110.3
200	E	32.3	Very low	32.1	Very low	132 Å²	132	156 Å²	156	62%	0.617	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-101.7	132.6	165.7	-76	169.6	166.8	0	0	108.3	K198	K198-E200 HydrophobicContact CD-CG 4.46Å; K198-E200 WeakPolarHBondContact CE-OE1 3.28Å; K198-E200 IonicContact NZ-OE1 3.21Å; K198-E200 PolarHBondContact NZ-OE1 3.48Å; K198-E200 PolarHBondContact O-N 2.78Å
201	R	40	Very low	32	Very low	234 Å²	234	157.6 Å²	157.6	88%	0.883	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-82.3	123.5	170.3	-69.1	-172.6	179.2	104.3	-2.5	107.9
202	M	33.2	Very low	32.2	Very low	185 Å²	185	157.8 Å²	157.8	91%	0.911	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-76.5	161.1	174.2	-88.7	175.2	57.2	0	0	112.2
203	Y	26.3	Very low	33.4	Very low	209 Å²	209	157.6 Å²	157.6	82%	0.82	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-72	157.2	-174.2	-84.7	-113.4	0	0	0	114	V205	Y203-V205 HydrophobicContact CD1-CG2 3.86Å; Y203-V205 HydrophobicContact CG-CG2 4.45Å
204	S	34.4	Very low	33.6	Very low	122 Å²	122	159 Å²	159	85%	0.853	79%	0.786	S	S	*	*				-113.4	158.2	129	55.2	0	0	0	0	108.6
205	V	32	Very low	34.3	Very low	124 Å²	124	165.1 Å²	165.1	75%	0.752	79%	0.787	S	S	*	*			trans	-128.4	131.6	-171.6	172.1	0	0	0	0	110	Y203	Y203-V205 HydrophobicContact CD1-CG2 3.86Å; Y203-V205 HydrophobicContact CG-CG2 4.45Å
206	D	30.3	Very low	34.5	Very low	119 Å²	119	159 Å²	159	64%	0.636	78%	0.777	S	S	*	*			trans	-153.4	152.2	137.1	-158.1	8.7	0	0	0	111.2
207	R	33.8	Very low	34.9	Very low	209 Å²	209	157.7 Å²	157.7	79%	0.789	77%	0.773	S	S	*	*			trans	67.8	88.6	164.7	-43.8	-154.6	-178.2	-134.2	-21.2	120.7
208	V	29.7	Very low	34.8	Very low	129 Å²	129	157.3 Å²	157.3	78%	0.782	77%	0.771	S	S	*	*			trans	-8.8	125.4	132.1	-179.1	0	0	0	0	116.6
209	S	29.2	Very low	35.4	Very low	98 Å²	98	155.6 Å²	155.6	69%	0.685	78%	0.776	S	S	*	*				-169.2	114	110	-113.5	0	0	0	0	112.8
210	D	34.5	Very low	35.5	Very low	125 Å²	125	157.8 Å²	157.8	67%	0.668	78%	0.779	S	S	*	*			trans	57.1	125.2	132.9	-41.3	-46	0	0	0	123.8
211	D	34.4	Very low	36.6	Very low	159 Å²	159	159.8 Å²	159.8	85%	0.85	79%	0.788	S	S	*	*			trans	79.5	152.4	143.6	-70.3	-24.2	0	0	0	124.8
212	I	33.8	Very low	37.2	Very low	156 Å²	156	156.2 Å²	156.2	80%	0.8	79%	0.786	S	S	*	*			trans	-151.8	156.3	-155.9	-67	170.7	0	0	0	106.1
213	P	53.6	Low	38	Very low	108 Å²	108	155.3 Å²	155.3	70%	0.701	79%	0.785	S	S	*	*			cis	-117.6	-163.8	-7.2	33	-12	0	0	0	111.7
214	I	33.2	Very low	39	Very low	154 Å²	154	153.3 Å²	153.3	79%	0.79	78%	0.78	S	S	*	*				-162.2	151.5	81.9	-86.8	173.7	0	0	0	111.4
215	R	45.1	Very low	40	Very low	203 Å²	203	149.8 Å²	149.8	77%	0.766	76%	0.756	S	S	*	*			trans	-98.5	117	-168.2	171.4	-171.9	-176.5	-102.8	7.2	112.7
216	T	36.4	Very low	40.9	Very low	124 Å²	124	152.8 Å²	152.8	76%	0.761	76%	0.759	S	S	*	*			trans	-123.5	122.8	164.7	49.1	0	0	0	0	111.6	F218	T216-F218 PolarHBondContact O-N 2.63Å
217	W	43.3	Very low	42.1	Very low	215 Å²	215	154.8 Å²	154.8	81%	0.814	77%	0.765	S	S	*	*			trans	-96.5	80.7	-178.7	-99.5	59	0	0	0	110.5
218	F	32.1	Very low	43.2	Very low	183 Å²	183	148.2 Å²	148.2	80%	0.803	75%	0.747	S	S	*	*			trans	-134.4	124.1	168.6	-81.5	-83.4	0	0	0	110.2	T216 K220	T216-F218 PolarHBondContact O-N 2.63Å; F218-K220 PolarHBondContact O-N 3.2Å
219	P	41.6	Very low	44.5	Very low	119 Å²	119	143.6 Å²	143.6	77%	0.773	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-61.8	123.3	164.8	-15.7	29.9	0	0	0	108.2	E221	P219-E221 PolarHBondContact O-N 3.25Å
220	K	37.1	Very low	46.2	Very low	206 Å²	206	142.3 Å²	142.3	90%	0.896	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-64.1	125.5	170.3	-83.9	-173.1	174.1	-178.8	0	108.9	F218	F218-K220 PolarHBondContact O-N 3.2Å
221	E	54.5	Low	47.8	Very low	175 Å²	175	140.5 Å²	140.5	82%	0.818	71%	0.705	S	S	*	*	S	Bend	trans	-61.7	165.7	168.6	-63.9	171.8	-170	0	0	110.3	P219	P219-E221 PolarHBondContact O-N 3.25Å
222	N	52	Low	49.3	Very low	158 Å²	158	136 Å²	136	85%	0.845	68%	0.683	S	S	*	*			trans	74.2	63.6	-176.7	-51.8	-38.3	0	0	0	116.7
223	L	49.8	Very low	50.7	Low	167 Å²	167	135.3 Å²	135.3	87%	0.874	68%	0.678	S	S	*	*			trans	-146.8	27.5	149.7	-115.9	162.3	0	0	0	114.3	S225	L223-S225 PolarHBondContact O-N 2.94Å
224	F	47.1	Very low	51.4	Low	166 Å²	166	135.7 Å²	135.7	73%	0.728	67%	0.671	S	S	*	*			trans	-72.2	94.7	162.7	-108.1	-79.7	0	0	0	109.1	A229	F224-A229 HydrophobicContact CD1-CB 4.24Å
225	S	57.2	Low	52.9	Low	48 Å²	48	130.3 Å²	130.3	34%	0.336	65%	0.649	S	S	.	*			trans	-63.6	144.2	172.5	93.1	0	0	0	0	110.3	L223 Q227 T228 A229	L223-S225 PolarHBondContact O-N 2.94Å; S225-Q227 PolarHBondContact O-N 2.91Å; S225-Q227 PolarHBondContact OG-N 3.44Å; S225-T228 WeakPolarHBondContact O-CB 3.28Å; S225-T228 PolarHBondContact O-N 3.5Å; S225-T228 PolarHBondContact OG-N 2.91Å; S225-T228 PolarHBondContact OG-OG1 3.29Å; S225-A229 PolarHBondContact O-N 3.05Å
226	F	50.4	Low	54.1	Low	188 Å²	188	125.4 Å²	125.4	83%	0.825	64%	0.637	S	S	*	*	H	α-helix	trans	-56.4	-33.7	176.9	-77.3	-86.7	0	0	0	112.5	T230	F226-T230 WeakPolarHBondContact O-CB 3.43Å; F226-T230 PolarHBondContact O-N 3.04Å; F226-T230 PolarHBondContact O-OG1 3.41Å
227	Q	55.3	Low	55.5	Low	161 Å²	161	122.4 Å²	122.4	75%	0.752	62%	0.621	S	S	*	*	H	α-helix	trans	-66.3	-45.3	175.9	-63.4	-179.2	-0.3	0	0	111.2	S225 T230 T231	S225-Q227 PolarHBondContact O-N 2.91Å; S225-Q227 PolarHBondContact OG-N 3.44Å; Q227-T230 PolarHBondContact O-N 2.92Å; Q227-T231 WeakPolarHBondContact O-CB 3.43Å; Q227-T231 PolarHBondContact O-N 3.3Å; Q227-T231 PolarHBondContact O-OG1 2.96Å
228	T	57.5	Low	56.9	Low	70 Å²	70	116.5 Å²	116.5	43%	0.429	61%	0.609	S	S	.	*	H	α-helix	trans	-60.5	-50	176.2	-47.3	0	0	0	0	110.7	S225 T230 T231 T232	S225-T228 WeakPolarHBondContact O-CB 3.28Å; S225-T228 PolarHBondContact O-N 3.5Å; S225-T228 PolarHBondContact OG-N 2.91Å; S225-T228 PolarHBondContact OG-OG1 3.29Å; T228-T230 PolarHBondContact O-N 3.31Å; T228-T231 PolarHBondContact O-N 3.2Å; T228-T232 PolarHBondContact O-N 3.07Å; T228-T232 PolarHBondContact O-OG1 3.12Å
229	A	56.9	Low	58.7	Low	33 Å²	33	114.9 Å²	114.9	27%	0.273	60%	0.602	S	S	.	*	H	α-helix	trans	-58	-47.5	178.6	0	0	0	0	0	112.2	F224 S225 T231 T232 M233	F224-A229 HydrophobicContact CD1-CB 4.24Å; S225-A229 PolarHBondContact O-N 3.05Å; A229-T231 PolarHBondContact O-N 3.04Å; A229-T232 PolarHBondContact O-N 3.46Å; A229-M233 WeakPolarHBondContact O-CG 3.49Å; A229-M233 PolarHBondContact O-N 3.14Å
230	T	63.6	Low	60.4	Low	71 Å²	71	117.3 Å²	117.3	44%	0.436	60%	0.595	S	S	.	*	H	α-helix	trans	-61.3	-44.8	178	-57.5	0	0	0	0	111.7	F226 Q227 T228 T232 M233 Q234	F226-T230 WeakPolarHBondContact O-CB 3.43Å; F226-T230 PolarHBondContact O-N 3.04Å; F226-T230 PolarHBondContact O-OG1 3.41Å; Q227-T230 PolarHBondContact O-N 2.92Å; T228-T230 PolarHBondContact O-N 3.31Å; T230-T232 PolarHBondContact O-N 3.34Å; T230-M233 PolarHBondContact O-N 3.38Å; T230-Q234 WeakPolarHBondContact O-CG 2.83Å; T230-Q234 PolarHBondContact O-N 2.86Å
231	T	68.4	Low	62.5	Low	87 Å²	87	108.6 Å²	108.6	53%	0.534	56%	0.564	S	S	.	*	H	α-helix	trans	-64.3	-41.2	179.1	-55.7	0	0	0	0	111.3	Q227 T228 A229 Q234 A235	Q227-T231 WeakPolarHBondContact O-CB 3.43Å; Q227-T231 PolarHBondContact O-N 3.3Å; Q227-T231 PolarHBondContact O-OG1 2.96Å; T228-T231 PolarHBondContact O-N 3.2Å; A229-T231 PolarHBondContact O-N 3.04Å; T231-Q234 PolarHBondContact O-N 3.14Å; T231-A235 WeakPolarHBondContact O-CB 3.06Å; T231-A235 PolarHBondContact O-N 3.35Å
232	T	67.3	Low	63.7	Low	65 Å²	65	106.6 Å²	106.6	40%	0.399	55%	0.55	S	S	.	.	H	α-helix	trans	-64.4	-42.1	175.3	-55.4	0	0	0	0	111.8	T228 A229 T230 A235 I236	T228-T232 PolarHBondContact O-N 3.07Å; T228-T232 PolarHBondContact O-OG1 3.12Å; A229-T232 PolarHBondContact O-N 3.46Å; T230-T232 PolarHBondContact O-N 3.34Å; T232-A235 PolarHBondContact O-N 2.79Å; T232-I236 HydrophobicContact CG2-CD1 3.87Å; T232-I236 HydrophobicContact CG2-CG1 4.49Å; T232-I236 WeakPolarHBondContact O-CB 3.48Å; T232-I236 VanDerWaalsContact O-CG1 3.27Å; T232-I236 WeakPolarHBondContact O-CG1 3.48Å; T232-I236 PolarHBondContact O-N 2.85Å
233	M	63.2	Low	65	Low	141 Å²	141	101.9 Å²	101.9	70%	0.695	53%	0.532	S	S	*	.	H	α-helix	trans	-65.4	-38.6	175.8	-72.6	-178.1	68.5	0	0	112.9	A229 T230 S237	A229-M233 WeakPolarHBondContact O-CG 3.49Å; A229-M233 PolarHBondContact O-N 3.14Å; T230-M233 PolarHBondContact O-N 3.38Å; M233-S237 PolarHBondContact O-N 3.23Å; M233-S237 PolarHBondContact O-OG 2.98Å
234	Q	68.1	Low	66.3	Low	116 Å²	116	97.6 Å²	97.6	54%	0.542	51%	0.508	S	S	.	.	H	α-helix	trans	-64.6	-44.6	173.4	-72.6	175.2	-3.7	0	0	111.5	T230 T231 I236 S237 V238	T230-Q234 WeakPolarHBondContact O-CG 2.83Å; T230-Q234 PolarHBondContact O-N 2.86Å; T231-Q234 PolarHBondContact O-N 3.14Å; Q234-I236 PolarHBondContact O-N 3.31Å; Q234-S237 PolarHBondContact O-N 3.33Å; Q234-S237 PolarHBondContact O-OG 2.74Å; Q234-V238 WeakPolarHBondContact O-CG2 3.44Å; Q234-V238 PolarHBondContact O-N 3.25Å
235	A	63.3	Low	68	Low	41 Å²	41	97.3 Å²	97.3	34%	0.339	50%	0.502	S	S	.	.	H	α-helix	trans	-59.9	-47.5	175	0	0	0	0	0	111.8	T231 T232 S237 V238 F239	T231-A235 WeakPolarHBondContact O-CB 3.06Å; T231-A235 PolarHBondContact O-N 3.35Å; T232-A235 PolarHBondContact O-N 2.79Å; A235-S237 VanDerWaalsContact C-N 3.34Å; A235-S237 PolarHBondContact O-N 2.65Å; A235-V238 PolarHBondContact O-N 3.12Å; A235-F239 WeakPolarHBondContact O-CD2 3.23Å; A235-F239 PolarHBondContact O-N 3.29Å
236	I	70.8	Confident	69.3	Low	100 Å²	100	100.1 Å²	100.1	51%	0.513	51%	0.508	S	S	.	.	H	α-helix	trans	-60.5	-41.9	178.6	-70.5	167.1	0	0	0	111.3	T232 Q234 F239 R240	T232-I236 HydrophobicContact CG2-CD1 3.87Å; T232-I236 HydrophobicContact CG2-CG1 4.49Å; T232-I236 WeakPolarHBondContact O-CB 3.48Å; T232-I236 VanDerWaalsContact O-CG1 3.27Å; T232-I236 WeakPolarHBondContact O-CG1 3.48Å; T232-I236 PolarHBondContact O-N 2.85Å; Q234-I236 PolarHBondContact O-N 3.31Å; I236-F239 PolarHBondContact O-N 2.83Å; I236-R240 VanDerWaalsContact O-CB 3.3Å; I236-R240 WeakPolarHBondContact O-CB 3.32Å; I236-R240 PolarHBondContact O-N 2.84Å
237	S	65.4	Low	70.9	Confident	61 Å²	61	98.8 Å²	98.8	43%	0.427	50%	0.498	S	S	.	.	H	α-helix	trans	-68.9	-37.9	178.6	73.5	0	0	0	0	112.5	M233 Q234 A235 R240 G241	M233-S237 PolarHBondContact O-N 3.23Å; M233-S237 PolarHBondContact O-OG 2.98Å; Q234-S237 PolarHBondContact O-N 3.33Å; Q234-S237 PolarHBondContact O-OG 2.74Å; A235-S237 VanDerWaalsContact C-N 3.34Å; A235-S237 PolarHBondContact O-N 2.65Å; S237-R240 PolarHBondContact O-N 3.22Å; S237-G241 PolarHBondContact O-N 3.05Å
238	V	72.6	Confident	72.2	Confident	90 Å²	90	98 Å²	98	55%	0.545	49%	0.488	S	S	.	.	H	α-helix	trans	-64.1	-45.1	173.4	170	0	0	0	0	111.5	Q234 A235 G241 Y242	Q234-V238 WeakPolarHBondContact O-CG2 3.44Å; Q234-V238 PolarHBondContact O-N 3.25Å; A235-V238 PolarHBondContact O-N 3.12Å; V238-G241 PolarHBondContact O-N 2.88Å; V238-Y242 WeakPolarHBondContact O-CB 3.26Å; V238-Y242 PolarHBondContact O-N 2.82Å
239	F	70.5	Confident	73.7	Confident	150 Å²	150	101.2 Å²	101.2	66%	0.658	50%	0.496	S	S	*	.	H	α-helix	trans	-65.4	-41.2	175.9	-80.3	-63.5	0	0	0	112.4	A235 I236 Y242 A243	A235-F239 WeakPolarHBondContact O-CD2 3.23Å; A235-F239 PolarHBondContact O-N 3.29Å; I236-F239 PolarHBondContact O-N 2.83Å; F239-Y242 PolarHBondContact O-N 2.89Å; F239-A243 PolarHBondContact O-N 3.44Å
240	R	76.9	Confident	75.2	Confident	170 Å²	170	108 Å²	108	64%	0.642	51%	0.514	S	S	*	.	H	α-helix	trans	-60	-47.5	173.4	-167.6	173	77.4	-157.8	5	110.8	I236 S237 Y242 A243 E244	I236-R240 VanDerWaalsContact O-CB 3.3Å; I236-R240 WeakPolarHBondContact O-CB 3.32Å; I236-R240 PolarHBondContact O-N 2.84Å; S237-R240 PolarHBondContact O-N 3.22Å; R240-Y242 VanDerWaalsContact C-N 3.33Å; R240-Y242 PolarHBondContact O-N 3.4Å; R240-A243 PolarHBondContact O-N 3.28Å; R240-E244 WeakPolarHBondContact O-CB 3.42Å; R240-E244 PolarHBondContact O-N 3.1Å
241	G	80.8	Confident	76.3	Confident	22 Å²	22	108.6 Å²	108.6	23%	0.227	51%	0.512	C	S	.	.	H	α-helix	trans	-65.1	-30.3	175.6	0	0	0	0	0	114	S237 V238 R245	S237-G241 PolarHBondContact O-N 3.05Å; V238-G241 PolarHBondContact O-N 2.88Å; G241-R245 WeakPolarHBondContact O-CB 3.46Å; G241-R245 VanDerWaalsContact O-CG 3.29Å; G241-R245 WeakPolarHBondContact O-CG 3.11Å; G241-R245 PolarHBondContact O-N 3.24Å; G241-R245 PolarHBondContact O-NE 3.27Å
242	Y	80	Confident	77.3	Confident	134 Å²	134	109.8 Å²	109.8	53%	0.525	52%	0.515	S	S	.	.	H	α-helix	trans	-69.1	-46.6	170.9	177.7	-92	0	0	0	111.5	V238 F239 R240 E244 R245 K246	V238-Y242 WeakPolarHBondContact O-CB 3.26Å; V238-Y242 PolarHBondContact O-N 2.82Å; F239-Y242 PolarHBondContact O-N 2.89Å; R240-Y242 VanDerWaalsContact C-N 3.33Å; R240-Y242 PolarHBondContact O-N 3.4Å; Y242-E244 VanDerWaalsContact C-N 3.33Å; Y242-E244 PolarHBondContact O-N 2.59Å; Y242-R245 PolarHBondContact O-N 2.86Å; Y242-K246 HydrophobicContact CE1-CD 4.01Å; Y242-K246 WeakPolarHBondContact O-CB 3.2Å; Y242-K246 PolarHBondContact O-N 3.18Å
243	A	79.1	Confident	78.3	Confident	58 Å²	58	110.7 Å²	110.7	48%	0.479	52%	0.517	S	S	.	.	H	α-helix	trans	-60.5	-41.9	175.7	0	0	0	0	0	111.8	F239 R240 K246 R247	F239-A243 PolarHBondContact O-N 3.44Å; R240-A243 PolarHBondContact O-N 3.28Å; A243-K246 CarbonylContact O-C 3.52Å; A243-K246 WeakPolarHBondContact O-CB 3.44Å; A243-K246 PolarHBondContact O-N 3.1Å; A243-R247 PolarHBondContact O-N 2.86Å
244	E	78.3	Confident	79.3	Confident	78 Å²	78	106.9 Å²	106.9	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-70	-37.4	178.9	-156.3	-177.4	129	0	0	112.4	R240 Y242 R247 R248	R240-E244 WeakPolarHBondContact O-CB 3.42Å; R240-E244 PolarHBondContact O-N 3.1Å; Y242-E244 VanDerWaalsContact C-N 3.33Å; Y242-E244 PolarHBondContact O-N 2.59Å; E244-R247 WeakPolarHBondContact O-CB 3.24Å; E244-R247 PolarHBondContact O-N 3.24Å; E244-R248 PolarHBondContact O-N 3.27Å; E244-R248 IonicContact OE1-CZ 2.69Å; E244-R248 IonicContact OE1-NH1 3.78Å; E244-R248 PolarHBondContact OE1-NH1 2.98Å; E244-R248 IonicContact OE1-NH2 2.84Å; E244-R248 PolarHBondContact OE1-NH2 3.06Å
245	R	82.1	Confident	80.2	Confident	159 Å²	159	103 Å²	103	60%	0.6	49%	0.493	S	S	*	.	H	α-helix	trans	-63.8	-39.9	168.8	-78.6	174.6	-73.5	-160	1.1	111.8	G241 Y242 R247 R248 K249	G241-R245 WeakPolarHBondContact O-CB 3.46Å; G241-R245 VanDerWaalsContact O-CG 3.29Å; G241-R245 WeakPolarHBondContact O-CG 3.11Å; G241-R245 PolarHBondContact O-N 3.24Å; G241-R245 PolarHBondContact O-NE 3.27Å; Y242-R245 PolarHBondContact O-N 2.86Å; R245-R247 VanDerWaalsContact C-N 3.29Å; R245-R247 PolarHBondContact O-N 2.79Å; R245-R248 PolarHBondContact O-N 3.48Å; R245-K249 WeakPolarHBondContact O-CB 3.38Å; R245-K249 PolarHBondContact O-N 3.5Å
246	K	84.6	Confident	81.3	Confident	108 Å²	108	103.4 Å²	103.4	47%	0.47	49%	0.493	S	S	.	.	H	α-helix	trans	-67.5	-28.2	175.1	-164.3	169.5	-172.7	169.9	0	112.3	Y242 A243 R250	Y242-K246 HydrophobicContact CE1-CD 4.01Å; Y242-K246 WeakPolarHBondContact O-CB 3.2Å; Y242-K246 PolarHBondContact O-N 3.18Å; A243-K246 CarbonylContact O-C 3.52Å; A243-K246 WeakPolarHBondContact O-CB 3.44Å; A243-K246 PolarHBondContact O-N 3.1Å; K246-R250 WeakPolarHBondContact O-CG 3.27Å
247	R	84.6	Confident	82.3	Confident	159 Å²	159	102.2 Å²	102.2	60%	0.6	49%	0.49	S	S	*	.	H	α-helix	trans	-71.5	-57	169.7	178.8	-178.9	167.5	172.7	-1.1	111.3	A243 E244 R245 K249 R250 E251	A243-R247 PolarHBondContact O-N 2.86Å; E244-R247 WeakPolarHBondContact O-CB 3.24Å; E244-R247 PolarHBondContact O-N 3.24Å; R245-R247 VanDerWaalsContact C-N 3.29Å; R245-R247 PolarHBondContact O-N 2.79Å; R247-K249 PolarHBondContact O-N 2.83Å; R247-K249 VanDerWaalsContact O-N 3.17Å; R247-R250 WeakPolarHBondContact O-CB 3.33Å; R247-R250 PolarHBondContact O-N 2.84Å; R247-E251 IonicContact CZ-OE1 3.84Å; R247-E251 VanDerWaalsContact CZ-OE1 3.32Å; R247-E251 IonicContact NE-OE1 3.07Å; R247-E251 PolarHBondContact NE-OE1 3.16Å; R247-E251 IonicContact NE-OE2 2.58Å; R247-E251 IonicContact NH2-OE1 3.67Å; R247-E251 PolarHBondContact NH2-OE1 3.36Å; R247-E251 PolarHBondContact O-N 2.87Å
248	R	82.6	Confident	83.4	Confident	145 Å²	145	104.8 Å²	104.8	55%	0.547	50%	0.498	S	S	.	.	H	α-helix	trans	-56.8	-32.9	178.3	-74.9	-163.2	-176.2	83.2	9.9	112.8	E244 R245 E251 N252	E244-R248 PolarHBondContact O-N 3.27Å; E244-R248 IonicContact OE1-CZ 2.69Å; E244-R248 IonicContact OE1-NH1 3.78Å; E244-R248 PolarHBondContact OE1-NH1 2.98Å; E244-R248 IonicContact OE1-NH2 2.84Å; E244-R248 PolarHBondContact OE1-NH2 3.06Å; R245-R248 PolarHBondContact O-N 3.48Å; R248-E251 WeakPolarHBondContact CA-OE2 3.34Å; R248-E251 PolarHBondContact O-N 3.49Å; R248-N252 WeakPolarHBondContact O-CB 3.42Å; R248-N252 PolarHBondContact O-N 3.21Å
249	K	88.4	Confident	84.1	Confident	137 Å²	137	105.5 Å²	105.5	60%	0.596	50%	0.496	S	S	*	.	H	α-helix	trans	-61.3	-49	172.2	-178.8	165.5	-179.3	174.2	0	112.1	R245 R247 E251 N252 D253	R245-K249 WeakPolarHBondContact O-CB 3.38Å; R245-K249 PolarHBondContact O-N 3.5Å; R247-K249 PolarHBondContact O-N 2.83Å; R247-K249 VanDerWaalsContact O-N 3.17Å; K249-E251 VanDerWaalsContact C-N 3.29Å; K249-E251 PolarHBondContact O-N 2.92Å; K249-N252 PolarHBondContact O-N 2.79Å; K249-D253 WeakPolarHBondContact CG-OD2 3.41Å; K249-D253 WeakPolarHBondContact O-CB 3.5Å; K249-D253 PolarHBondContact O-N 2.82Å
250	R	89.8	Confident	85	Confident	177 Å²	177	105.7 Å²	105.7	67%	0.668	49%	0.492	S	S	*	.	H	α-helix	trans	-60.8	-38.4	176.3	-65.1	172.9	-169.8	-104.2	14.4	112.4	K246 R247 S254	K246-R250 WeakPolarHBondContact O-CG 3.27Å; R247-R250 WeakPolarHBondContact O-CB 3.33Å; R247-R250 PolarHBondContact O-N 2.84Å; R250-S254 WeakPolarHBondContact O-CB 3.36Å; R250-S254 PolarHBondContact O-N 2.94Å; R250-S254 PolarHBondContact O-OG 3.34Å
251	E	86.5	Confident	85.5	Confident	82 Å²	82	102 Å²	102	38%	0.383	49%	0.485	S	S	.	.	H	α-helix	trans	-67.8	-39.7	177.9	-68.2	165.5	158.2	0	0	111.3	R247 R248 K249 S254 A255	R247-E251 IonicContact CZ-OE1 3.84Å; R247-E251 VanDerWaalsContact CZ-OE1 3.32Å; R247-E251 IonicContact NE-OE1 3.07Å; R247-E251 PolarHBondContact NE-OE1 3.16Å; R247-E251 IonicContact NE-OE2 2.58Å; R247-E251 IonicContact NH2-OE1 3.67Å; R247-E251 PolarHBondContact NH2-OE1 3.36Å; R247-E251 PolarHBondContact O-N 2.87Å; R248-E251 WeakPolarHBondContact CA-OE2 3.34Å; R248-E251 PolarHBondContact O-N 3.49Å; K249-E251 VanDerWaalsContact C-N 3.29Å; K249-E251 PolarHBondContact O-N 2.92Å; E251-S254 PolarHBondContact O-OG 2.74Å; E251-A255 WeakPolarHBondContact O-CB 3.46Å; E251-A255 PolarHBondContact O-N 2.99Å
252	N	87.9	Confident	85.8	Confident	112 Å²	112	106.8 Å²	106.8	60%	0.599	50%	0.5	S	S	*	.	H	α-helix	trans	-70.9	-42.5	174	-168.1	-0.8	0	0	0	112.3	R248 K249 S254 A255 S256	R248-N252 WeakPolarHBondContact O-CB 3.42Å; R248-N252 PolarHBondContact O-N 3.21Å; K249-N252 PolarHBondContact O-N 2.79Å; N252-S254 VanDerWaalsContact C-N 3.28Å; N252-S254 PolarHBondContact O-N 3.43Å; N252-A255 PolarHBondContact O-N 2.93Å; N252-S256 WeakPolarHBondContact O-CB 3.1Å; N252-S256 PolarHBondContact O-N 2.75Å
253	D	88.4	Confident	86	Confident	84 Å²	84	108 Å²	108	45%	0.449	50%	0.503	S	S	.	.	H	α-helix	trans	-58.3	-41.4	175.1	-69.2	-27.9	0	0	0	110.7	K249 S256 V257	K249-D253 WeakPolarHBondContact CG-OD2 3.41Å; K249-D253 WeakPolarHBondContact O-CB 3.5Å; K249-D253 PolarHBondContact O-N 2.82Å; D253-S256 PolarHBondContact O-N 2.78Å; D253-V257 WeakPolarHBondContact O-CG2 3.43Å; D253-V257 PolarHBondContact O-N 3.45Å; D253-V257 VanDerWaalsContact O-N 3.12Å
254	S	84.7	Confident	86.3	Confident	61 Å²	61	111.1 Å²	111.1	43%	0.427	51%	0.506	S	S	.	.	H	α-helix	trans	-69.7	-41.9	175.9	77.5	0	0	0	0	112.6	R250 E251 N252 S256 V257 I258	R250-S254 WeakPolarHBondContact O-CB 3.36Å; R250-S254 PolarHBondContact O-N 2.94Å; R250-S254 PolarHBondContact O-OG 3.34Å; E251-S254 PolarHBondContact O-OG 2.74Å; N252-S254 VanDerWaalsContact C-N 3.28Å; N252-S254 PolarHBondContact O-N 3.43Å; S254-S256 VanDerWaalsContact C-N 3.32Å; S254-S256 PolarHBondContact O-N 2.78Å; S254-V257 PolarHBondContact O-N 3.4Å; S254-I258 WeakPolarHBondContact O-CG1 3.44Å; S254-I258 PolarHBondContact O-N 2.97Å
255	A	86.3	Confident	86.5	Confident	36 Å²	36	112.3 Å²	112.3	30%	0.298	51%	0.511	S	S	.	.	H	α-helix	trans	-60	-40.7	173.5	0	0	0	0	0	112	E251 N252 V257 I258 Q259	E251-A255 WeakPolarHBondContact O-CB 3.46Å; E251-A255 PolarHBondContact O-N 2.99Å; N252-A255 PolarHBondContact O-N 2.93Å; A255-V257 PolarHBondContact O-N 2.99Å; A255-I258 PolarHBondContact O-N 3.19Å; A255-Q259 WeakPolarHBondContact O-CB 3.43Å; A255-Q259 WeakPolarHBondContact O-CG 3.28Å; A255-Q259 PolarHBondContact O-N 2.9Å
256	S	87.9	Confident	86.2	Confident	48 Å²	48	109.1 Å²	109.1	34%	0.336	51%	0.506	S	S	.	.	H	α-helix	trans	-62.2	-40	175.2	-179.3	0	0	0	0	112.4	N252 D253 S254 R260	N252-S256 WeakPolarHBondContact O-CB 3.1Å; N252-S256 PolarHBondContact O-N 2.75Å; D253-S256 PolarHBondContact O-N 2.78Å; S254-S256 VanDerWaalsContact C-N 3.32Å; S254-S256 PolarHBondContact O-N 2.78Å; S256-R260 VanDerWaalsContact O-CB 3.22Å; S256-R260 WeakPolarHBondContact O-CB 3.23Å; S256-R260 PolarHBondContact O-N 3.41Å
257	V	90.8	Very high	86	Confident	75 Å²	75	112.4 Å²	112.4	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-65.8	-43.9	172.9	172.6	0	0	0	0	111.4	D253 S254 A255 R260 N261	D253-V257 WeakPolarHBondContact O-CG2 3.43Å; D253-V257 PolarHBondContact O-N 3.45Å; D253-V257 VanDerWaalsContact O-N 3.12Å; S254-V257 PolarHBondContact O-N 3.4Å; A255-V257 PolarHBondContact O-N 2.99Å; V257-R260 PolarHBondContact O-N 3.02Å; V257-N261 WeakPolarHBondContact O-CB 3.35Å; V257-N261 PolarHBondContact O-N 3.3Å; V257-N261 PolarHBondContact O-ND2 3.14Å
258	I	87.9	Confident	85.3	Confident	116 Å²	116	109.8 Å²	109.8	60%	0.595	51%	0.511	S	S	*	.	H	α-helix	trans	-61.8	-48.6	177.4	-67.4	164.6	0	0	0	110.7	S254 A255 R260 N261 F262	S254-I258 WeakPolarHBondContact O-CG1 3.44Å; S254-I258 PolarHBondContact O-N 2.97Å; A255-I258 PolarHBondContact O-N 3.19Å; I258-R260 PolarHBondContact O-N 2.58Å; I258-N261 PolarHBondContact O-N 2.89Å; I258-F262 WeakPolarHBondContact O-CB 3.4Å; I258-F262 PolarHBondContact O-N 2.81Å
259	Q	88	Confident	84.6	Confident	105 Å²	105	106.4 Å²	106.4	49%	0.491	51%	0.506	S	S	.	.	H	α-helix	trans	-61.8	-42.1	176.8	-71.9	-177.1	18	0	0	112.2	A255 N261 F262 R263	A255-Q259 WeakPolarHBondContact O-CB 3.43Å; A255-Q259 WeakPolarHBondContact O-CG 3.28Å; A255-Q259 PolarHBondContact O-N 2.9Å; Q259-N261 VanDerWaalsContact C-N 3.34Å; Q259-N261 PolarHBondContact O-N 3.07Å; Q259-F262 PolarHBondContact O-N 3.48Å; Q259-R263 WeakPolarHBondContact O-CB 3.45Å; Q259-R263 VanDerWaalsContact O-CG 3.28Å; Q259-R263 WeakPolarHBondContact O-CG 3.23Å; Q259-R263 PolarHBondContact O-N 2.84Å
260	R	88.6	Confident	83.1	Confident	153 Å²	153	101.5 Å²	101.5	58%	0.577	50%	0.495	S	S	*	.	H	α-helix	trans	-60.5	-43.1	175.4	-178.2	-175.7	-78.7	100.9	-9.9	111.3	S256 V257 I258 K264	S256-R260 VanDerWaalsContact O-CB 3.22Å; S256-R260 WeakPolarHBondContact O-CB 3.23Å; S256-R260 PolarHBondContact O-N 3.41Å; V257-R260 PolarHBondContact O-N 3.02Å; I258-R260 PolarHBondContact O-N 2.58Å; R260-K264 WeakPolarHBondContact O-CB 3.19Å; R260-K264 PolarHBondContact O-N 3.29Å
261	N	88.3	Confident	81.5	Confident	94 Å²	94	96.4 Å²	96.4	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-68.1	-41	177.1	-76.8	-26.3	0	0	0	112.3	V257 I258 Q259 K264 H265	V257-N261 WeakPolarHBondContact O-CB 3.35Å; V257-N261 PolarHBondContact O-N 3.3Å; V257-N261 PolarHBondContact O-ND2 3.14Å; I258-N261 PolarHBondContact O-N 2.89Å; Q259-N261 VanDerWaalsContact C-N 3.34Å; Q259-N261 PolarHBondContact O-N 3.07Å; N261-K264 WeakPolarHBondContact O-CB 3.47Å; N261-K264 PolarHBondContact O-N 2.97Å; N261-K264 VanDerWaalsContact O-N 3.15Å; N261-H265 WeakPolarHBondContact O-CB 3.25Å; N261-H265 PolarHBondContact O-N 3.45Å
262	F	86.8	Confident	79.9	Confident	122 Å²	122	102 Å²	102	54%	0.535	50%	0.504	S	S	.	.	H	α-helix	trans	-62.9	-46.2	174.6	-172.4	-112.6	0	0	0	111.8	I258 Q259 K264 H265 L266	I258-F262 WeakPolarHBondContact O-CB 3.4Å; I258-F262 PolarHBondContact O-N 2.81Å; Q259-F262 PolarHBondContact O-N 3.48Å; F262-K264 PolarHBondContact O-N 3.41Å; F262-H265 PolarHBondContact O-N 3.42Å; F262-H265 VanDerWaalsContact O-N 3.14Å; F262-L266 HydrophobicContact CD1-CD1 3.92Å; F262-L266 HydrophobicContact CD1-CG 4.39Å; F262-L266 HydrophobicContact CE1-CD1 3.56Å; F262-L266 HydrophobicContact CE1-CG 4.13Å; F262-L266 HydrophobicContact CE2-CG 4.5Å; F262-L266 HydrophobicContact CZ-CD1 4.04Å; F262-L266 HydrophobicContact CZ-CD2 4.19Å; F262-L266 HydrophobicContact CZ-CG 4.18Å; F262-L266 WeakPolarHBondContact O-CG 3.45Å; F262-L266 PolarHBondContact O-N 3.4Å
263	R	83.7	Confident	78.3	Confident	159 Å²	159	106 Å²	106	60%	0.6	51%	0.51	S	S	*	.	H	α-helix	trans	-64.5	-19.6	173.2	-68.3	176.1	-174.2	-174.3	4.5	113.6	Q259 R267	Q259-R263 WeakPolarHBondContact O-CB 3.45Å; Q259-R263 VanDerWaalsContact O-CG 3.28Å; Q259-R263 WeakPolarHBondContact O-CG 3.23Å; Q259-R263 PolarHBondContact O-N 2.84Å; R263-R267 PolarHBondContact O-NE 2.81Å; R263-R267 PolarHBondContact O-NH2 2.7Å
264	K	87.1	Confident	76.6	Confident	124 Å²	124	106.1 Å²	106.1	54%	0.539	51%	0.514	S	S	.	.	H	α-helix	trans	-81.3	-45.5	169.7	-173.1	-179.9	-180	-179.1	0	110.7	R260 N261 F262 R267 M268	R260-K264 WeakPolarHBondContact O-CB 3.19Å; R260-K264 PolarHBondContact O-N 3.29Å; N261-K264 WeakPolarHBondContact O-CB 3.47Å; N261-K264 PolarHBondContact O-N 2.97Å; N261-K264 VanDerWaalsContact O-N 3.15Å; F262-K264 PolarHBondContact O-N 3.41Å; K264-R267 PolarHBondContact O-N 3.13Å; K264-M268 HydrophobicContact CG-CE 4.42Å; K264-M268 WeakPolarHBondContact O-CG 3.32Å; K264-M268 PolarHBondContact O-N 2.62Å; K264-M268 VanDerWaalsContact O-N 3.14Å
265	H	82.2	Confident	75.2	Confident	102 Å²	102	110.7 Å²	110.7	47%	0.472	53%	0.526	S	S	.	.	H	α-helix	trans	-59.9	-47.7	177.7	-175.4	81	0	0	0	112.1	N261 F262 R267 M268 V269	N261-H265 WeakPolarHBondContact O-CB 3.25Å; N261-H265 PolarHBondContact O-N 3.45Å; F262-H265 PolarHBondContact O-N 3.42Å; F262-H265 VanDerWaalsContact O-N 3.14Å; H265-R267 VanDerWaalsContact C-N 3.31Å; H265-R267 PolarHBondContact O-N 2.73Å; H265-M268 PolarHBondContact O-N 3.2Å; H265-M268 VanDerWaalsContact O-N 3.07Å; H265-V269 WeakPolarHBondContact O-CG2 3.27Å; H265-V269 PolarHBondContact O-N 3.39Å
266	L	74.9	Confident	73.7	Confident	93 Å²	93	112 Å²	112	49%	0.487	54%	0.537	S	S	.	.	H	α-helix	trans	-56.3	-41	176.5	-73.5	178.5	0	0	0	112.8	F262 G270	F262-L266 HydrophobicContact CD1-CD1 3.92Å; F262-L266 HydrophobicContact CD1-CG 4.39Å; F262-L266 HydrophobicContact CE1-CD1 3.56Å; F262-L266 HydrophobicContact CE1-CG 4.13Å; F262-L266 HydrophobicContact CE2-CG 4.5Å; F262-L266 HydrophobicContact CZ-CD1 4.04Å; F262-L266 HydrophobicContact CZ-CD2 4.19Å; F262-L266 HydrophobicContact CZ-CG 4.18Å; F262-L266 WeakPolarHBondContact O-CG 3.45Å; F262-L266 PolarHBondContact O-N 3.4Å; L266-G270 PolarHBondContact O-N 2.7Å
267	R	80.4	Confident	72	Confident	177 Å²	177	115.8 Å²	115.8	67%	0.668	55%	0.55	S	S	*	.	H	α-helix	trans	-65.5	-40.8	175.2	-81.9	178.5	-74.9	169.9	-4.9	112.5	R263 K264 H265 S271	R263-R267 PolarHBondContact O-NE 2.81Å; R263-R267 PolarHBondContact O-NH2 2.7Å; K264-R267 PolarHBondContact O-N 3.13Å; H265-R267 VanDerWaalsContact C-N 3.31Å; H265-R267 PolarHBondContact O-N 2.73Å; R267-S271 VanDerWaalsContact O-CB 3.26Å; R267-S271 WeakPolarHBondContact O-CB 3.35Å; R267-S271 PolarHBondContact O-N 2.7Å
268	M	70.3	Confident	70.4	Confident	104 Å²	104	115 Å²	115	51%	0.512	55%	0.545	S	S	.	.	H	α-helix	trans	-69.6	-38.1	178.2	-65.1	-171.1	-55	0	0	112.9	K264 H265 R272	K264-M268 HydrophobicContact CG-CE 4.42Å; K264-M268 WeakPolarHBondContact O-CG 3.32Å; K264-M268 PolarHBondContact O-N 2.62Å; K264-M268 VanDerWaalsContact O-N 3.14Å; H265-M268 PolarHBondContact O-N 3.2Å; H265-M268 VanDerWaalsContact O-N 3.07Å; M268-R272 PolarHBondContact O-N 3.12Å
269	V	67.7	Low	68.6	Low	73 Å²	73	116.4 Å²	116.4	44%	0.442	55%	0.547	S	S	.	.	H	α-helix	trans	-76.4	-42.2	177.9	176.7	0	0	0	0	111.3	H265 S271 R272 R273	H265-V269 WeakPolarHBondContact O-CG2 3.27Å; H265-V269 PolarHBondContact O-N 3.39Å; V269-S271 VanDerWaalsContact C-N 3.35Å; V269-S271 PolarHBondContact O-N 3.37Å; V269-R272 PolarHBondContact O-N 2.71Å; V269-R272 VanDerWaalsContact O-N 3.14Å; V269-R273 PolarHBondContact O-N 2.72Å
270	G	57.8	Low	66.9	Low	34 Å²	34	113.9 Å²	113.9	35%	0.351	55%	0.545	S	S	.	.	H	α-helix	trans	-58.4	-44.4	174.3	0	0	0	0	0	112.4	L266 R272 R273 V274	L266-G270 PolarHBondContact O-N 2.7Å; G270-R272 VanDerWaalsContact C-N 3.29Å; G270-R272 PolarHBondContact O-N 3.44Å; G270-R273 PolarHBondContact O-N 2.62Å; G270-R273 VanDerWaalsContact O-N 3.12Å; G270-V274 WeakPolarHBondContact O-CG2 3.15Å; G270-V274 PolarHBondContact O-N 2.86Å
271	S	56.5	Low	65.1	Low	71 Å²	71	110.8 Å²	110.8	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-59.2	-36.9	175.2	-177.2	0	0	0	0	112.9	R267 V269 K275	R267-S271 VanDerWaalsContact O-CB 3.26Å; R267-S271 WeakPolarHBondContact O-CB 3.35Å; R267-S271 PolarHBondContact O-N 2.7Å; V269-S271 VanDerWaalsContact C-N 3.35Å; V269-S271 PolarHBondContact O-N 3.37Å; S271-K275 WeakPolarHBondContact O-CB 3.01Å; S271-K275 PolarHBondContact O-N 3.11Å; S271-K275 VanDerWaalsContact O-N 3.11Å
272	R	52.2	Low	63.3	Low	200 Å²	200	113.8 Å²	113.8	76%	0.755	54%	0.541	S	S	*	.	H	α-helix	trans	-69.4	-39.5	173.9	-71.9	179.5	-179.2	-119.4	0.5	112.5	M268 V269 G270 K275 A276	M268-R272 PolarHBondContact O-N 3.12Å; V269-R272 PolarHBondContact O-N 2.71Å; V269-R272 VanDerWaalsContact O-N 3.14Å; G270-R272 VanDerWaalsContact C-N 3.29Å; G270-R272 PolarHBondContact O-N 3.44Å; R272-K275 PolarHBondContact O-N 2.93Å; R272-A276 PolarHBondContact O-N 3.48Å
273	R	52.9	Low	61.6	Low	194 Å²	194	116 Å²	116	73%	0.732	55%	0.546	S	S	*	.	H	α-helix	trans	-64	-44.1	178.3	-157.7	175	-170.2	-179.7	2.2	111.8	V269 G270 A276 Q277	V269-R273 PolarHBondContact O-N 2.72Å; G270-R273 PolarHBondContact O-N 2.62Å; G270-R273 VanDerWaalsContact O-N 3.12Å; R273-A276 PolarHBondContact O-N 2.79Å; R273-Q277 PolarHBondContact O-N 3.49Å
274	V	54.3	Low	59.7	Low	88 Å²	88	114.9 Å²	114.9	53%	0.533	55%	0.547	S	S	.	.	H	α-helix	trans	-66.1	-39	176.1	175.6	0	0	0	0	112.1	G270 A276 Q277 T278	G270-V274 WeakPolarHBondContact O-CG2 3.15Å; G270-V274 PolarHBondContact O-N 2.86Å; V274-A276 VanDerWaalsContact C-N 3.32Å; V274-A276 PolarHBondContact O-N 3.18Å; V274-Q277 PolarHBondContact O-N 3.44Å; V274-T278 PolarHBondContact O-N 2.83Å; V274-T278 VanDerWaalsContact O-N 3.12Å; V274-T278 PolarHBondContact O-OG1 2.94Å
275	K	54.4	Low	57.9	Low	156 Å²	156	117.4 Å²	117.4	68%	0.678	55%	0.554	S	S	*	*	H	α-helix	trans	-67.3	-28.4	174.2	-89.3	-170.2	169.2	-174.2	0	113.6	S271 R272 F279	S271-K275 WeakPolarHBondContact O-CB 3.01Å; S271-K275 PolarHBondContact O-N 3.11Å; S271-K275 VanDerWaalsContact O-N 3.11Å; R272-K275 PolarHBondContact O-N 2.93Å; K275-F279 WeakPolarHBondContact O-CB 3.47Å; K275-F279 PolarHBondContact O-N 3.29Å
276	A	54.1	Low	56.1	Low	64 Å²	64	117 Å²	117	53%	0.529	56%	0.562	S	S	.	*	H	α-helix	trans	-70.3	-48.4	174.6	0	0	0	0	0	111.5	R272 R273 V274 T278 F279 A280	R272-A276 PolarHBondContact O-N 3.48Å; R273-A276 PolarHBondContact O-N 2.79Å; V274-A276 VanDerWaalsContact C-N 3.32Å; V274-A276 PolarHBondContact O-N 3.18Å; A276-T278 PolarHBondContact O-N 3.17Å; A276-F279 PolarHBondContact O-N 3.18Å; A276-A280 PolarHBondContact O-N 3.1Å; A276-A280 VanDerWaalsContact O-N 3.14Å
277	Q	54.2	Low	54.7	Low	127 Å²	127	120.7 Å²	120.7	59%	0.593	58%	0.575	S	S	*	*	H	α-helix	trans	-60.2	-48.1	178.9	-68.9	177.1	-77.9	0	0	111.9	R273 V274 F279 A280 E281	R273-Q277 PolarHBondContact O-N 3.49Å; V274-Q277 PolarHBondContact O-N 3.44Å; Q277-F279 PolarHBondContact O-N 2.99Å; Q277-F279 VanDerWaalsContact O-N 3.15Å; Q277-A280 PolarHBondContact O-N 3.38Å; Q277-E281 WeakPolarHBondContact O-CB 3.42Å; Q277-E281 PolarHBondContact O-N 2.95Å
278	T	55.8	Low	52.9	Low	59 Å²	59	117 Å²	117	36%	0.362	58%	0.576	S	S	.	*	H	α-helix	trans	-71.2	-5.7	179.5	51.7	0	0	0	0	114.7	V274 A276 R282	V274-T278 PolarHBondContact O-N 2.83Å; V274-T278 VanDerWaalsContact O-N 3.12Å; V274-T278 PolarHBondContact O-OG1 2.94Å; A276-T278 PolarHBondContact O-N 3.17Å; T278-R282 WeakPolarHBondContact O-CB 3.48Å; T278-R282 PolarHBondContact O-NH1 2.82Å
279	F	49.5	Very low	51.7	Low	145 Å²	145	123.3 Å²	123.3	64%	0.636	59%	0.594	S	S	*	*	H	α-helix	trans	-95	-36.5	170.5	-155.1	-90.7	0	0	0	112	K275 A276 Q277 R283	K275-F279 WeakPolarHBondContact O-CB 3.47Å; K275-F279 PolarHBondContact O-N 3.29Å; A276-F279 PolarHBondContact O-N 3.18Å; Q277-F279 PolarHBondContact O-N 2.99Å; Q277-F279 VanDerWaalsContact O-N 3.15Å; F279-R283 PolarHBondContact O-N 2.86Å; F279-R283 VanDerWaalsContact O-N 3.11Å
280	A	54.1	Low	50.3	Low	53 Å²	53	125.6 Å²	125.6	44%	0.438	61%	0.613	S	S	.	*	H	α-helix	trans	-62.8	-52.6	171.1	0	0	0	0	0	111.3	A276 Q277 R282 R283 E284	A276-A280 PolarHBondContact O-N 3.1Å; A276-A280 VanDerWaalsContact O-N 3.14Å; Q277-A280 PolarHBondContact O-N 3.38Å; A280-R282 PolarHBondContact O-N 2.9Å; A280-R282 VanDerWaalsContact O-N 3.17Å; A280-R283 WeakPolarHBondContact O-CA 3.43Å; A280-R283 WeakPolarHBondContact O-CB 3.2Å; A280-R283 PolarHBondContact O-N 2.81Å; A280-E284 PolarHBondContact O-N 2.75Å
281	E	49.8	Very low	49.4	Very low	87 Å²	87	135.6 Å²	135.6	41%	0.407	64%	0.64	S	S	.	*	H	α-helix	trans	-61.3	-28.6	-178.6	-160.3	-158.9	154.5	0	0	112.9	Q277 R285	Q277-E281 WeakPolarHBondContact O-CB 3.42Å; Q277-E281 PolarHBondContact O-N 2.95Å; E281-R285 VanDerWaalsContact CD-NH1 3.35Å; E281-R285 IonicContact OE1-CZ 2.7Å; E281-R285 IonicContact OE1-NH1 3.64Å; E281-R285 PolarHBondContact OE1-NH1 3.22Å; E281-R285 IonicContact OE1-NH2 3.37Å; E281-R285 PolarHBondContact OE1-NH2 2.92Å
282	R	50.1	Low	48.5	Very low	158 Å²	158	137.7 Å²	137.7	60%	0.596	66%	0.655	S	S	*	*	H	α-helix	trans	-77.4	-35	173.5	-172.8	178.6	-78.5	100.7	-6.8	111.8	T278 A280 S286	T278-R282 WeakPolarHBondContact O-CB 3.48Å; T278-R282 PolarHBondContact O-NH1 2.82Å; A280-R282 PolarHBondContact O-N 2.9Å; A280-R282 VanDerWaalsContact O-N 3.17Å; R282-S286 PolarHBondContact O-N 2.88Å; R282-S286 PolarHBondContact O-OG 2.84Å; R282-S286 VanDerWaalsContact O-OG 3.1Å
283	R	51.1	Low	47.6	Very low	168 Å²	168	135 Å²	135	63%	0.634	66%	0.656	S	S	*	*	H	α-helix	trans	-69	-39	177.7	-170.4	178.7	-177.5	93.2	-1.3	112	F279 A280 S286	F279-R283 PolarHBondContact O-N 2.86Å; F279-R283 VanDerWaalsContact O-N 3.11Å; A280-R283 WeakPolarHBondContact O-CA 3.43Å; A280-R283 WeakPolarHBondContact O-CB 3.2Å; A280-R283 PolarHBondContact O-N 2.81Å; R283-S286 PolarHBondContact O-N 2.93Å
284	E	44.6	Very low	47.3	Very low	135 Å²	135	130.7 Å²	130.7	63%	0.631	65%	0.653	S	S	*	*	H	α-helix	trans	-62.7	-50.9	176.4	-70.5	173.1	153.7	0	0	111.2	A280 S286 F287	A280-E284 PolarHBondContact O-N 2.75Å; E284-S286 PolarHBondContact O-N 2.88Å; E284-S286 VanDerWaalsContact O-N 3.12Å; E284-F287 PolarHBondContact O-N 3.47Å
285	R	49.7	Very low	46.8	Very low	178 Å²	178	132.7 Å²	132.7	67%	0.672	67%	0.665	S	S	*	*	H	α-helix	trans	-62.6	-19.7	176.7	-68.6	-163.5	-173.2	93.4	-0.8	114.4	E281	E281-R285 VanDerWaalsContact CD-NH1 3.35Å; E281-R285 IonicContact OE1-CZ 2.7Å; E281-R285 IonicContact OE1-NH1 3.64Å; E281-R285 PolarHBondContact OE1-NH1 3.22Å; E281-R285 IonicContact OE1-NH2 3.37Å; E281-R285 PolarHBondContact OE1-NH2 2.92Å
286	S	43.7	Very low	46	Very low	93 Å²	93	131.3 Å²	131.3	65%	0.65	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-13.2	175.6	-67.2	0	0	0	0	114.5	R282 R283 E284	R282-S286 PolarHBondContact O-N 2.88Å; R282-S286 PolarHBondContact O-OG 2.84Å; R282-S286 VanDerWaalsContact O-OG 3.1Å; R283-S286 PolarHBondContact O-N 2.93Å; E284-S286 PolarHBondContact O-N 2.88Å; E284-S286 VanDerWaalsContact O-N 3.12Å
287	F	45.9	Very low	45	Very low	171 Å²	171	137 Å²	137	75%	0.75	69%	0.69	S	S	*	*	S	Bend	trans	-99.3	-0	-175.5	-120	-94.2	0	0	0	114.2	E284	E284-F287 PolarHBondContact O-N 3.47Å
288	S	42.6	Very low	44.5	Very low	100 Å²	100	138.9 Å²	138.9	70%	0.699	70%	0.696	S	S	*	*			trans	-115.3	27.7	-168.8	-49.5	0	0	0	0	114.8
289	R	44.7	Very low	43.4	Very low	236 Å²	236	140.4 Å²	140.4	89%	0.891	72%	0.715	S	S	*	*			trans	-122	98.9	167	-98.4	-176.9	168.1	-96.2	0.7	109.9
290	S	38.4	Very low	42.8	Very low	120 Å²	120	139.5 Å²	139.5	84%	0.839	72%	0.717	S	S	*	*			trans	-63.8	161.8	175.6	-54.5	0	0	0	0	112.4
291	W	38.9	Very low	41.9	Very low	244 Å²	244	143.8 Å²	143.8	92%	0.924	74%	0.738	S	S	*	*			trans	-77.3	-179.9	174.2	-79.1	45.1	0	0	0	112.3
292	S	37.3	Very low	41.5	Very low	115 Å²	115	145 Å²	145	80%	0.804	76%	0.755	S	S	*	*			trans	78.5	134.5	-176.5	-52.4	0	0	0	0	113.7
293	D	34.1	Very low	40.8	Very low	145 Å²	145	146.2 Å²	146.2	78%	0.775	77%	0.768	S	S	*	*			cis	-146	-158.5	2.5	-154.6	22.8	0	0	0	112.2
294	P	45.3	Very low	40.1	Very low	102 Å²	102	145.5 Å²	145.5	66%	0.662	78%	0.777	S	S	*	*				-105.1	171.1	-111.9	37	-23.4	0	0	0	116.2
295	T	44.5	Very low	39.6	Very low	130 Å²	130	144.8 Å²	144.8	80%	0.798	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-80.5	132.9	177.9	45.7	0	0	0	0	114.3
296	P	36.8	Very low	39.3	Very low	127 Å²	127	146.6 Å²	146.6	83%	0.825	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-75.3	148.7	154.5	-10.6	28.1	0	0	0	111.2
297	M	34.4	Very low	38.8	Very low	184 Å²	184	148.8 Å²	148.8	91%	0.906	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-83.4	161.3	178.8	-67.6	-179	68.4	0	0	112.9
298	K	43.7	Very low	38.3	Very low	166 Å²	166	146 Å²	146	72%	0.722	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-66.1	154.9	167	-80	-173.1	153.6	-146	0	112.1	D300	K298-D300 IonicContact NZ-OD1 2.71Å; K298-D300 PolarHBondContact NZ-OD1 3.02Å; K298-D300 IonicContact NZ-OD2 3.76Å
299	A	32.8	Very low	38	Very low	91 Å²	91	147 Å²	147	75%	0.752	81%	0.806	S	S	*	*			trans	-121	128.9	142.2	0	0	0	0	0	107.8
300	D	36.8	Very low	37.9	Very low	126 Å²	126	143.1 Å²	143.1	67%	0.674	80%	0.804	S	S	*	*			trans	-96.4	132.3	166.8	-58.8	-66.1	0	0	0	107.6	K298	K298-D300 IonicContact NZ-OD1 2.71Å; K298-D300 PolarHBondContact NZ-OD1 3.02Å; K298-D300 IonicContact NZ-OD2 3.76Å
301	T	34.4	Very low	38.3	Very low	143 Å²	143	144.5 Å²	144.5	88%	0.877	80%	0.801	S	S	*	*			trans	-140.8	127.3	174.7	6.1	0	0	0	0	110.5
302	S	42.5	Very low	38.6	Very low	112 Å²	112	141 Å²	141	78%	0.783	79%	0.794	S	S	*	*			trans	-100.1	135.8	-177.5	54.4	0	0	0	0	112.1
303	H	35.5	Very low	38.3	Very low	185 Å²	185	141.2 Å²	141.2	86%	0.856	80%	0.796	S	S	*	*			trans	-155.3	142.7	140.3	-138.6	-73.6	0	0	0	113.2
304	D	36.2	Very low	38.4	Very low	153 Å²	153	139.2 Å²	139.2	82%	0.818	79%	0.793	S	S	*	*			trans	-68.6	145.7	166.6	-113.3	-49	0	0	0	111.5
305	S	33.2	Very low	38.2	Very low	120 Å²	120	143 Å²	143	84%	0.839	80%	0.802	S	S	*	*			trans	-158.2	149.9	160.8	-166.8	0	0	0	0	111.3
306	R	43.3	Very low	38.1	Very low	215 Å²	215	143.2 Å²	143.2	81%	0.811	81%	0.807	S	S	*	*			trans	-103.7	148.7	-170.5	-107.9	180	175.7	163.8	-2.3	113.4
307	D	33.7	Very low	38.3	Very low	139 Å²	139	143.3 Å²	143.3	74%	0.743	81%	0.806	S	S	*	*			trans	59.7	148.1	144.4	-57	-38.7	0	0	0	122.1
308	S	34.5	Very low	38.3	Very low	114 Å²	114	141.2 Å²	141.2	80%	0.797	80%	0.797	S	S	*	*			trans	75.9	97.4	157.8	-154.9	0	0	0	0	119.5
309	S	36.7	Very low	38.1	Very low	119 Å²	119	140 Å²	140	83%	0.832	80%	0.799	S	S	*	*				-161	114	118.8	9.1	0	0	0	0	110.5
310	D	43.7	Very low	38.7	Very low	156 Å²	156	143.5 Å²	143.5	83%	0.834	80%	0.8	S	S	*	*			trans	-65.5	135.4	158.5	-75.7	-68.3	0	0	0	109.6
311	L	45.5	Very low	38.8	Very low	149 Å²	149	140.9 Å²	140.9	78%	0.78	80%	0.796	S	S	*	*				175.2	139.4	119.9	-91.9	164.2	0	0	0	111.9
312	Q	45.3	Very low	38.9	Very low	169 Å²	169	141.9 Å²	141.9	79%	0.79	79%	0.788	S	S	*	*			trans	61.2	78	152.4	-64	173.9	-5.3	0	0	118.9
313	S	30.6	Very low	39.4	Very low	121 Å²	121	143.2 Å²	143.2	85%	0.846	78%	0.782	S	S	*	*			trans	-128.3	34.4	142.6	58.7	0	0	0	0	112	H315	S313-H315 VanDerWaalsContact C-N 3.28Å; S313-H315 PolarHBondContact O-N 3.26Å
314	S	38.2	Very low	40.3	Very low	102 Å²	102	139.9 Å²	139.9	71%	0.713	77%	0.77	S	S	*	*			trans	-75.6	68.1	-178.6	56.8	0	0	0	0	113.1
315	H	41.1	Very low	41.2	Very low	183 Å²	183	139.1 Å²	139.1	85%	0.847	77%	0.765	S	S	*	*			trans	-145.6	94.9	169.2	-97.8	-83.8	0	0	0	109.3	S313	S313-H315 VanDerWaalsContact C-N 3.28Å; S313-H315 PolarHBondContact O-N 3.26Å
316	C	42.3	Very low	43.2	Very low	134 Å²	134	136.5 Å²	136.5	91%	0.905	74%	0.742	S	S	*	*	S	Bend	trans	162.9	38.8	155.4	-90.3	0	0	0	0	113.8
317	T	40.4	Very low	45	Very low	129 Å²	129	129 Å²	129	79%	0.791	71%	0.714	S	S	*	*	S	Bend	trans	-146	12	178.8	50.5	0	0	0	0	115.4
318	L	35	Very low	47.4	Very low	139 Å²	139	127 Å²	127	73%	0.728	70%	0.703	S	S	*	*	S	Bend	trans	-114.5	-15.3	-169.7	-157.9	134.7	0	0	0	115.1
319	D	38.5	Very low	49.9	Very low	142 Å²	142	125.4 Å²	125.4	76%	0.759	69%	0.689	S	S	*	*	S	Bend	trans	-76.1	-51.1	-176.9	-122.1	24.9	0	0	0	112	A321 F322 E323	D319-A321 VanDerWaalsContact C-N 3.28Å; D319-A321 PolarHBondContact O-N 2.5Å; D319-F322 PolarHBondContact O-N 3.34Å; D319-E323 PolarHBondContact O-N 3.05Å
320	E	44.6	Very low	52.2	Low	164 Å²	164	121.4 Å²	121.4	77%	0.766	66%	0.657	S	S	*	*	H	α-helix	trans	-59	-39	-177.9	-63.2	-178.8	132.5	0	0	112	F322 E323 D324	E320-F322 PolarHBondContact O-N 3.03Å; E320-E323 PolarHBondContact O-N 3.16Å; E320-D324 PolarHBondContact O-N 2.73Å
321	A	39.6	Very low	54.4	Low	71 Å²	71	117.6 Å²	117.6	59%	0.587	63%	0.633	S	S	*	*	H	α-helix	trans	-70.3	-12.4	179.7	0	0	0	0	0	114.3	D319	D319-A321 VanDerWaalsContact C-N 3.28Å; D319-A321 PolarHBondContact O-N 2.5Å
322	F	36.6	Very low	56.4	Low	164 Å²	164	112.2 Å²	112.2	72%	0.719	61%	0.614	S	S	*	*	H	α-helix	trans	-96	-35.1	178.5	-138.7	-91.1	0	0	0	112	D319 E320	D319-F322 PolarHBondContact O-N 3.34Å; E320-F322 PolarHBondContact O-N 3.03Å
323	E	52.3	Low	58.4	Low	139 Å²	139	109.9 Å²	109.9	65%	0.65	61%	0.606	S	S	*	*	H	α-helix	trans	-69.6	-35.8	173.2	-66.8	-157.1	136.2	0	0	112.4	D319 E320 L325 D326 W327	D319-E323 PolarHBondContact O-N 3.05Å; E320-E323 PolarHBondContact O-N 3.16Å; E323-L325 VanDerWaalsContact C-N 3.27Å; E323-L325 PolarHBondContact O-N 2.92Å; E323-D326 PolarHBondContact O-N 2.64Å; E323-W327 PolarHBondContact O-N 3.3Å
324	D	54.9	Low	61.3	Low	116 Å²	116	104.2 Å²	104.2	62%	0.62	57%	0.566	S	S	*	*	H	α-helix	trans	-62.6	-31	178.9	-89.3	-11.2	0	0	0	113.3	E320 W327 D328	E320-D324 PolarHBondContact O-N 2.73Å; D324-W327 WeakPolarHBondContact O-CB 3.39Å; D324-W327 PolarHBondContact O-N 2.82Å; D324-D328 PolarHBondContact O-N 2.97Å
325	L	54.6	Low	63.8	Low	136 Å²	136	101 Å²	101	71%	0.712	55%	0.545	S	S	*	.	H	α-helix	trans	-78.2	-33.4	178.9	-153.9	74.1	0	0	0	112.1	E323 W327 T329	E323-L325 VanDerWaalsContact C-N 3.27Å; E323-L325 PolarHBondContact O-N 2.92Å; L325-W327 VanDerWaalsContact C-N 3.33Å; L325-T329 WeakPolarHBondContact O-CB 3.36Å; L325-T329 PolarHBondContact O-N 3.15Å; L325-T329 PolarHBondContact O-OG1 3.27Å
326	D	75.1	Confident	66.1	Low	65 Å²	65	97.3 Å²	97.3	35%	0.348	54%	0.536	S	S	.	.	H	α-helix	trans	-66.3	-37.3	168.3	-170.4	34.4	0	0	0	110.6	E323 T329 E330 R446	E323-D326 PolarHBondContact O-N 2.64Å; D326-T329 PolarHBondContact O-N 2.88Å; D326-E330 WeakPolarHBondContact O-CB 3.48Å; D326-E330 PolarHBondContact O-N 3.07Å; D326-R446 IonicContact OD2-CZ 2.59Å; D326-R446 IonicContact OD2-NH1 2.75Å; D326-R446 PolarHBondContact OD2-NH1 3.25Å; D326-R446 IonicContact OD2-NH2 3.77Å; D326-R446 PolarHBondContact OD2-NH2 2.9Å
327	W	81.7	Confident	68.3	Low	57 Å²	57	91.3 Å²	91.3	22%	0.216	50%	0.496	C	S	.	.	H	α-helix	trans	-59.1	-59.4	-178.4	-179.4	-88.5	0	0	0	114.1	E323 D324 L325 T329 E330 K331 K450 P484 Y485	E323-W327 PolarHBondContact O-N 3.3Å; D324-W327 WeakPolarHBondContact O-CB 3.39Å; D324-W327 PolarHBondContact O-N 2.82Å; L325-W327 VanDerWaalsContact C-N 3.33Å; W327-T329 PolarHBondContact O-N 3.39Å; W327-E330 PolarHBondContact O-N 3.45Å; W327-K331 VanDerWaalsContact O-CB 3.26Å; W327-K331 WeakPolarHBondContact O-CB 3.42Å; W327-K331 PolarHBondContact O-N 2.69Å; W327-K450 HydrophobicContact CD2-CD 3.81Å; W327-K450 HydrophobicContact CE3-CD 4.06Å; W327-K450 VanDerWaalsContact CE3-CE 3.48Å; W327-K450 HydrophobicContact CG-CD 4.39Å; W327-K450 HydrophobicContact CH2-CD 4.03Å; W327-K450 HydrophobicContact CH2-CG 3.82Å; W327-K450 HydrophobicContact CZ2-CB 4.11Å; W327-K450 HydrophobicContact CZ2-CD 3.78Å; W327-K450 HydrophobicContact CZ2-CG 3.66Å; W327-K450 HydrophobicContact CZ3-CD 4.19Å; W327-K450 HydrophobicContact CZ3-CG 4.37Å; W327-P484 HydrophobicContact CE3-CG 4.21Å; W327-P484 HydrophobicContact CH2-CG 3.85Å; W327-P484 HydrophobicContact CZ3-CG 3.6Å; W327-Y485 HydrophobicContact CE3-CE1 4.23Å; W327-Y485 AromaticContact CH2-CD1 3.56Å; W327-Y485 HydrophobicContact CH2-CD1 3.56Å; W327-Y485 HydrophobicContact CH2-CD2 4.45Å; W327-Y485 AromaticContact CH2-CE1 3.71Å; W327-Y485 HydrophobicContact CH2-CE1 3.71Å; W327-Y485 AromaticContact CH2-CG 3.96Å; W327-Y485 HydrophobicContact CH2-CG 3.96Å; W327-Y485 AromaticContact CZ3-CD1 3.62Å; W327-Y485 HydrophobicContact CZ3-CD1 3.62Å; W327-Y485 HydrophobicContact CZ3-CD2 4.19Å; W327-Y485 AromaticContact CZ3-CE1 3.26Å; W327-Y485 HydrophobicContact CZ3-CE1 3.26Å; W327-Y485 AromaticContact CZ3-CE2 3.86Å; W327-Y485 HydrophobicContact CZ3-CE2 3.86Å; W327-Y485 HydrophobicContact CZ3-CG 4.07Å; W327-Y485 AromaticContact CZ3-CZ 3.38Å
328	D	83.6	Confident	70.5	Confident	97 Å²	97	86.5 Å²	86.5	52%	0.519	47%	0.467	S	S	.	.	H	α-helix	trans	-71.7	-23	-177.5	-95.4	-22.5	0	0	0	111.6	D324 K331 G332	D324-D328 PolarHBondContact O-N 2.97Å; D328-K331 WeakPolarHBondContact OD1-CD 3.43Å; D328-K331 IonicContact OD1-NZ 2.96Å; D328-K331 PolarHBondContact OD1-NZ 2.9Å; D328-G332 PolarHBondContact O-N 3.42Å
329	T	86.9	Confident	72.9	Confident	81 Å²	81	86.3 Å²	86.3	50%	0.497	47%	0.467	S	S	.	.	H	α-helix	trans	-70.6	-51.8	171	-56.8	0	0	0	0	111.7	L325 D326 W327 K331 G332 L333	L325-T329 WeakPolarHBondContact O-CB 3.36Å; L325-T329 PolarHBondContact O-N 3.15Å; L325-T329 PolarHBondContact O-OG1 3.27Å; D326-T329 PolarHBondContact O-N 2.88Å; W327-T329 PolarHBondContact O-N 3.39Å; T329-K331 PolarHBondContact O-N 3.42Å; T329-G332 PolarHBondContact O-N 3.27Å; T329-L333 HydrophobicContact CG2-CD1 4.35Å; T329-L333 WeakPolarHBondContact O-CG 3.41Å; T329-L333 PolarHBondContact O-N 3.35Å
330	E	86.7	Confident	75.1	Confident	36 Å²	36	82.7 Å²	82.7	17%	0.168	45%	0.449	C	S	.	.	H	α-helix	trans	-57.1	-38.3	173.7	-83.5	-155.5	-176.7	0	0	111.3	D326 W327 E334 K403 R446 K450	D326-E330 WeakPolarHBondContact O-CB 3.48Å; D326-E330 PolarHBondContact O-N 3.07Å; W327-E330 PolarHBondContact O-N 3.45Å; E330-E334 WeakPolarHBondContact O-CB 3.26Å; E330-E334 PolarHBondContact O-N 2.86Å; E330-K403 IonicContact OE2-NZ 2.69Å; E330-K403 PolarHBondContact OE2-NZ 2.88Å; E330-R446 IonicContact OE1-CZ 2.59Å; E330-R446 IonicContact OE1-NE 2.77Å; E330-R446 IonicContact OE1-NH2 3.15Å; E330-R446 PolarHBondContact OE1-NH2 3.41Å; E330-K450 HydrophobicContact CB-CD 4.33Å; E330-K450 IonicContact OE2-NZ 3.58Å; E330-K450 PolarHBondContact OE2-NZ 2.67Å
331	K	88.4	Confident	77.1	Confident	76 Å²	76	84.3 Å²	84.3	33%	0.33	46%	0.457	S	S	.	.	H	α-helix	trans	-69.2	-38.5	178	-179.1	175.3	141.8	-142.7	0	112.8	W327 D328 T329 E334 A335 K450 V451	W327-K331 VanDerWaalsContact O-CB 3.26Å; W327-K331 WeakPolarHBondContact O-CB 3.42Å; W327-K331 PolarHBondContact O-N 2.69Å; D328-K331 WeakPolarHBondContact OD1-CD 3.43Å; D328-K331 IonicContact OD1-NZ 2.96Å; D328-K331 PolarHBondContact OD1-NZ 2.9Å; T329-K331 PolarHBondContact O-N 3.42Å; K331-E334 PolarHBondContact O-N 3.44Å; K331-A335 PolarHBondContact O-N 3.23Å; K331-K450 HydrophobicContact CB-CB 3.87Å; K331-K450 HydrophobicContact CB-CD 3.79Å; K331-K450 HydrophobicContact CD-CB 4.09Å; K331-K450 HydrophobicContact CG-CB 3.8Å; K331-V451 HydrophobicContact CG-CG1 3.99Å; K331-V451 WeakPolarHBondContact O-CG1 3.5Å
332	G	87.5	Confident	79.1	Confident	36 Å²	36	84.3 Å²	84.3	37%	0.371	46%	0.464	S	S	.	.	H	α-helix	trans	-65.3	-41.6	173.8	0	0	0	0	0	112.2	D328 T329 A335 V336	D328-G332 PolarHBondContact O-N 3.42Å; T329-G332 PolarHBondContact O-N 3.27Å; G332-A335 PolarHBondContact O-N 3.31Å; G332-V336 WeakPolarHBondContact O-CG2 3.46Å; G332-V336 PolarHBondContact O-N 3.49Å; G332-V336 VanDerWaalsContact O-N 3.14Å
333	L	88.4	Confident	81.7	Confident	120 Å²	120	78.2 Å²	78.2	63%	0.628	44%	0.438	S	S	*	.	H	α-helix	trans	-64.7	-40.4	173.8	-67.3	170.8	0	0	0	112	T329 A337	T329-L333 HydrophobicContact CG2-CD1 4.35Å; T329-L333 WeakPolarHBondContact O-CG 3.41Å; T329-L333 PolarHBondContact O-N 3.35Å; L333-A337 PolarHBondContact O-N 2.89Å
334	E	91.5	Very high	83.6	Confident	2 Å²	2	74.3 Å²	74.3	1%	0.009	42%	0.423	C	S	.	.	H	α-helix	trans	-64	-40.3	174.2	-173	-173.7	170.8	0	0	112	E330 K331 A337 C338 K403 S449 K450 V451	E330-E334 WeakPolarHBondContact O-CB 3.26Å; E330-E334 PolarHBondContact O-N 2.86Å; K331-E334 PolarHBondContact O-N 3.44Å; E334-A337 WeakPolarHBondContact O-CB 3.39Å; E334-A337 PolarHBondContact O-N 2.74Å; E334-C338 PolarHBondContact O-N 3.5Å; E334-C338 PolarHBondContact O-SG 3.31Å; E334-C338 VanDerWaalsContact O-SG 3.34Å; E334-K403 HydrophobicContact CG-CB 4.43Å; E334-K403 HydrophobicContact CG-CG 3.94Å; E334-K403 WeakPolarHBondContact OE1-CB 3.44Å; E334-S449 WeakPolarHBondContact OE1-CA 3.34Å; E334-S449 WeakPolarHBondContact OE1-CB 3.29Å; E334-S449 PolarHBondContact OE1-OG 3.36Å; E334-K450 PolarHBondContact OE1-N 3.37Å; E334-K450 WeakPolarHBondContact OE2-CB 3.25Å; E334-K450 PolarHBondContact OE2-N 3.02Å; E334-V451 HydrophobicContact CB-CG1 4.07Å; E334-V451 HydrophobicContact CG-CG1 4.05Å; E334-V451 HydrophobicContact CG-CG2 4.07Å
335	A	90.6	Very high	85.4	Confident	34 Å²	34	70.6 Å²	70.6	28%	0.281	41%	0.405	S	S	.	.	H	α-helix	trans	-60.6	-49	176.8	0	0	0	0	0	111.5	K331 G332 A337 C338 D339 V451	K331-A335 PolarHBondContact O-N 3.23Å; G332-A335 PolarHBondContact O-N 3.31Å; A335-A337 PolarHBondContact O-N 2.77Å; A335-C338 PolarHBondContact O-N 2.78Å; A335-D339 PolarHBondContact O-N 3.5Å; A335-V451 HydrophobicContact CB-CG1 4.05Å
336	V	89.9	Confident	87.3	Confident	106 Å²	106	64.1 Å²	64.1	64%	0.642	37%	0.372	S	S	*	.	H	α-helix	trans	-61.3	-32.3	176	174.4	0	0	0	0	112	G332	G332-V336 WeakPolarHBondContact O-CG2 3.46Å; G332-V336 PolarHBondContact O-N 3.49Å; G332-V336 VanDerWaalsContact O-N 3.14Å
337	A	86.8	Confident	88.3	Confident	8 Å²	8	62.9 Å²	62.9	7%	0.066	36%	0.363	C	S	.	.	H	α-helix	trans	-67.3	-45.5	172	0	0	0	0	0	111.8	L333 E334 A335 D339 T340 H399	L333-A337 PolarHBondContact O-N 2.89Å; E334-A337 WeakPolarHBondContact O-CB 3.39Å; E334-A337 PolarHBondContact O-N 2.74Å; A335-A337 PolarHBondContact O-N 2.77Å; A337-D339 VanDerWaalsContact C-N 3.33Å; A337-D339 PolarHBondContact O-N 2.76Å; A337-T340 WeakPolarHBondContact O-CB 3.47Å; A337-T340 PolarHBondContact O-N 3.12Å; A337-T340 PolarHBondContact O-OG1 3.15Å; A337-H399 PolarHBondContact O-CE1 3Å; A337-H399 VanDerWaalsContact O-CE1 3.28Å; A337-H399 PolarHBondContact O-NE2 3.02Å
338	C	87.3	Confident	89.1	Confident	27 Å²	27	60.1 Å²	60.1	18%	0.182	35%	0.353	C	S	.	.	H	α-helix	trans	-66.7	-27.9	178.3	-68.9	0	0	0	0	114.2	E334 A335 T340 F343	E334-C338 PolarHBondContact O-N 3.5Å; E334-C338 PolarHBondContact O-SG 3.31Å; E334-C338 VanDerWaalsContact O-SG 3.34Å; A335-C338 PolarHBondContact O-N 2.78Å; C338-T340 PolarHBondContact O-N 3.21Å; C338-F343 HydrophobicContact CB-CD1 4.11Å; C338-F343 HydrophobicContact CB-CE1 4.01Å; C338-F343 WeakPolarHBondContact SG-CE1 3.41Å
339	D	85.1	Confident	89.8	Confident	136 Å²	136	55.5 Å²	55.5	73%	0.727	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	0.3	177	-71.5	-26.2	0	0	0	113.7	A335 A337 E341	A335-D339 PolarHBondContact O-N 3.5Å; A337-D339 VanDerWaalsContact C-N 3.33Å; A337-D339 PolarHBondContact O-N 2.76Å; D339-E341 PolarHBondContact O-N 2.93Å
340	T	85.1	Confident	90.3	Very high	65 Å²	65	51.8 Å²	51.8	40%	0.399	31%	0.305	S	S	.	.	S	Bend	trans	-66	131.4	175.4	-51.7	0	0	0	0	111	A337 C338 G342 F343 H399	A337-T340 WeakPolarHBondContact O-CB 3.47Å; A337-T340 PolarHBondContact O-N 3.12Å; A337-T340 PolarHBondContact O-OG1 3.15Å; C338-T340 PolarHBondContact O-N 3.21Å; T340-G342 PolarHBondContact O-N 2.85Å; T340-F343 WeakPolarHBondContact O-CB 3.47Å; T340-F343 PolarHBondContact O-N 3.01Å; T340-H399 PolarHBondContact OG1-NE2 3.16Å
341	E	85.6	Confident	90.8	Very high	198 Å²	198	50 Å²	50	93%	0.925	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	126.9	176.8	-172.8	172.8	-163.6	0	0	111.4	D339	D339-E341 PolarHBondContact O-N 2.93Å
342	G	83.1	Confident	91.2	Very high	72 Å²	72	46.4 Å²	46.4	74%	0.742	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	4.7	-176.7	0	0	0	0	0	115.6	T340 V344	T340-G342 PolarHBondContact O-N 2.85Å; G342-V344 PolarHBondContact O-N 3.12Å
343	F	89.7	Confident	91.5	Very high	36 Å²	36	47 Å²	47	16%	0.158	28%	0.28	C	S	.	.			trans	-60.3	126.6	174.7	179.5	-95.1	0	0	0	111.9	C338 T340 P345 H399 A402	C338-F343 HydrophobicContact CB-CD1 4.11Å; C338-F343 HydrophobicContact CB-CE1 4.01Å; C338-F343 WeakPolarHBondContact SG-CE1 3.41Å; T340-F343 WeakPolarHBondContact O-CB 3.47Å; T340-F343 PolarHBondContact O-N 3.01Å; F343-P345 HydrophobicContact CE1-CB 4.33Å; F343-P345 HydrophobicContact CE1-CG 4.04Å; F343-H399 HydrophobicContact CD2-CB 4.45Å; F343-H399 AromaticContact CD2-CD2 3.83Å; F343-H399 AromaticContact CD2-CG 3.99Å; F343-H399 HydrophobicContact CE2-CB 4.25Å; F343-A402 HydrophobicContact CE2-CB 3.92Å; F343-A402 HydrophobicContact CZ-CB 4.24Å
344	V	92.3	Very high	91.8	Very high	57 Å²	57	44.8 Å²	44.8	35%	0.345	27%	0.265	S	S	.	.			trans	-113.7	129.8	169.9	-175.1	0	0	0	0	108.5	G342 Y398	G342-V344 PolarHBondContact O-N 3.12Å; V344-Y398 WeakPolarHBondContact O-CE1 3.23Å; V344-Y398 PolarHBondContact O-OH 2.91Å
345	P	93.1	Very high	91.8	Very high	38 Å²	38	45 Å²	45	25%	0.247	27%	0.266	C	S	.	.			trans	-60.2	132	179.7	-26.5	34.4	0	0	0	113.5	F343 S371 W405	F343-P345 HydrophobicContact CE1-CB 4.33Å; F343-P345 HydrophobicContact CE1-CG 4.04Å; P345-S371 VanDerWaalsContact O-CB 3.28Å; P345-S371 WeakPolarHBondContact O-CB 3.11Å; P345-S371 PolarHBondContact O-OG 2.64Å; P345-W405 HydrophobicContact CB-CB 4.06Å; P345-W405 HydrophobicContact CB-CD2 3.44Å; P345-W405 VanDerWaalsContact CB-CD2 3.44Å; P345-W405 HydrophobicContact CB-CE3 3.87Å; P345-W405 HydrophobicContact CB-CG 3.53Å; P345-W405 HydrophobicContact CB-CZ2 4.34Å; P345-W405 HydrophobicContact CB-CZ3 4.47Å; P345-W405 HydrophobicContact CG-CD2 3.82Å; P345-W405 HydrophobicContact CG-CE3 3.89Å; P345-W405 HydrophobicContact CG-CG 4.43Å; P345-W405 HydrophobicContact CG-CH2 4.02Å; P345-W405 HydrophobicContact CG-CZ2 3.96Å; P345-W405 HydrophobicContact CG-CZ3 3.99Å
346	P	95.3	Very high	91.8	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.266	C	S	.	.			trans	-76.2	147.1	-172.9	30.3	-35.3	0	0	0	113.4	S371 I373 L395 Y398 A402 K403 W405	P346-S371 WeakPolarHBondContact CA-O 3.37Å; P346-I373 HydrophobicContact CB-CD1 3.81Å; P346-L395 HydrophobicContact CB-CD2 4Å; P346-L395 HydrophobicContact CG-CD2 3.76Å; P346-Y398 HydrophobicContact CB-CD1 3.99Å; P346-Y398 HydrophobicContact CB-CE1 3.9Å; P346-Y398 HydrophobicContact CG-CD1 4.43Å; P346-Y398 HydrophobicContact CG-CE1 4.36Å; P346-A402 HydrophobicContact CG-CB 4.24Å; P346-K403 WeakPolarHBondContact CD-O 3.33Å; P346-K403 WeakPolarHBondContact CG-O 3.5Å; P346-W405 PolarHBondContact O-N 2.8Å
347	K	96.6	Very high	91.7	Very high	38 Å²	38	42.8 Å²	42.8	17%	0.165	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	90.2	-177.2	-63.8	163.2	-166.7	141.2	0	109.2	D369 S371 I372 I373 K406 Y506	K347-D369 IonicContact NZ-OD1 3.49Å; K347-D369 PolarHBondContact NZ-OD1 3.05Å; K347-D369 IonicContact NZ-OD2 2.69Å; K347-D369 PolarHBondContact NZ-OD2 2.95Å; K347-S371 WeakPolarHBondContact CD-OG 3.49Å; K347-S371 WeakPolarHBondContact CE-OG 3.26Å; K347-S371 PolarHBondContact N-O 3.44Å; K347-S371 PolarHBondContact NZ-OG 2.84Å; K347-I372 HydrophobicContact CB-CG1 4.12Å; K347-I372 HydrophobicContact CD-CG1 3.91Å; K347-I372 WeakPolarHBondContact O-CA 3.46Å; K347-I373 PolarHBondContact O-N 3.19Å; K347-K406 CarbonylContact C-O 3.48Å; K347-K406 VanDerWaalsContact CA-O 3.25Å; K347-K406 WeakPolarHBondContact CA-O 3.07Å; K347-Y506 HydrophobicContact CB-CE1 4.07Å
348	V	97.5	Very high	91.9	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	129.9	-176.5	172.4	0	0	0	0	110.7	I373 I375 I391 L395 I404 K406 M407 L408	V348-I373 HydrophobicContact CG2-CB 4.33Å; V348-I373 HydrophobicContact CG2-CD1 4.5Å; V348-I375 HydrophobicContact CG1-CD1 4.07Å; V348-I391 HydrophobicContact CG1-CG1 4.2Å; V348-I391 HydrophobicContact CG1-CG2 4.45Å; V348-L395 HydrophobicContact CG2-CD2 4Å; V348-L395 HydrophobicContact CG2-CG 4.39Å; V348-I404 HydrophobicContact CB-CD1 4.13Å; V348-I404 HydrophobicContact CB-CG1 4.29Å; V348-I404 HydrophobicContact CB-CG2 4.33Å; V348-I404 HydrophobicContact CG2-CD1 3.93Å; V348-I404 HydrophobicContact CG2-CG1 3.74Å; V348-I404 HydrophobicContact CG2-CG2 4.46Å; V348-K406 PolarHBondContact N-O 2.88Å; V348-K406 VanDerWaalsContact N-O 3.16Å; V348-M407 HydrophobicContact CB-CG 4.43Å; V348-M407 HydrophobicContact CG1-CE 4.37Å; V348-M407 CarbonylContact O-C 3.59Å; V348-M407 VanDerWaalsContact O-CA 3.23Å; V348-M407 WeakPolarHBondContact O-CA 3.48Å; V348-M407 WeakPolarHBondContact O-CG 3.22Å; V348-L408 PolarHBondContact O-N 3.04Å
349	M	97.5	Very high	91.9	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	105.5	179.5	178.5	175.2	171.6	0	0	110.3	I351 I361 I365 I373 P374 I375 L408 F410 F507	M349-I351 HydrophobicContact CE-CD1 3.78Å; M349-I351 HydrophobicContact CE-CG1 3.82Å; M349-I351 HydrophobicContact CG-CD1 4.34Å; M349-I351 HydrophobicContact CG-CG1 4Å; M349-I351 HydrophobicContact SD-CD1 4.39Å; M349-I361 HydrophobicContact CE-CG2 3.46Å; M349-I361 VanDerWaalsContact CE-CG2 3.46Å; M349-I365 HydrophobicContact SD-CD1 4.04Å; M349-I365 HydrophobicContact SD-CG1 4.35Å; M349-I373 PolarHBondContact N-O 3.41Å; M349-P374 WeakPolarHBondContact O-CA 3.26Å; M349-I375 PolarHBondContact O-N 2.76Å; M349-L408 CarbonylContact C-O 3.59Å; M349-L408 WeakPolarHBondContact CA-O 3.35Å; M349-L408 HydrophobicContact CB-CB 4.46Å; M349-L408 HydrophobicContact CE-CD2 3.98Å; M349-L408 HydrophobicContact CG-CB 4.21Å; M349-L408 HydrophobicContact CG-CD2 4.05Å; M349-L408 HydrophobicContact CG-CG 4.29Å; M349-L408 HydrophobicContact SD-CD2 3.93Å; M349-F410 HydrophobicContact CE-CD1 4.12Å; M349-F507 HydrophobicContact CE-CE1 3.56Å; M349-F507 HydrophobicContact CE-CZ 3.4Å; M349-F507 HydrophobicContact SD-CE1 4.02Å; M349-F507 HydrophobicContact SD-CZ 4.03Å
350	L	97.5	Very high	92.1	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	117.3	-178	-175.6	65.3	0	0	0	110.5	I375 Y377 I387 M407 L408 F410	L350-I375 HydrophobicContact CD1-CB 4.24Å; L350-I375 HydrophobicContact CD1-CG2 3.84Å; L350-Y377 HydrophobicContact CD1-CD1 3.49Å; L350-Y377 VanDerWaalsContact CD1-CD1 3.49Å; L350-Y377 HydrophobicContact CD1-CE1 3.9Å; L350-Y377 HydrophobicContact CD1-CG 4.43Å; L350-Y377 HydrophobicContact CD2-CE1 4.28Å; L350-Y377 HydrophobicContact CG-CD1 3.84Å; L350-Y377 HydrophobicContact CG-CE1 3.68Å; L350-I387 HydrophobicContact CD1-CG2 3.77Å; L350-I387 HydrophobicContact CD2-CG2 3.82Å; L350-I387 HydrophobicContact CG-CG2 4.47Å; L350-M407 HydrophobicContact CB-CE 3.87Å; L350-M407 HydrophobicContact CD2-CE 3.87Å; L350-M407 HydrophobicContact CG-CE 4.49Å; L350-L408 PolarHBondContact N-O 3.08Å; L350-F410 PolarHBondContact O-N 3.46Å
351	I	97.3	Very high	92.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	118.1	-166.8	-44.2	179.5	0	0	0	109.9	M349 A358 I361 P374 I375 L376 Y377	M349-I351 HydrophobicContact CE-CD1 3.78Å; M349-I351 HydrophobicContact CE-CG1 3.82Å; M349-I351 HydrophobicContact CG-CD1 4.34Å; M349-I351 HydrophobicContact CG-CG1 4Å; M349-I351 HydrophobicContact SD-CD1 4.39Å; I351-A358 HydrophobicContact CG2-CB 4.23Å; I351-I361 HydrophobicContact CD1-CB 4.23Å; I351-I361 HydrophobicContact CD1-CG2 3.83Å; I351-I361 HydrophobicContact CG2-CD1 3.82Å; I351-P374 HydrophobicContact CD1-CB 4.24Å; I351-I375 PolarHBondContact N-O 2.82Å; I351-L376 HydrophobicContact CB-CD1 4Å; I351-L376 HydrophobicContact CG2-CD1 3.86Å; I351-Y377 WeakPolarHBondContact O-CD1 3.34Å; I351-Y377 WeakPolarHBondContact O-CE1 3.18Å; I351-Y377 PolarHBondContact O-N 3.3Å
352	S	96.6	Very high	92.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	131.1	172.4	-168	0	0	0	0	110.7	K354 V355 Y377 F410	S352-K354 PolarHBondContact O-N 2.77Å; S352-K354 PolarHBondContact OG-N 3.42Å; S352-V355 WeakPolarHBondContact O-CB 3.36Å; S352-V355 WeakPolarHBondContact O-CG2 3.39Å; S352-V355 PolarHBondContact O-N 3.47Å; S352-Y377 WeakPolarHBondContact CB-OH 3.28Å; S352-F410 WeakPolarHBondContact CB-O 3.42Å; S352-F410 PolarHBondContact N-O 3.03Å
353	S	95.1	Very high	92.9	Very high	49 Å²	49	30.5 Å²	30.5	34%	0.343	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-11.4	164.5	45.5	0	0	0	0	114.8	Y377 D378 H379	S353-Y377 VanDerWaalsContact CB-O 3.27Å; S353-Y377 WeakPolarHBondContact CB-O 3.5Å; S353-Y377 PolarHBondContact N-O 3.44Å; S353-Y377 PolarHBondContact OG-O 3.06Å; S353-D378 VanDerWaalsContact OG-CA 3.32Å; S353-D378 WeakPolarHBondContact OG-CA 3.47Å; S353-H379 PolarHBondContact OG-N 3.44Å
354	K	93.6	Very high	93	Very high	73 Å²	73	28.8 Å²	28.8	32%	0.317	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-7.8	168.2	-65.1	-59.2	-178.3	-166.6	0	114.1	S352 H379 E380 Q412	S352-K354 PolarHBondContact O-N 2.77Å; S352-K354 PolarHBondContact OG-N 3.42Å; K354-H379 HydrophobicContact CG-CB 3.61Å; K354-H379 VanDerWaalsContact CG-CG 3.49Å; K354-E380 WeakPolarHBondContact CE-OE1 3.48Å; K354-E380 IonicContact NZ-OE1 2.68Å; K354-E380 PolarHBondContact NZ-OE1 3.03Å; K354-Q412 HydrophobicContact CB-CG 3.95Å; K354-Q412 PolarHBondContact O-NE2 3.09Å
355	V	92.6	Very high	93	Very high	6 Å²	6	26.9 Å²	26.9	4%	0.036	14%	0.143	C	C	.	.	S	Bend	trans	-67.5	131.6	168.4	-178.3	0	0	0	0	108.1	S352 K357 A358 I361 F410 W515	S352-V355 WeakPolarHBondContact O-CB 3.36Å; S352-V355 WeakPolarHBondContact O-CG2 3.39Å; S352-V355 PolarHBondContact O-N 3.47Å; V355-K357 PolarHBondContact O-N 3.34Å; V355-A358 HydrophobicContact CB-CB 4.19Å; V355-A358 WeakPolarHBondContact O-CB 3.49Å; V355-A358 PolarHBondContact O-N 2.87Å; V355-I361 HydrophobicContact CB-CD1 4.23Å; V355-I361 HydrophobicContact CG1-CD1 3.66Å; V355-F410 HydrophobicContact CB-CE2 4.47Å; V355-F410 HydrophobicContact CG1-CD1 4.43Å; V355-F410 HydrophobicContact CG1-CD2 4.08Å; V355-F410 HydrophobicContact CG1-CE1 4.03Å; V355-F410 HydrophobicContact CG1-CE2 3.62Å; V355-F410 HydrophobicContact CG1-CG 4.47Å; V355-F410 HydrophobicContact CG1-CZ 3.61Å; V355-F410 HydrophobicContact CG2-CB 4.44Å; V355-F410 HydrophobicContact CG2-CD2 3.54Å; V355-F410 HydrophobicContact CG2-CE2 3.9Å; V355-F410 HydrophobicContact CG2-CG 3.94Å; V355-F410 WeakPolarHBondContact CG2-O 3.5Å; V355-W515 HydrophobicContact CG1-CH2 3.77Å; V355-W515 HydrophobicContact CG1-CZ2 4.01Å
356	P	89.7	Confident	92.9	Very high	44 Å²	44	28.6 Å²	28.6	29%	0.286	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	124.3	-177.2	-19.5	31.4	0	0	0	110.9	W515 Q519	P356-W515 WeakPolarHBondContact O-CZ2 3.46Å; P356-Q519 HydrophobicContact CB-CB 4.3Å
357	K	88.1	Confident	92.6	Very high	50 Å²	50	37.4 Å²	37.4	22%	0.217	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	48.5	-175.4	-61	-171.4	176.7	-174.2	0	113.2	V355 E359 Y360 W515 S521 F526	V355-K357 PolarHBondContact O-N 3.34Å; K357-E359 VanDerWaalsContact C-N 3.3Å; K357-E359 VanDerWaalsContact C-OE2 3.25Å; K357-E359 VanDerWaalsContact CA-OE1 3.23Å; K357-E359 WeakPolarHBondContact CA-OE1 3.48Å; K357-E359 WeakPolarHBondContact CA-OE2 3.37Å; K357-E359 PolarHBondContact O-N 3.04Å; K357-Y360 HydrophobicContact CB-CD2 4.21Å; K357-Y360 PolarHBondContact O-N 3.45Å; K357-W515 PolarHBondContact O-NE1 3.02Å; K357-S521 PolarHBondContact NZ-O 3.24Å; K357-F526 HydrophobicContact CD-CD2 4.02Å; K357-F526 HydrophobicContact CD-CE2 3.48Å; K357-F526 VanDerWaalsContact CD-CE2 3.48Å; K357-F526 HydrophobicContact CD-CZ 4.48Å
358	A	90.6	Very high	92.2	Very high	3 Å²	3	40.8 Å²	40.8	3%	0.025	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-64.4	-32.1	-179	0	0	0	0	0	113.4	I351 V355 Y360 I361 L376	I351-A358 HydrophobicContact CG2-CB 4.23Å; V355-A358 HydrophobicContact CB-CB 4.19Å; V355-A358 WeakPolarHBondContact O-CB 3.49Å; V355-A358 PolarHBondContact O-N 2.87Å; A358-Y360 PolarHBondContact O-N 2.9Å; A358-I361 HydrophobicContact CB-CD1 4.29Å; A358-I361 VanDerWaalsContact O-CB 3.28Å; A358-I361 WeakPolarHBondContact O-CB 3.32Å; A358-I361 WeakPolarHBondContact O-CG1 3.48Å; A358-I361 PolarHBondContact O-N 3.01Å; A358-L376 HydrophobicContact CB-CD1 3.82Å
359	E	88.9	Confident	91.8	Very high	99 Å²	99	42 Å²	42	46%	0.463	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-58.6	-29.4	179.6	63.9	-71.6	167.1	0	0	113.4	K357 P362	K357-E359 VanDerWaalsContact C-N 3.3Å; K357-E359 VanDerWaalsContact C-OE2 3.25Å; K357-E359 VanDerWaalsContact CA-OE1 3.23Å; K357-E359 WeakPolarHBondContact CA-OE1 3.48Å; K357-E359 WeakPolarHBondContact CA-OE2 3.37Å; K357-E359 PolarHBondContact O-N 3.04Å; E359-P362 WeakPolarHBondContact O-CD 3.35Å
360	Y	89.4	Confident	91.5	Very high	48 Å²	48	47 Å²	47	19%	0.188	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-86.7	-10.4	175.7	-64.8	-76.2	0	0	0	113.8	K357 A358 T363 F526 D527	K357-Y360 HydrophobicContact CB-CD2 4.21Å; K357-Y360 PolarHBondContact O-N 3.45Å; A358-Y360 PolarHBondContact O-N 2.9Å; Y360-T363 PolarHBondContact O-N 3.39Å; Y360-T363 PolarHBondContact O-OG1 3.18Å; Y360-F526 HydrophobicContact CD1-CB 3.52Å; Y360-F526 HydrophobicContact CD1-CG 4.25Å; Y360-F526 HydrophobicContact CD2-CB 4.25Å; Y360-F526 HydrophobicContact CD2-CD2 4.1Å; Y360-F526 HydrophobicContact CD2-CG 4.32Å; Y360-F526 HydrophobicContact CE1-CB 3.45Å; Y360-F526 VanDerWaalsContact CE1-CB 3.45Å; Y360-F526 HydrophobicContact CE1-CG 4.47Å; Y360-F526 HydrophobicContact CE2-CB 4.18Å; Y360-F526 HydrophobicContact CE2-CD2 4.2Å; Y360-F526 HydrophobicContact CG-CB 3.93Å; Y360-F526 HydrophobicContact CG-CD2 4.39Å; Y360-F526 HydrophobicContact CG-CG 4.16Å; Y360-D527 WeakPolarHBondContact CE1-OD1 3.48Å
361	I	91.6	Very high	91.3	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-59.4	-38.4	-176	-64	178.4	0	0	0	113.2	M349 I351 V355 A358 T363 I364 F410 F507 W515	M349-I361 HydrophobicContact CE-CG2 3.46Å; M349-I361 VanDerWaalsContact CE-CG2 3.46Å; I351-I361 HydrophobicContact CD1-CB 4.23Å; I351-I361 HydrophobicContact CD1-CG2 3.83Å; I351-I361 HydrophobicContact CG2-CD1 3.82Å; V355-I361 HydrophobicContact CB-CD1 4.23Å; V355-I361 HydrophobicContact CG1-CD1 3.66Å; A358-I361 HydrophobicContact CB-CD1 4.29Å; A358-I361 VanDerWaalsContact O-CB 3.28Å; A358-I361 WeakPolarHBondContact O-CB 3.32Å; A358-I361 WeakPolarHBondContact O-CG1 3.48Å; A358-I361 PolarHBondContact O-N 3.01Å; I361-T363 PolarHBondContact O-N 2.8Å; I361-I364 WeakPolarHBondContact O-CG1 3.38Å; I361-I364 PolarHBondContact O-N 3.03Å; I361-F410 HydrophobicContact CD1-CD1 4.03Å; I361-F410 HydrophobicContact CD1-CE1 3.9Å; I361-F507 HydrophobicContact CG2-CE1 3.87Å; I361-W515 HydrophobicContact CD1-CH2 3.98Å; I361-W515 HydrophobicContact CD1-CZ2 3.62Å; I361-W515 HydrophobicContact CG1-CH2 4.3Å; I361-W515 HydrophobicContact CG1-CZ2 3.61Å
362	P	89.1	Confident	91.3	Very high	43 Å²	43	47.6 Å²	47.6	28%	0.279	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-57.1	-30.9	173.9	-27.6	36.9	0	0	0	114.5	E359 I364 I365	E359-P362 WeakPolarHBondContact O-CD 3.35Å; P362-I364 VanDerWaalsContact C-N 3.31Å; P362-I364 PolarHBondContact O-N 3.49Å; P362-I365 PolarHBondContact O-N 2.79Å
363	T	88.5	Confident	91.2	Very high	54 Å²	54	48.2 Å²	48.2	33%	0.331	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-75.3	-18.5	-176.6	68.9	0	0	0	0	114.1	Y360 I361 R367 L530	Y360-T363 PolarHBondContact O-N 3.39Å; Y360-T363 PolarHBondContact O-OG1 3.18Å; I361-T363 PolarHBondContact O-N 2.8Å; T363-R367 PolarHBondContact O-NH2 3.24Å; T363-R367 VanDerWaalsContact O-NH2 3.07Å; T363-L530 VanDerWaalsContact OG1-CD1 3.27Å; T363-L530 WeakPolarHBondContact OG1-CD1 3.44Å
364	I	92.4	Very high	91.3	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-102.2	3.1	179.5	65.6	161.7	0	0	0	113.6	I361 P362 F507 D508 L511 Y512 W515 L530	I361-I364 WeakPolarHBondContact O-CG1 3.38Å; I361-I364 PolarHBondContact O-N 3.03Å; P362-I364 VanDerWaalsContact C-N 3.31Å; P362-I364 PolarHBondContact O-N 3.49Å; I364-F507 HydrophobicContact CD1-CD1 4.06Å; I364-F507 HydrophobicContact CD1-CE1 4.27Å; I364-F507 HydrophobicContact CG1-CD1 4.08Å; I364-F507 HydrophobicContact CG1-CE1 4.44Å; I364-D508 PolarHBondContact O-N 3.22Å; I364-D508 VanDerWaalsContact O-N 3.1Å; I364-L511 HydrophobicContact CB-CB 3.82Å; I364-L511 HydrophobicContact CG2-CB 3.79Å; I364-Y512 HydrophobicContact CD1-CD2 3.99Å; I364-W515 HydrophobicContact CD1-CB 3.97Å; I364-W515 HydrophobicContact CD1-CD2 3.97Å; I364-W515 HydrophobicContact CD1-CE3 4.14Å; I364-W515 HydrophobicContact CD1-CG 3.89Å; I364-W515 HydrophobicContact CG2-CB 4.32Å; I364-L530 HydrophobicContact CG2-CD1 3.82Å; I364-L530 HydrophobicContact CG2-CD2 4.06Å
365	I	93.1	Very high	91.4	Very high	17 Å²	17	44.8 Å²	44.8	9%	0.087	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-67	153.8	171.5	-70.4	176.1	0	0	0	109.8	M349 P362 R367 I372 P374 F507	M349-I365 HydrophobicContact SD-CD1 4.04Å; M349-I365 HydrophobicContact SD-CG1 4.35Å; P362-I365 PolarHBondContact O-N 2.79Å; I365-R367 PolarHBondContact O-N 3.49Å; I365-R367 VanDerWaalsContact O-N 3.12Å; I365-I372 HydrophobicContact CD1-CG2 4.35Å; I365-I372 HydrophobicContact CG2-CB 4.07Å; I365-I372 HydrophobicContact CG2-CD1 4.1Å; I365-I372 HydrophobicContact CG2-CG2 3.74Å; I365-P374 HydrophobicContact CD1-CB 3.6Å; I365-P374 HydrophobicContact CD1-CG 3.84Å; I365-F507 HydrophobicContact CG1-CD1 4.46Å
366	R	90.9	Very high	91.6	Very high	75 Å²	75	47.3 Å²	47.3	28%	0.283	24%	0.239	S	C	.	.			trans	-56.9	112.5	174	-69	-160.9	76.4	116.5	2.1	111.5	D368 D369 I372 E504 Y506 F507	R366-D368 WeakPolarHBondContact CB-OD1 3.47Å; R366-D368 IonicContact CZ-OD1 2.67Å; R366-D368 IonicContact CZ-OD2 2.62Å; R366-D368 IonicContact NE-OD1 3.58Å; R366-D368 PolarHBondContact NE-OD1 3.38Å; R366-D368 IonicContact NE-OD2 2.73Å; R366-D368 PolarHBondContact NE-OD2 3.27Å; R366-D368 IonicContact NH2-OD1 2.64Å; R366-D368 PolarHBondContact NH2-OD1 3.04Å; R366-D368 IonicContact NH2-OD2 2.7Å; R366-D368 PolarHBondContact NH2-OD2 2.68Å; R366-D368 PolarHBondContact O-N 2.62Å; R366-D369 HydrophobicContact CB-CB 4.02Å; R366-I372 HydrophobicContact CB-CD1 3.8Å; R366-I372 HydrophobicContact CG-CD1 4.25Å; R366-E504 WeakPolarHBondContact CD-O 3.49Å; R366-E504 PolarHBondContact NH1-O 3.33Å; R366-Y506 PolarHBondContact N-O 3.29Å; R366-F507 WeakPolarHBondContact CG-O 3.48Å
367	R	87.4	Confident	91.9	Very high	184 Å²	184	45.7 Å²	45.7	69%	0.694	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-9.2	176.1	-57.2	-176.7	-170.4	173.4	5.8	112.6	T363 I365 L530	T363-R367 PolarHBondContact O-NH2 3.24Å; T363-R367 VanDerWaalsContact O-NH2 3.07Å; I365-R367 PolarHBondContact O-N 3.49Å; I365-R367 VanDerWaalsContact O-N 3.12Å; R367-L530 PolarHBondContact NH2-O 3.32Å
368	D	89	Confident	92.3	Very high	109 Å²	109	45.9 Å²	45.9	58%	0.583	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-4.3	177.9	62	-52.7	0	0	0	114.4	R366	R366-D368 WeakPolarHBondContact CB-OD1 3.47Å; R366-D368 IonicContact CZ-OD1 2.67Å; R366-D368 IonicContact CZ-OD2 2.62Å; R366-D368 IonicContact NE-OD1 3.58Å; R366-D368 PolarHBondContact NE-OD1 3.38Å; R366-D368 IonicContact NE-OD2 2.73Å; R366-D368 PolarHBondContact NE-OD2 3.27Å; R366-D368 IonicContact NH2-OD1 2.64Å; R366-D368 PolarHBondContact NH2-OD1 3.04Å; R366-D368 IonicContact NH2-OD2 2.7Å; R366-D368 PolarHBondContact NH2-OD2 2.68Å; R366-D368 PolarHBondContact O-N 2.62Å
369	D	90.1	Very high	92.5	Very high	27 Å²	27	46.7 Å²	46.7	14%	0.144	23%	0.234	C	C	.	.			trans	-130.1	89.3	-173	-174	-2	0	0	0	111.5	K347 R366 S371 I372	K347-D369 IonicContact NZ-OD1 3.49Å; K347-D369 PolarHBondContact NZ-OD1 3.05Å; K347-D369 IonicContact NZ-OD2 2.69Å; K347-D369 PolarHBondContact NZ-OD2 2.95Å; R366-D369 HydrophobicContact CB-CB 4.02Å; D369-S371 PolarHBondContact O-N 3.5Å; D369-S371 VanDerWaalsContact O-N 3.15Å; D369-S371 PolarHBondContact OD1-N 3.05Å; D369-S371 PolarHBondContact OD1-OG 2.82Å; D369-I372 HydrophobicContact CB-CD1 3.83Å; D369-I372 HydrophobicContact CB-CG1 4.39Å; D369-I372 PolarHBondContact O-N 2.75Å
370	P	89.6	Confident	92.8	Very high	105 Å²	105	45.6 Å²	45.6	68%	0.682	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-4.9	-175.6	30.5	-36.2	0	0	0	113.7	I372 Y398	P370-I372 VanDerWaalsContact C-N 3.26Å; P370-I372 PolarHBondContact O-N 3.01Å; P370-Y398 WeakPolarHBondContact O-CE2 3.41Å
371	S	94.1	Very high	93.1	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-7.3	177.3	102.4	0	0	0	0	113.3	P345 P346 K347 D369 I373 Y398	P345-S371 VanDerWaalsContact O-CB 3.28Å; P345-S371 WeakPolarHBondContact O-CB 3.11Å; P345-S371 PolarHBondContact O-OG 2.64Å; P346-S371 WeakPolarHBondContact CA-O 3.37Å; K347-S371 WeakPolarHBondContact CD-OG 3.49Å; K347-S371 WeakPolarHBondContact CE-OG 3.26Å; K347-S371 PolarHBondContact N-O 3.44Å; K347-S371 PolarHBondContact NZ-OG 2.84Å; D369-S371 PolarHBondContact O-N 3.5Å; D369-S371 VanDerWaalsContact O-N 3.15Å; D369-S371 PolarHBondContact OD1-N 3.05Å; D369-S371 PolarHBondContact OD1-OG 2.82Å; S371-I373 PolarHBondContact O-N 2.98Å; S371-Y398 VanDerWaalsContact CB-OH 3.28Å; S371-Y398 WeakPolarHBondContact CB-OH 3.35Å
372	I	96.3	Very high	93.3	Very high	13 Å²	13	49.9 Å²	49.9	7%	0.067	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	116.6	177.2	-57.8	162.2	0	0	0	110.3	K347 I365 R366 D369 P370 P374 Y506	K347-I372 HydrophobicContact CB-CG1 4.12Å; K347-I372 HydrophobicContact CD-CG1 3.91Å; K347-I372 WeakPolarHBondContact O-CA 3.46Å; I365-I372 HydrophobicContact CD1-CG2 4.35Å; I365-I372 HydrophobicContact CG2-CB 4.07Å; I365-I372 HydrophobicContact CG2-CD1 4.1Å; I365-I372 HydrophobicContact CG2-CG2 3.74Å; R366-I372 HydrophobicContact CB-CD1 3.8Å; R366-I372 HydrophobicContact CG-CD1 4.25Å; D369-I372 HydrophobicContact CB-CD1 3.83Å; D369-I372 HydrophobicContact CB-CG1 4.39Å; D369-I372 PolarHBondContact O-N 2.75Å; P370-I372 VanDerWaalsContact C-N 3.26Å; P370-I372 PolarHBondContact O-N 3.01Å; I372-P374 VanDerWaalsContact O-CD 3.24Å; I372-P374 WeakPolarHBondContact O-CD 3.34Å; I372-Y506 HydrophobicContact CG2-CD1 4.47Å
373	I	96.1	Very high	93.7	Very high	14 Å²	14	51.3 Å²	51.3	7%	0.072	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	97.3	-174	-60.9	174.8	0	0	0	109.3	P346 K347 V348 M349 S371 I375 K394 L395 Y398	P346-I373 HydrophobicContact CB-CD1 3.81Å; K347-I373 PolarHBondContact O-N 3.19Å; V348-I373 HydrophobicContact CG2-CB 4.33Å; V348-I373 HydrophobicContact CG2-CD1 4.5Å; M349-I373 PolarHBondContact N-O 3.41Å; S371-I373 PolarHBondContact O-N 2.98Å; I373-I375 HydrophobicContact CG2-CG1 4.47Å; I373-K394 HydrophobicContact CG2-CB 3.68Å; I373-K394 HydrophobicContact CG2-CD 4.34Å; I373-K394 HydrophobicContact CG2-CG 4.32Å; I373-L395 HydrophobicContact CD1-CD2 4.17Å; I373-Y398 HydrophobicContact CD1-CD1 4.35Å; I373-Y398 HydrophobicContact CD1-CD2 4.24Å; I373-Y398 HydrophobicContact CD1-CG 3.86Å
374	P	96	Very high	94.1	Very high	44 Å²	44	49.3 Å²	49.3	29%	0.286	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	136.1	177	29.3	-33.7	0	0	0	113.1	M349 I351 I365 I372	M349-P374 WeakPolarHBondContact O-CA 3.26Å; I351-P374 HydrophobicContact CD1-CB 4.24Å; I365-P374 HydrophobicContact CD1-CB 3.6Å; I365-P374 HydrophobicContact CD1-CG 3.84Å; I372-P374 VanDerWaalsContact O-CD 3.24Å; I372-P374 WeakPolarHBondContact O-CD 3.34Å
375	I	96.7	Very high	94.2	Very high	6 Å²	6	52.8 Å²	52.8	3%	0.031	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	112.9	177.1	-63.8	173.1	0	0	0	108.3	V348 M349 L350 I351 I373 E390 I391 K394	V348-I375 HydrophobicContact CG1-CD1 4.07Å; M349-I375 PolarHBondContact O-N 2.76Å; L350-I375 HydrophobicContact CD1-CB 4.24Å; L350-I375 HydrophobicContact CD1-CG2 3.84Å; I351-I375 PolarHBondContact N-O 2.82Å; I373-I375 HydrophobicContact CG2-CG1 4.47Å; I375-E390 HydrophobicContact CD1-CG 4.31Å; I375-E390 HydrophobicContact CG1-CG 4.29Å; I375-E390 HydrophobicContact CG2-CB 4.41Å; I375-E390 HydrophobicContact CG2-CG 3.6Å; I375-I391 HydrophobicContact CD1-CB 4.18Å; I375-I391 HydrophobicContact CD1-CG1 3.54Å; I375-K394 HydrophobicContact CD1-CB 4.22Å; I375-K394 HydrophobicContact CD1-CG 4.1Å; I375-K394 HydrophobicContact CG1-CG 4.13Å
376	L	96.3	Very high	94.4	Very high	58 Å²	58	55.3 Å²	55.3	30%	0.304	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	124.7	177	179	67.4	0	0	0	109.6	I351 A358	I351-L376 HydrophobicContact CB-CD1 4Å; I351-L376 HydrophobicContact CG2-CD1 3.86Å; A358-L376 HydrophobicContact CB-CD1 3.82Å
377	Y	96.4	Very high	94.7	Very high	10 Å²	10	52 Å²	52	4%	0.039	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	148.3	-178.4	71.4	-87.9	0	0	0	113.1	L350 I351 S352 S353 H379 I387 L420 L421	L350-Y377 HydrophobicContact CD1-CD1 3.49Å; L350-Y377 VanDerWaalsContact CD1-CD1 3.49Å; L350-Y377 HydrophobicContact CD1-CE1 3.9Å; L350-Y377 HydrophobicContact CD1-CG 4.43Å; L350-Y377 HydrophobicContact CD2-CE1 4.28Å; L350-Y377 HydrophobicContact CG-CD1 3.84Å; L350-Y377 HydrophobicContact CG-CE1 3.68Å; I351-Y377 WeakPolarHBondContact O-CD1 3.34Å; I351-Y377 WeakPolarHBondContact O-CE1 3.18Å; I351-Y377 PolarHBondContact O-N 3.3Å; S352-Y377 WeakPolarHBondContact CB-OH 3.28Å; S353-Y377 VanDerWaalsContact CB-O 3.27Å; S353-Y377 WeakPolarHBondContact CB-O 3.5Å; S353-Y377 PolarHBondContact N-O 3.44Å; S353-Y377 PolarHBondContact OG-O 3.06Å; Y377-H379 PolarHBondContact O-N 2.81Å; Y377-I387 HydrophobicContact CD1-CD1 4.33Å; Y377-I387 HydrophobicContact CD2-CD1 3.76Å; Y377-I387 HydrophobicContact CE2-CD1 4.14Å; Y377-I387 HydrophobicContact CG-CD1 3.86Å; Y377-I387 HydrophobicContact CG-CG1 4.23Å; Y377-L420 VanDerWaalsContact CE2-O 3.28Å; Y377-L420 WeakPolarHBondContact CE2-O 3.13Å; Y377-L420 PolarHBondContact OH-O 2.98Å; Y377-L421 HydrophobicContact CD2-CD2 3.9Å; Y377-L421 HydrophobicContact CE2-CD2 3.84Å
378	D	96.1	Very high	95.2	Very high	54 Å²	54	43.4 Å²	43.4	29%	0.289	23%	0.234	S	C	.	.			trans	-77.1	113.8	172.2	-166.8	-28.5	0	0	0	110.2	S353 E380 H381 A382	S353-D378 VanDerWaalsContact OG-CA 3.32Å; S353-D378 WeakPolarHBondContact OG-CA 3.47Å; D378-E380 PolarHBondContact O-N 3.49Å; D378-E380 PolarHBondContact OD1-N 2.94Å; D378-H381 HydrophobicContact CB-CB 4.29Å; D378-H381 PolarHBondContact OD1-N 3.02Å; D378-H381 IonicContact OD1-ND1 2.62Å; D378-H381 IonicContact OD2-CE1 3.42Å; D378-H381 IonicContact OD2-CG 2.74Å; D378-H381 IonicContact OD2-ND1 2.77Å; D378-H381 PolarHBondContact OD2-ND1 2.9Å; D378-A382 WeakPolarHBondContact O-CB 3.47Å; D378-A382 PolarHBondContact O-N 3.49Å
379	H	95.3	Very high	95.6	Very high	20 Å²	20	44.7 Å²	44.7	9%	0.093	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-25.9	178.3	174.9	82.5	0	0	0	113	S353 K354 Y377 L420 K422	S353-H379 PolarHBondContact OG-N 3.44Å; K354-H379 HydrophobicContact CG-CB 3.61Å; K354-H379 VanDerWaalsContact CG-CG 3.49Å; Y377-H379 PolarHBondContact O-N 2.81Å; H379-L420 PolarHBondContact ND1-O 2.93Å; H379-K422 PolarHBondContact CE1-N 2.98Å; H379-K422 PolarHBondContact NE2-N 3.46Å; H379-K422 VanDerWaalsContact O-CB 3.26Å; H379-K422 WeakPolarHBondContact O-CB 3.18Å; H379-K422 PolarHBondContact O-N 3.18Å
380	E	94.8	Very high	96	Very high	76 Å²	76	44.7 Å²	44.7	36%	0.355	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-22.6	-175.6	-59.6	-149.5	-149.3	0	0	114.3	K354 D378 K422	K354-E380 WeakPolarHBondContact CE-OE1 3.48Å; K354-E380 IonicContact NZ-OE1 2.68Å; K354-E380 PolarHBondContact NZ-OE1 3.03Å; D378-E380 PolarHBondContact O-N 3.49Å; D378-E380 PolarHBondContact OD1-N 2.94Å; E380-K422 HydrophobicContact CB-CD 3.79Å; E380-K422 HydrophobicContact CG-CD 3.9Å; E380-K422 WeakPolarHBondContact OE2-CE 2.95Å; E380-K422 IonicContact OE2-NZ 2.98Å; E380-K422 PolarHBondContact OE2-NZ 2.93Å
381	H	95.2	Very high	96.4	Very high	121 Å²	121	39.7 Å²	39.7	56%	0.56	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-126.3	-20	-172.2	-54.7	111.1	0	0	0	115.4	D378	D378-H381 HydrophobicContact CB-CB 4.29Å; D378-H381 PolarHBondContact OD1-N 3.02Å; D378-H381 IonicContact OD1-ND1 2.62Å; D378-H381 IonicContact OD2-CE1 3.42Å; D378-H381 IonicContact OD2-CG 2.74Å; D378-H381 IonicContact OD2-ND1 2.77Å; D378-H381 PolarHBondContact OD2-ND1 2.9Å
382	A	96.1	Very high	96.5	Very high	18 Å²	18	42.7 Å²	42.7	15%	0.149	22%	0.217	C	C	.	.			trans	-75.4	149.5	175	0	0	0	0	0	111.4	D378 L421	D378-A382 WeakPolarHBondContact O-CB 3.47Å; D378-A382 PolarHBondContact O-N 3.49Å; A382-L421 HydrophobicContact CB-CD2 4.18Å; A382-L421 WeakPolarHBondContact O-CD1 3.24Å; A382-L421 WeakPolarHBondContact O-CD2 3.44Å
383	T	96.6	Very high	96.5	Very high	73 Å²	73	48 Å²	48	45%	0.448	24%	0.236	S	C	.	.			trans	-95.6	178.3	168.5	71	0	0	0	0	110.8	E385 D386 L421	T383-E385 PolarHBondContact OG1-N 3.25Å; T383-D386 WeakPolarHBondContact CA-OD2 3.44Å; T383-D386 VanDerWaalsContact CB-OD2 3.26Å; T383-D386 WeakPolarHBondContact CB-OD2 3.34Å; T383-D386 WeakPolarHBondContact CG2-OD2 3.44Å; T383-D386 PolarHBondContact N-OD2 3.31Å; T383-D386 PolarHBondContact OG1-N 2.97Å; T383-D386 PolarHBondContact OG1-OD2 3.26Å; T383-L421 VanDerWaalsContact C-CD1 3.46Å
384	F	96.8	Very high	96.5	Very high	11 Å²	11	50.3 Å²	50.3	5%	0.048	25%	0.246	C	C	.	.	H	α-helix	trans	-71.5	-33.6	172.6	-76.4	-50.8	0	0	0	112.2	I387 L388 L420 L421 K424 D436 M437 F440	F384-I387 PolarHBondContact O-N 3.47Å; F384-L388 WeakPolarHBondContact O-CD1 3.48Å; F384-L388 WeakPolarHBondContact O-CG 3.49Å; F384-L388 PolarHBondContact O-N 3.25Å; F384-L388 VanDerWaalsContact O-N 3.14Å; F384-L420 HydrophobicContact CE1-CB 4.21Å; F384-L420 HydrophobicContact CE1-CD1 4.04Å; F384-L420 HydrophobicContact CZ-CD1 4.46Å; F384-L421 HydrophobicContact CD1-CD1 3.63Å; F384-L421 HydrophobicContact CD1-CG 4.45Å; F384-L421 HydrophobicContact CD2-CD1 4.39Å; F384-L421 HydrophobicContact CE1-CD1 3.77Å; F384-L421 HydrophobicContact CE1-CG 4.22Å; F384-L421 HydrophobicContact CG-CD1 3.96Å; F384-L421 HydrophobicContact CZ-CD1 4.23Å; F384-K424 HydrophobicContact CE2-CB 4.1Å; F384-K424 HydrophobicContact CE2-CD 4.15Å; F384-K424 HydrophobicContact CE2-CG 3.87Å; F384-K424 HydrophobicContact CZ-CB 3.84Å; F384-K424 HydrophobicContact CZ-CG 4.11Å; F384-D436 HydrophobicContact CD2-CB 3.99Å; F384-D436 HydrophobicContact CE2-CB 4.21Å; F384-M437 HydrophobicContact CE2-CG 4.15Å; F384-M437 HydrophobicContact CZ-CG 4.27Å; F384-F440 HydrophobicContact CB-CB 3.95Å; F384-F440 HydrophobicContact CB-CD2 3.71Å; F384-F440 HydrophobicContact CB-CG 4.1Å; F384-F440 HydrophobicContact CD1-CB 3.92Å; F384-F440 HydrophobicContact CD1-CD1 4.02Å; F384-F440 AromaticContact CD1-CD2 3.47Å; F384-F440 HydrophobicContact CD1-CD2 3.47Å; F384-F440 VanDerWaalsContact CD1-CD2 3.47Å; F384-F440 HydrophobicContact CD1-CE1 4.45Å; F384-F440 AromaticContact CD1-CE2 3.94Å; F384-F440 HydrophobicContact CD1-CE2 3.94Å; F384-F440 AromaticContact CD1-CG 3.5Å; F384-F440 HydrophobicContact CD1-CG 3.5Å; F384-F440 HydrophobicContact CD1-CZ 4.41Å; F384-F440 HydrophobicContact CD2-CB 4.16Å; F384-F440 HydrophobicContact CE1-CB 4.47Å; F384-F440 HydrophobicContact CE1-CD1 4.12Å; F384-F440 HydrophobicContact CE1-CD2 4.36Å; F384-F440 HydrophobicContact CE1-CE1 4.5Å; F384-F440 HydrophobicContact CE1-CG 4.04Å; F384-F440 HydrophobicContact CG-CB 3.77Å; F384-F440 AromaticContact CG-CD2 3.85Å; F384-F440 HydrophobicContact CG-CD2 3.85Å; F384-F440 AromaticContact CG-CG 3.86Å; F384-F440 HydrophobicContact CG-CG 3.86Å
385	E	96.4	Very high	96.5	Very high	74 Å²	74	48.5 Å²	48.5	35%	0.346	23%	0.234	S	C	.	.	H	α-helix	trans	-72.2	-40.9	179.4	-54.5	-43.6	122.9	0	0	111.6	T383 I387 L388 E389 H439	T383-E385 PolarHBondContact OG1-N 3.25Å; E385-I387 PolarHBondContact O-N 3.15Å; E385-I387 VanDerWaalsContact O-N 3.13Å; E385-L388 PolarHBondContact O-N 2.92Å; E385-L388 WeakPolarHBondContact OE2-CD1 3.33Å; E385-E389 PolarHBondContact O-N 3.31Å; E385-H439 IonicContact OE1-CD2 2.74Å
386	D	96.6	Very high	96.4	Very high	70 Å²	70	51.7 Å²	51.7	37%	0.374	25%	0.251	S	S	.	.	H	α-helix	trans	-54.3	-37.2	174	-58.3	-59.5	0	0	0	111.9	T383 E390	T383-D386 WeakPolarHBondContact CA-OD2 3.44Å; T383-D386 VanDerWaalsContact CB-OD2 3.26Å; T383-D386 WeakPolarHBondContact CB-OD2 3.34Å; T383-D386 WeakPolarHBondContact CG2-OD2 3.44Å; T383-D386 PolarHBondContact N-OD2 3.31Å; T383-D386 PolarHBondContact OG1-N 2.97Å; T383-D386 PolarHBondContact OG1-OD2 3.26Å; D386-E390 VanDerWaalsContact O-CB 3.24Å; D386-E390 WeakPolarHBondContact O-CB 3.5Å; D386-E390 PolarHBondContact O-N 3.04Å; D386-E390 VanDerWaalsContact O-N 3.07Å
387	I	97.5	Very high	96.3	Very high	6 Å²	6	54.5 Å²	54.5	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-71.5	-41	177.6	-70.6	172.4	0	0	0	111	L350 Y377 F384 E385 I391 L421 F440	L350-I387 HydrophobicContact CD1-CG2 3.77Å; L350-I387 HydrophobicContact CD2-CG2 3.82Å; L350-I387 HydrophobicContact CG-CG2 4.47Å; Y377-I387 HydrophobicContact CD1-CD1 4.33Å; Y377-I387 HydrophobicContact CD2-CD1 3.76Å; Y377-I387 HydrophobicContact CE2-CD1 4.14Å; Y377-I387 HydrophobicContact CG-CD1 3.86Å; Y377-I387 HydrophobicContact CG-CG1 4.23Å; F384-I387 PolarHBondContact O-N 3.47Å; E385-I387 PolarHBondContact O-N 3.15Å; E385-I387 VanDerWaalsContact O-N 3.13Å; I387-I391 HydrophobicContact CG2-CD1 3.83Å; I387-I391 WeakPolarHBondContact O-CB 3.39Å; I387-I391 WeakPolarHBondContact O-CD1 3.42Å; I387-I391 WeakPolarHBondContact O-CG1 2.94Å; I387-I391 PolarHBondContact O-N 2.9Å; I387-L421 HydrophobicContact CD1-CD1 4.48Å; I387-L421 HydrophobicContact CD1-CD2 4Å; I387-L421 HydrophobicContact CD1-CG 4.44Å; I387-F440 HydrophobicContact CB-CE2 4.49Å; I387-F440 HydrophobicContact CG2-CE2 3.97Å; I387-F440 HydrophobicContact CG2-CZ 4.44Å
388	L	97.8	Very high	96.2	Very high	3 Å²	3	57.4 Å²	57.4	2%	0.016	28%	0.282	C	S	.	.	H	α-helix	trans	-70.2	-44.5	-179.8	-71	162.8	0	0	0	111.7	F384 E385 I391 E392 F440 R443 L444 L447	F384-L388 WeakPolarHBondContact O-CD1 3.48Å; F384-L388 WeakPolarHBondContact O-CG 3.49Å; F384-L388 PolarHBondContact O-N 3.25Å; F384-L388 VanDerWaalsContact O-N 3.14Å; E385-L388 PolarHBondContact O-N 2.92Å; E385-L388 WeakPolarHBondContact OE2-CD1 3.33Å; L388-I391 PolarHBondContact O-N 3.26Å; L388-E392 WeakPolarHBondContact O-CB 3.37Å; L388-E392 PolarHBondContact O-N 3.19Å; L388-F440 HydrophobicContact CD1-CD2 3.79Å; L388-F440 HydrophobicContact CD1-CE2 4.45Å; L388-F440 HydrophobicContact CD2-CD2 4.11Å; L388-F440 HydrophobicContact CD2-CE2 4.08Å; L388-F440 HydrophobicContact CG-CD2 3.85Å; L388-F440 HydrophobicContact CG-CE2 4Å; L388-R443 HydrophobicContact CD1-CB 3.79Å; L388-R443 HydrophobicContact CD1-CG 3.77Å; L388-R443 HydrophobicContact CD2-CB 4.25Å; L388-R443 HydrophobicContact CD2-CG 4.11Å; L388-R443 HydrophobicContact CG-CG 4.35Å; L388-L444 HydrophobicContact CD2-CB 3.91Å; L388-L444 HydrophobicContact CD2-CD1 4.36Å; L388-L447 HydrophobicContact CD2-CD1 4.2Å
389	E	97.4	Very high	96	Very high	135 Å²	135	57 Å²	57	63%	0.631	28%	0.278	S	S	*	.	H	α-helix	trans	-60.5	-44.2	173.5	-71.1	-171.5	-173.9	0	0	111.3	E385 I391 E392 R393	E385-E389 PolarHBondContact O-N 3.31Å; E389-I391 PolarHBondContact O-N 3.14Å; E389-E392 PolarHBondContact O-N 3.26Å; E389-R393 WeakPolarHBondContact O-CB 3.49Å; E389-R393 PolarHBondContact O-N 2.98Å
390	E	97.5	Very high	95.8	Very high	27 Å²	27	64.1 Å²	64.1	13%	0.126	31%	0.308	C	S	.	.	H	α-helix	trans	-65.1	-37.7	177.2	-179	61.5	-175.3	0	0	112.2	I375 D386 R393 K394	I375-E390 HydrophobicContact CD1-CG 4.31Å; I375-E390 HydrophobicContact CG1-CG 4.29Å; I375-E390 HydrophobicContact CG2-CB 4.41Å; I375-E390 HydrophobicContact CG2-CG 3.6Å; D386-E390 VanDerWaalsContact O-CB 3.24Å; D386-E390 WeakPolarHBondContact O-CB 3.5Å; D386-E390 PolarHBondContact O-N 3.04Å; D386-E390 VanDerWaalsContact O-N 3.07Å; E390-R393 IonicContact OE1-CZ 3.91Å; E390-R393 IonicContact OE1-NH2 2.94Å; E390-R393 PolarHBondContact OE1-NH2 3.02Å; E390-R393 IonicContact OE2-CZ 3.12Å; E390-R393 IonicContact OE2-NE 2.72Å; E390-R393 PolarHBondContact OE2-NE 2.97Å; E390-R393 IonicContact OE2-NH2 2.71Å; E390-R393 PolarHBondContact OE2-NH2 3.33Å; E390-K394 HydrophobicContact CG-CG 4.4Å; E390-K394 VanDerWaalsContact O-CB 3.23Å; E390-K394 WeakPolarHBondContact O-CB 3.38Å; E390-K394 WeakPolarHBondContact O-CG 3.32Å; E390-K394 PolarHBondContact O-N 3.12Å; E390-K394 WeakPolarHBondContact OE1-CE 3.42Å; E390-K394 IonicContact OE1-NZ 3.88Å
391	I	97.8	Very high	95.5	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-63.3	-50.3	173.1	-70.1	164.5	0	0	0	110.6	V348 I375 I387 L388 E389 R393 K394 L395 I404 M407 L444 L447	V348-I391 HydrophobicContact CG1-CG1 4.2Å; V348-I391 HydrophobicContact CG1-CG2 4.45Å; I375-I391 HydrophobicContact CD1-CB 4.18Å; I375-I391 HydrophobicContact CD1-CG1 3.54Å; I387-I391 HydrophobicContact CG2-CD1 3.83Å; I387-I391 WeakPolarHBondContact O-CB 3.39Å; I387-I391 WeakPolarHBondContact O-CD1 3.42Å; I387-I391 WeakPolarHBondContact O-CG1 2.94Å; I387-I391 PolarHBondContact O-N 2.9Å; L388-I391 PolarHBondContact O-N 3.26Å; E389-I391 PolarHBondContact O-N 3.14Å; I391-R393 PolarHBondContact O-N 3.27Å; I391-K394 PolarHBondContact O-N 3.06Å; I391-L395 HydrophobicContact CG2-CD1 3.85Å; I391-L395 HydrophobicContact CG2-CG 4.48Å; I391-L395 WeakPolarHBondContact O-CB 3.42Å; I391-L395 WeakPolarHBondContact O-CG 3.3Å; I391-L395 PolarHBondContact O-N 2.93Å; I391-I404 HydrophobicContact CG2-CD1 3.79Å; I391-M407 HydrophobicContact CD1-CE 3.99Å; I391-L444 HydrophobicContact CD1-CD1 4.08Å; I391-L447 HydrophobicContact CB-CD1 4.32Å; I391-L447 HydrophobicContact CG2-CD1 3.79Å
392	E	96.4	Very high	95.3	Very high	64 Å²	64	56.5 Å²	56.5	30%	0.299	28%	0.283	S	S	.	.	H	α-helix	trans	-65.8	-39	-178.1	-171.2	163.4	172.2	0	0	111.8	L388 E389 N396 R443 L447	L388-E392 WeakPolarHBondContact O-CB 3.37Å; L388-E392 PolarHBondContact O-N 3.19Å; E389-E392 PolarHBondContact O-N 3.26Å; E392-N396 WeakPolarHBondContact O-CB 3.04Å; E392-N396 PolarHBondContact O-N 3.48Å; E392-N396 PolarHBondContact O-ND2 2.96Å; E392-R443 IonicContact OE1-NH2 3.27Å; E392-R443 PolarHBondContact OE1-NH2 3.17Å; E392-R443 IonicContact OE2-CZ 2.68Å; E392-R443 IonicContact OE2-NE 3.39Å; E392-R443 IonicContact OE2-NH2 3.8Å; E392-R443 PolarHBondContact OE2-NH2 2.77Å; E392-L447 HydrophobicContact CB-CD1 4.49Å; E392-L447 HydrophobicContact CB-CD2 4.25Å; E392-L447 HydrophobicContact CG-CD2 4.17Å
393	R	96.9	Very high	95.2	Very high	123 Å²	123	57.1 Å²	57.1	46%	0.464	28%	0.282	S	S	.	.	H	α-helix	trans	-61.3	-47.3	172.5	-172.2	-178.9	79.1	104.6	-4.1	111.6	E389 E390 I391 N396 V397	E389-R393 WeakPolarHBondContact O-CB 3.49Å; E389-R393 PolarHBondContact O-N 2.98Å; E390-R393 IonicContact OE1-CZ 3.91Å; E390-R393 IonicContact OE1-NH2 2.94Å; E390-R393 PolarHBondContact OE1-NH2 3.02Å; E390-R393 IonicContact OE2-CZ 3.12Å; E390-R393 IonicContact OE2-NE 2.72Å; E390-R393 PolarHBondContact OE2-NE 2.97Å; E390-R393 IonicContact OE2-NH2 2.71Å; E390-R393 PolarHBondContact OE2-NH2 3.33Å; I391-R393 PolarHBondContact O-N 3.27Å; R393-N396 PolarHBondContact O-N 3.47Å; R393-V397 WeakPolarHBondContact O-CG2 3.17Å; R393-V397 PolarHBondContact O-N 3.28Å
394	K	96.5	Very high	95.2	Very high	64 Å²	64	53.6 Å²	53.6	28%	0.278	26%	0.261	S	S	.	.	H	α-helix	trans	-68.5	-38.3	-179.2	-72.7	-83.2	-176.2	165.9	0	112.8	I373 I375 E390 I391 V397 Y398	I373-K394 HydrophobicContact CG2-CB 3.68Å; I373-K394 HydrophobicContact CG2-CD 4.34Å; I373-K394 HydrophobicContact CG2-CG 4.32Å; I375-K394 HydrophobicContact CD1-CB 4.22Å; I375-K394 HydrophobicContact CD1-CG 4.1Å; I375-K394 HydrophobicContact CG1-CG 4.13Å; E390-K394 HydrophobicContact CG-CG 4.4Å; E390-K394 VanDerWaalsContact O-CB 3.23Å; E390-K394 WeakPolarHBondContact O-CB 3.38Å; E390-K394 WeakPolarHBondContact O-CG 3.32Å; E390-K394 PolarHBondContact O-N 3.12Å; E390-K394 WeakPolarHBondContact OE1-CE 3.42Å; E390-K394 IonicContact OE1-NZ 3.88Å; I391-K394 PolarHBondContact O-N 3.06Å; K394-V397 PolarHBondContact O-N 3.44Å; K394-Y398 PolarHBondContact O-N 2.9Å
395	L	95.3	Very high	95.1	Very high	5 Å²	5	55.8 Å²	55.8	3%	0.026	27%	0.269	C	S	.	.	H	α-helix	trans	-61.4	-48.1	172.4	-73.5	166.7	0	0	0	111	P346 V348 I373 I391 V397 Y398 H399 I404	P346-L395 HydrophobicContact CB-CD2 4Å; P346-L395 HydrophobicContact CG-CD2 3.76Å; V348-L395 HydrophobicContact CG2-CD2 4Å; V348-L395 HydrophobicContact CG2-CG 4.39Å; I373-L395 HydrophobicContact CD1-CD2 4.17Å; I391-L395 HydrophobicContact CG2-CD1 3.85Å; I391-L395 HydrophobicContact CG2-CG 4.48Å; I391-L395 WeakPolarHBondContact O-CB 3.42Å; I391-L395 WeakPolarHBondContact O-CG 3.3Å; I391-L395 PolarHBondContact O-N 2.93Å; L395-V397 VanDerWaalsContact C-N 3.28Å; L395-V397 PolarHBondContact O-N 2.96Å; L395-Y398 WeakPolarHBondContact O-CB 3.42Å; L395-Y398 PolarHBondContact O-N 3.4Å; L395-H399 CarbonylContact O-C 3.57Å; L395-H399 PolarHBondContact O-N 3.35Å; L395-I404 HydrophobicContact CD1-CD1 4.25Å; L395-I404 HydrophobicContact CD1-CG1 3.81Å; L395-I404 HydrophobicContact CD2-CG1 4.17Å
396	N	94.3	Very high	95.1	Very high	74 Å²	74	55.4 Å²	55.4	40%	0.396	27%	0.266	S	S	.	.	H	α-helix	trans	-66.5	-25.4	179	-78.9	-59.7	0	0	0	114.3	E392 R393	E392-N396 WeakPolarHBondContact O-CB 3.04Å; E392-N396 PolarHBondContact O-N 3.48Å; E392-N396 PolarHBondContact O-ND2 2.96Å; R393-N396 PolarHBondContact O-N 3.47Å
397	V	95.1	Very high	95.2	Very high	117 Å²	117	52.1 Å²	52.1	71%	0.709	25%	0.248	S	C	*	.	H	α-helix	trans	-75.8	-34.3	170.2	167.9	0	0	0	0	111.8	R393 K394 L395	R393-V397 WeakPolarHBondContact O-CG2 3.17Å; R393-V397 PolarHBondContact O-N 3.28Å; K394-V397 PolarHBondContact O-N 3.44Å; L395-V397 VanDerWaalsContact C-N 3.28Å; L395-V397 PolarHBondContact O-N 2.96Å
398	Y	94.1	Very high	95.2	Very high	71 Å²	71	51.8 Å²	51.8	28%	0.278	25%	0.247	S	C	.	.	H	α-helix	trans	-69.8	-56.8	175.8	176.1	-100.4	0	0	0	111.7	V344 P346 P370 S371 I373 K394 L395 A402	V344-Y398 WeakPolarHBondContact O-CE1 3.23Å; V344-Y398 PolarHBondContact O-OH 2.91Å; P346-Y398 HydrophobicContact CB-CD1 3.99Å; P346-Y398 HydrophobicContact CB-CE1 3.9Å; P346-Y398 HydrophobicContact CG-CD1 4.43Å; P346-Y398 HydrophobicContact CG-CE1 4.36Å; P370-Y398 WeakPolarHBondContact O-CE2 3.41Å; S371-Y398 VanDerWaalsContact CB-OH 3.28Å; S371-Y398 WeakPolarHBondContact CB-OH 3.35Å; I373-Y398 HydrophobicContact CD1-CD1 4.35Å; I373-Y398 HydrophobicContact CD1-CD2 4.24Å; I373-Y398 HydrophobicContact CD1-CG 3.86Å; K394-Y398 PolarHBondContact O-N 2.9Å; L395-Y398 WeakPolarHBondContact O-CB 3.42Å; L395-Y398 PolarHBondContact O-N 3.4Å; Y398-A402 HydrophobicContact CD1-CB 4.5Å
399	H	92.3	Very high	95.2	Very high	45 Å²	45	51.7 Å²	51.7	21%	0.208	25%	0.246	C	C	.	.	S	Bend	trans	-161.2	131.6	174.5	-176.3	-64	0	0	0	110	A337 T340 F343 L395 G401 A402	A337-H399 PolarHBondContact O-CE1 3Å; A337-H399 VanDerWaalsContact O-CE1 3.28Å; A337-H399 PolarHBondContact O-NE2 3.02Å; T340-H399 PolarHBondContact OG1-NE2 3.16Å; F343-H399 HydrophobicContact CD2-CB 4.45Å; F343-H399 AromaticContact CD2-CD2 3.83Å; F343-H399 AromaticContact CD2-CG 3.99Å; F343-H399 HydrophobicContact CE2-CB 4.25Å; L395-H399 CarbonylContact O-C 3.57Å; L395-H399 PolarHBondContact O-N 3.35Å; H399-G401 PolarHBondContact O-N 3.49Å; H399-A402 HydrophobicContact CB-CB 4.01Å; H399-A402 VanDerWaalsContact O-CB 3.26Å; H399-A402 WeakPolarHBondContact O-CB 3.48Å; H399-A402 PolarHBondContact O-N 3.39Å; H399-A402 VanDerWaalsContact O-N 3.14Å
400	K	91.2	Very high	95.1	Very high	169 Å²	169	45.5 Å²	45.5	74%	0.735	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	120.7	-174	-70.3	-173.7	178.6	-177.3	0	111.7
401	G	87.7	Confident	95	Very high	32 Å²	32	44.2 Å²	44.2	33%	0.33	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.4	-4.1	-176.1	0	0	0	0	0	114.3	H399	H399-G401 PolarHBondContact O-N 3.49Å
402	A	91.5	Very high	94.8	Very high	6 Å²	6	48.6 Å²	48.6	5%	0.05	23%	0.232	C	C	.	.			trans	-65.7	140	175.7	0	0	0	0	0	112.2	F343 P346 Y398 H399	F343-A402 HydrophobicContact CE2-CB 3.92Å; F343-A402 HydrophobicContact CZ-CB 4.24Å; P346-A402 HydrophobicContact CG-CB 4.24Å; Y398-A402 HydrophobicContact CD1-CB 4.5Å; H399-A402 HydrophobicContact CB-CB 4.01Å; H399-A402 VanDerWaalsContact O-CB 3.26Å; H399-A402 WeakPolarHBondContact O-CB 3.48Å; H399-A402 PolarHBondContact O-N 3.39Å; H399-A402 VanDerWaalsContact O-N 3.14Å
403	K	94.6	Very high	94.7	Very high	30 Å²	30	46.8 Å²	46.8	13%	0.13	23%	0.23	C	C	.	.			trans	-120.1	160	178.9	-58.5	-72.1	-171.4	161.2	0	110.6	E330 E334 P346 W405 R446 L447	E330-K403 IonicContact OE2-NZ 2.69Å; E330-K403 PolarHBondContact OE2-NZ 2.88Å; E334-K403 HydrophobicContact CG-CB 4.43Å; E334-K403 HydrophobicContact CG-CG 3.94Å; E334-K403 WeakPolarHBondContact OE1-CB 3.44Å; P346-K403 WeakPolarHBondContact CD-O 3.33Å; P346-K403 WeakPolarHBondContact CG-O 3.5Å; K403-W405 PolarHBondContact O-N 3.02Å; K403-R446 PolarHBondContact NZ-O 3.01Å; K403-L447 WeakPolarHBondContact CB-O 3.37Å
404	I	95.9	Very high	94.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-74.6	123.9	-175.2	-53	171.2	0	0	0	110.4	V348 I391 L395 K406 M407 L444 L447 M448 S449 N456	V348-I404 HydrophobicContact CB-CD1 4.13Å; V348-I404 HydrophobicContact CB-CG1 4.29Å; V348-I404 HydrophobicContact CB-CG2 4.33Å; V348-I404 HydrophobicContact CG2-CD1 3.93Å; V348-I404 HydrophobicContact CG2-CG1 3.74Å; V348-I404 HydrophobicContact CG2-CG2 4.46Å; I391-I404 HydrophobicContact CG2-CD1 3.79Å; L395-I404 HydrophobicContact CD1-CD1 4.25Å; L395-I404 HydrophobicContact CD1-CG1 3.81Å; L395-I404 HydrophobicContact CD2-CG1 4.17Å; I404-K406 WeakPolarHBondContact CG2-O 3.39Å; I404-M407 HydrophobicContact CG2-CB 4.11Å; I404-L444 HydrophobicContact CD1-CD1 4.34Å; I404-L447 HydrophobicContact CD1-CB 4.18Å; I404-L447 WeakPolarHBondContact CG1-O 3.46Å; I404-L447 PolarHBondContact N-O 3.25Å; I404-M448 HydrophobicContact CB-CE 4.21Å; I404-M448 HydrophobicContact CB-SD 3.83Å; I404-M448 HydrophobicContact CD1-CE 3.88Å; I404-M448 HydrophobicContact CG2-CE 4.13Å; I404-M448 HydrophobicContact CG2-SD 3.89Å; I404-M448 WeakPolarHBondContact O-CA 3.31Å; I404-S449 PolarHBondContact O-N 3.43Å; I404-N456 PolarHBondContact O-OD1 3Å
405	W	94.8	Very high	94.3	Very high	56 Å²	56	41.2 Å²	41.2	21%	0.212	22%	0.218	C	C	.	.	S	Bend	trans	-95.1	-37	171.9	-75.2	44.6	0	0	0	112	P345 P346 K403 S449 V451 N452 N456 V457	P345-W405 HydrophobicContact CB-CB 4.06Å; P345-W405 HydrophobicContact CB-CD2 3.44Å; P345-W405 VanDerWaalsContact CB-CD2 3.44Å; P345-W405 HydrophobicContact CB-CE3 3.87Å; P345-W405 HydrophobicContact CB-CG 3.53Å; P345-W405 HydrophobicContact CB-CZ2 4.34Å; P345-W405 HydrophobicContact CB-CZ3 4.47Å; P345-W405 HydrophobicContact CG-CD2 3.82Å; P345-W405 HydrophobicContact CG-CE3 3.89Å; P345-W405 HydrophobicContact CG-CG 4.43Å; P345-W405 HydrophobicContact CG-CH2 4.02Å; P345-W405 HydrophobicContact CG-CZ2 3.96Å; P345-W405 HydrophobicContact CG-CZ3 3.99Å; P346-W405 PolarHBondContact O-N 2.8Å; K403-W405 PolarHBondContact O-N 3.02Å; W405-S449 VanDerWaalsContact CD1-CB 3.42Å; W405-S449 PolarHBondContact NE1-OG 3.18Å; W405-V451 HydrophobicContact CZ2-CG2 4.09Å; W405-N452 HydrophobicContact CD2-CB 3.81Å; W405-N452 HydrophobicContact CE3-CB 3.98Å; W405-N452 HydrophobicContact CG-CB 4.3Å; W405-N452 HydrophobicContact CH2-CB 4.46Å; W405-N452 HydrophobicContact CZ2-CB 4.3Å; W405-N452 HydrophobicContact CZ3-CB 4.3Å; W405-N456 WeakPolarHBondContact O-CA 3.3Å; W405-V457 PolarHBondContact O-N 2.94Å
406	K	96.4	Very high	94.2	Very high	67 Å²	67	41.3 Å²	41.3	29%	0.291	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	138.4	175.1	-56.9	-170.9	-179.6	-171.7	0	110.1	K347 V348 I404 V457	K347-K406 CarbonylContact C-O 3.48Å; K347-K406 VanDerWaalsContact CA-O 3.25Å; K347-K406 WeakPolarHBondContact CA-O 3.07Å; V348-K406 PolarHBondContact N-O 2.88Å; V348-K406 VanDerWaalsContact N-O 3.16Å; I404-K406 WeakPolarHBondContact CG2-O 3.39Å; K406-V457 CarbonylContact C-O 3.6Å; K406-V457 VanDerWaalsContact CA-O 3.32Å; K406-V457 WeakPolarHBondContact CA-O 3.35Å; K406-V457 HydrophobicContact CG-CB 4.39Å
407	M	97.6	Very high	94.2	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	144.9	177.7	-162.5	-175.7	-173.3	0	0	110.3	V348 L350 I391 I404 I409 L444 M448 V457 I458 H459 Y506	V348-M407 HydrophobicContact CB-CG 4.43Å; V348-M407 HydrophobicContact CG1-CE 4.37Å; V348-M407 CarbonylContact O-C 3.59Å; V348-M407 VanDerWaalsContact O-CA 3.23Å; V348-M407 WeakPolarHBondContact O-CA 3.48Å; V348-M407 WeakPolarHBondContact O-CG 3.22Å; L350-M407 HydrophobicContact CB-CE 3.87Å; L350-M407 HydrophobicContact CD2-CE 3.87Å; L350-M407 HydrophobicContact CG-CE 4.49Å; I391-M407 HydrophobicContact CD1-CE 3.99Å; I404-M407 HydrophobicContact CG2-CB 4.11Å; M407-I409 HydrophobicContact CE-CD1 4.37Å; M407-I409 HydrophobicContact CE-CG1 4.07Å; M407-I409 HydrophobicContact CG-CG1 4.4Å; M407-I409 HydrophobicContact SD-CD1 4.17Å; M407-I409 HydrophobicContact SD-CG1 4.05Å; M407-L444 HydrophobicContact CE-CD1 4.12Å; M407-L444 HydrophobicContact CE-CD2 4.25Å; M407-L444 HydrophobicContact SD-CD1 4.21Å; M407-L444 HydrophobicContact SD-CD2 4.02Å; M407-M448 HydrophobicContact CB-CE 4.37Å; M407-M448 HydrophobicContact SD-CE 3.88Å; M407-V457 PolarHBondContact N-O 3Å; M407-I458 HydrophobicContact CB-CB 4.44Å; M407-I458 HydrophobicContact CB-CG1 4.04Å; M407-I458 HydrophobicContact CB-CG2 4.28Å; M407-I458 HydrophobicContact SD-CD1 4.4Å; M407-I458 HydrophobicContact SD-CG2 4.43Å; M407-H459 PolarHBondContact O-N 3.43Å; M407-Y506 VanDerWaalsContact C-OH 3.32Å; M407-Y506 PolarHBondContact O-OH 2.97Å
408	L	97.6	Very high	94.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	120.3	166.6	175.2	60.6	0	0	0	109.2	V348 M349 L350 H459 M461 Y506 F507	V348-L408 PolarHBondContact O-N 3.04Å; M349-L408 CarbonylContact C-O 3.59Å; M349-L408 WeakPolarHBondContact CA-O 3.35Å; M349-L408 HydrophobicContact CB-CB 4.46Å; M349-L408 HydrophobicContact CE-CD2 3.98Å; M349-L408 HydrophobicContact CG-CB 4.21Å; M349-L408 HydrophobicContact CG-CD2 4.05Å; M349-L408 HydrophobicContact CG-CG 4.29Å; M349-L408 HydrophobicContact SD-CD2 3.93Å; L350-L408 PolarHBondContact N-O 3.08Å; L408-H459 WeakPolarHBondContact CA-O 3.21Å; L408-H459 HydrophobicContact CD1-CB 3.79Å; L408-M461 HydrophobicContact CD1-CB 3.75Å; L408-M461 HydrophobicContact CD1-SD 4.37Å; L408-M461 HydrophobicContact CD2-SD 4.47Å; L408-Y506 HydrophobicContact CB-CD1 3.96Å; L408-Y506 HydrophobicContact CB-CD2 4.18Å; L408-Y506 HydrophobicContact CB-CE1 3.66Å; L408-Y506 HydrophobicContact CB-CE2 3.93Å; L408-Y506 HydrophobicContact CB-CG 4.21Å; L408-Y506 HydrophobicContact CD2-CD1 4.19Å; L408-Y506 HydrophobicContact CD2-CD2 3.8Å; L408-Y506 HydrophobicContact CD2-CE2 4.35Å; L408-Y506 HydrophobicContact CD2-CG 3.73Å; L408-Y506 HydrophobicContact CG-CD2 4.47Å; L408-F507 HydrophobicContact CD2-CE2 3.83Å; L408-F507 HydrophobicContact CD2-CZ 3.92Å
409	I	97.5	Very high	94.2	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	108.7	170.8	-58.2	177.7	0	0	0	107.7	M407 C411 L420 W441 I458 H459 I460 M461	M407-I409 HydrophobicContact CE-CD1 4.37Å; M407-I409 HydrophobicContact CE-CG1 4.07Å; M407-I409 HydrophobicContact CG-CG1 4.4Å; M407-I409 HydrophobicContact SD-CD1 4.17Å; M407-I409 HydrophobicContact SD-CG1 4.05Å; I409-C411 HydrophobicContact CG2-CB 4.4Å; I409-L420 HydrophobicContact CG2-CD2 4.05Å; I409-W441 HydrophobicContact CD1-CH2 3.8Å; I409-W441 HydrophobicContact CD1-CZ3 4.26Å; I409-I458 HydrophobicContact CD1-CG2 3.76Å; I409-I458 HydrophobicContact CG1-CG2 4.08Å; I409-H459 PolarHBondContact N-O 2.94Å; I409-I460 HydrophobicContact CB-CG2 4.32Å; I409-I460 HydrophobicContact CG2-CG2 4.47Å; I409-I460 WeakPolarHBondContact O-CA 3.4Å; I409-M461 PolarHBondContact O-N 2.95Å
410	F	96.2	Very high	94.3	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.018	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	101.4	176.3	-161.3	169.9	0	0	0	109	M349 L350 S352 V355 I361 M461 F507 Y512 W515	M349-F410 HydrophobicContact CE-CD1 4.12Å; L350-F410 PolarHBondContact O-N 3.46Å; S352-F410 WeakPolarHBondContact CB-O 3.42Å; S352-F410 PolarHBondContact N-O 3.03Å; V355-F410 HydrophobicContact CB-CE2 4.47Å; V355-F410 HydrophobicContact CG1-CD1 4.43Å; V355-F410 HydrophobicContact CG1-CD2 4.08Å; V355-F410 HydrophobicContact CG1-CE1 4.03Å; V355-F410 HydrophobicContact CG1-CE2 3.62Å; V355-F410 HydrophobicContact CG1-CG 4.47Å; V355-F410 HydrophobicContact CG1-CZ 3.61Å; V355-F410 HydrophobicContact CG2-CB 4.44Å; V355-F410 HydrophobicContact CG2-CD2 3.54Å; V355-F410 HydrophobicContact CG2-CE2 3.9Å; V355-F410 HydrophobicContact CG2-CG 3.94Å; V355-F410 WeakPolarHBondContact CG2-O 3.5Å; I361-F410 HydrophobicContact CD1-CD1 4.03Å; I361-F410 HydrophobicContact CD1-CE1 3.9Å; F410-M461 HydrophobicContact CD1-SD 4.32Å; F410-M461 HydrophobicContact CD2-CB 4.27Å; F410-M461 HydrophobicContact CD2-CG 4.33Å; F410-M461 HydrophobicContact CE1-SD 4.26Å; F410-M461 HydrophobicContact CE2-CG 4.34Å; F410-M461 HydrophobicContact CG-CB 4.41Å; F410-M461 HydrophobicContact CZ-SD 4.47Å; F410-F507 HydrophobicContact CD1-CZ 4.33Å; F410-F507 HydrophobicContact CE1-CZ 4.43Å; F410-Y512 HydrophobicContact CE1-CE2 4.27Å; F410-W515 AromaticContact CE1-CH2 3.83Å; F410-W515 HydrophobicContact CE1-CH2 3.83Å; F410-W515 HydrophobicContact CE1-CZ3 4.1Å; F410-W515 AromaticContact CZ-CH2 3.63Å; F410-W515 HydrophobicContact CZ-CH2 3.63Å; F410-W515 AromaticContact CZ-CZ3 3.95Å; F410-W515 HydrophobicContact CZ-CZ3 3.95Å
411	C	95.4	Very high	94.5	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.007	14%	0.138	C	C	.	.			trans	-144.5	169.8	-177.1	64.6	0	0	0	0	112.3	I409 M461	I409-C411 HydrophobicContact CG2-CB 4.4Å; C411-M461 PolarHBondContact N-O 3.02Å; C411-M461 VanDerWaalsContact N-O 3.15Å; C411-M461 VanDerWaalsContact O-O 3.12Å
412	Q	93.5	Very high	94.7	Very high	92 Å²	92	28.4 Å²	28.4	43%	0.43	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	156.3	171	-67.2	-163	5.9	0	0	111	K354 Y419	K354-Q412 HydrophobicContact CB-CG 3.95Å; K354-Q412 PolarHBondContact O-NE2 3.09Å; Q412-Y419 HydrophobicContact CB-CD2 4.27Å; Q412-Y419 WeakPolarHBondContact O-CB 3.43Å; Q412-Y419 PolarHBondContact O-N 3Å
413	G	93.5	Very high	94.6	Very high	25 Å²	25	34.8 Å²	34.8	26%	0.258	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	175.1	-166.5	-178.9	0	0	0	0	0	111.5	H417 C463	G413-H417 WeakPolarHBondContact CA-O 3.42Å; G413-C463 WeakPolarHBondContact O-CB 3.41Å
414	G	92.9	Very high	94.4	Very high	8 Å²	8	35.7 Å²	35.7	8%	0.082	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	-170	176.7	0	0	0	0	0	111.9	G416 H417	G414-G416 PolarHBondContact O-N 3.09Å; G414-H417 VanDerWaalsContact C-CE1 3.47Å; G414-H417 VanDerWaalsContact CA-CE1 3.44Å; G414-H417 WeakPolarHBondContact CA-CE1 3.28Å; G414-H417 PolarHBondContact N-NE2 3.29Å; G414-H417 PolarHBondContact N-O 2.89Å; G414-H417 PolarHBondContact O-N 3.48Å
415	P	93.1	Very high	94.3	Very high	63 Å²	63	37.3 Å²	37.3	41%	0.409	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	114.5	-175.9	-27.3	36	0	0	0	112.2	H417 Y464 N468	P415-H417 PolarHBondContact O-ND1 3.28Å; P415-Y464 WeakPolarHBondContact CA-O 3.3Å; P415-N468 HydrophobicContact CB-CB 3.68Å
416	G	93.5	Very high	94.3	Very high	6 Å²	6	34.7 Å²	34.7	6%	0.062	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	14.1	-177.9	0	0	0	0	0	117.7	G414 I465	G414-G416 PolarHBondContact O-N 3.09Å; G416-I465 PolarHBondContact N-O 2.96Å
417	H	94.3	Very high	94.2	Very high	47 Å²	47	33 Å²	33	22%	0.218	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	153	-178.6	63	-80.1	0	0	0	114.9	G413 G414 P415 Y419 V425 A426 T427	G413-H417 WeakPolarHBondContact CA-O 3.42Å; G414-H417 VanDerWaalsContact C-CE1 3.47Å; G414-H417 VanDerWaalsContact CA-CE1 3.44Å; G414-H417 WeakPolarHBondContact CA-CE1 3.28Å; G414-H417 PolarHBondContact N-NE2 3.29Å; G414-H417 PolarHBondContact N-O 2.89Å; G414-H417 PolarHBondContact O-N 3.48Å; P415-H417 PolarHBondContact O-ND1 3.28Å; H417-Y419 AromaticContact CD2-CE2 3.67Å; H417-Y419 AromaticContact CD2-CZ 3.75Å; H417-Y419 AromaticContact NE2-CE2 3.83Å; H417-V425 HydrophobicContact CB-CG1 4.33Å; H417-A426 CarbonylContact C-O 3.49Å; H417-A426 WeakPolarHBondContact CA-O 3.43Å; H417-T427 HydrophobicContact CB-CG2 3.73Å
418	L	95.6	Very high	94	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	143.8	179.4	-73.1	178.4	0	0	0	112.5	V425 A426 I460 C463 I465 L474	L418-V425 CarbonylContact O-C 3.55Å; L418-V425 WeakPolarHBondContact O-CA 3.43Å; L418-A426 HydrophobicContact CB-CB 4.26Å; L418-A426 PolarHBondContact N-O 3.4Å; L418-A426 PolarHBondContact O-N 3.04Å; L418-I460 HydrophobicContact CD1-CD1 3.78Å; L418-I460 HydrophobicContact CD1-CG2 4.12Å; L418-I460 HydrophobicContact CD2-CG2 3.99Å; L418-C463 WeakPolarHBondContact CD2-SG 3.48Å; L418-I465 HydrophobicContact CD1-CD1 4.13Å; L418-I465 HydrophobicContact CD2-CD1 3.59Å; L418-I465 HydrophobicContact CD2-CG1 3.79Å; L418-I465 HydrophobicContact CG-CD1 4.06Å; L418-I465 HydrophobicContact CG-CG1 4.34Å; L418-L474 HydrophobicContact CG-CD2 4.5Å
419	Y	94.3	Very high	93.7	Very high	87 Å²	87	38.3 Å²	38.3	34%	0.341	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	83.7	171.7	-61.1	-70.1	0	0	0	108.9	Q412 H417 V425	Q412-Y419 HydrophobicContact CB-CD2 4.27Å; Q412-Y419 WeakPolarHBondContact O-CB 3.43Å; Q412-Y419 PolarHBondContact O-N 3Å; H417-Y419 AromaticContact CD2-CE2 3.67Å; H417-Y419 AromaticContact CD2-CZ 3.75Å; H417-Y419 AromaticContact NE2-CE2 3.83Å; Y419-V425 HydrophobicContact CD1-CB 4.37Å; Y419-V425 HydrophobicContact CD1-CG1 3.95Å; Y419-V425 HydrophobicContact CD1-CG2 3.82Å; Y419-V425 HydrophobicContact CE1-CB 4.28Å; Y419-V425 HydrophobicContact CE1-CG1 3.67Å; Y419-V425 HydrophobicContact CE1-CG2 3.65Å
420	L	93.1	Very high	93.6	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	-69.5	172.6	-63.4	175.9	0	0	0	109	Y377 H379 F384 I409 A426 F440 W441	Y377-L420 VanDerWaalsContact CE2-O 3.28Å; Y377-L420 WeakPolarHBondContact CE2-O 3.13Å; Y377-L420 PolarHBondContact OH-O 2.98Å; H379-L420 PolarHBondContact ND1-O 2.93Å; F384-L420 HydrophobicContact CE1-CB 4.21Å; F384-L420 HydrophobicContact CE1-CD1 4.04Å; F384-L420 HydrophobicContact CZ-CD1 4.46Å; I409-L420 HydrophobicContact CG2-CD2 4.05Å; L420-A426 HydrophobicContact CD1-CB 4.33Å; L420-F440 HydrophobicContact CD1-CE1 4.29Å; L420-W441 HydrophobicContact CD1-CZ2 3.94Å
421	L	95.1	Very high	93.5	Very high	8 Å²	8	41.5 Å²	41.5	4%	0.042	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	159.9	176.7	-62.6	171.4	0	0	0	111	Y377 A382 T383 F384 I387 N423 K424	Y377-L421 HydrophobicContact CD2-CD2 3.9Å; Y377-L421 HydrophobicContact CE2-CD2 3.84Å; A382-L421 HydrophobicContact CB-CD2 4.18Å; A382-L421 WeakPolarHBondContact O-CD1 3.24Å; A382-L421 WeakPolarHBondContact O-CD2 3.44Å; T383-L421 VanDerWaalsContact C-CD1 3.46Å; F384-L421 HydrophobicContact CD1-CD1 3.63Å; F384-L421 HydrophobicContact CD1-CG 4.45Å; F384-L421 HydrophobicContact CD2-CD1 4.39Å; F384-L421 HydrophobicContact CE1-CD1 3.77Å; F384-L421 HydrophobicContact CE1-CG 4.22Å; F384-L421 HydrophobicContact CG-CD1 3.96Å; F384-L421 HydrophobicContact CZ-CD1 4.23Å; I387-L421 HydrophobicContact CD1-CD1 4.48Å; I387-L421 HydrophobicContact CD1-CD2 4Å; I387-L421 HydrophobicContact CD1-CG 4.44Å; L421-N423 PolarHBondContact O-N 2.93Å; L421-K424 HydrophobicContact CB-CB 4.1Å; L421-K424 HydrophobicContact CB-CG 4.33Å; L421-K424 CarbonylContact O-C 3.5Å; L421-K424 PolarHBondContact O-N 3.25Å
422	K	92.4	Very high	93.4	Very high	92 Å²	92	45.8 Å²	45.8	40%	0.4	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	134.1	173.9	-178	173.6	176.9	179.5	0	109.6	H379 E380 K424	H379-K422 PolarHBondContact CE1-N 2.98Å; H379-K422 PolarHBondContact NE2-N 3.46Å; H379-K422 VanDerWaalsContact O-CB 3.26Å; H379-K422 WeakPolarHBondContact O-CB 3.18Å; H379-K422 PolarHBondContact O-N 3.18Å; E380-K422 HydrophobicContact CB-CD 3.79Å; E380-K422 HydrophobicContact CG-CD 3.9Å; E380-K422 WeakPolarHBondContact OE2-CE 2.95Å; E380-K422 IonicContact OE2-NZ 2.98Å; E380-K422 PolarHBondContact OE2-NZ 2.93Å; K422-K424 PolarHBondContact O-N 2.59Å
423	N	88.9	Confident	93.4	Very high	139 Å²	139	49 Å²	49	74%	0.743	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	-21.9	-171.8	-51.6	-36.1	0	0	0	116.5	L421 V425	L421-N423 PolarHBondContact O-N 2.93Å; N423-V425 PolarHBondContact O-N 2.89Å; N423-V425 VanDerWaalsContact O-N 3.15Å
424	K	91.1	Very high	93.5	Very high	49 Å²	49	49.8 Å²	49.8	21%	0.213	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	69.6	178.2	-60.6	-61.6	-167.6	178.2	0	112.2	F384 L421 K422 A426 D436 M437	F384-K424 HydrophobicContact CE2-CB 4.1Å; F384-K424 HydrophobicContact CE2-CD 4.15Å; F384-K424 HydrophobicContact CE2-CG 3.87Å; F384-K424 HydrophobicContact CZ-CB 3.84Å; F384-K424 HydrophobicContact CZ-CG 4.11Å; L421-K424 HydrophobicContact CB-CB 4.1Å; L421-K424 HydrophobicContact CB-CG 4.33Å; L421-K424 CarbonylContact O-C 3.5Å; L421-K424 PolarHBondContact O-N 3.25Å; K422-K424 PolarHBondContact O-N 2.59Å; K424-A426 PolarHBondContact O-N 3.21Å; K424-D436 WeakPolarHBondContact CE-OD2 3.29Å; K424-D436 IonicContact NZ-OD1 2.97Å; K424-D436 IonicContact NZ-OD2 3.32Å; K424-D436 PolarHBondContact NZ-OD2 2.89Å; K424-M437 VanDerWaalsContact C-CE 3.47Å; K424-M437 HydrophobicContact CB-CE 3.89Å; K424-M437 HydrophobicContact CD-CE 4.36Å
425	V	92.9	Very high	93.5	Very high	35 Å²	35	57 Å²	57	21%	0.212	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	100.4	177.8	-167.6	0	0	0	0	110.6	H417 L418 Y419 N423 T427 K430	H417-V425 HydrophobicContact CB-CG1 4.33Å; L418-V425 CarbonylContact O-C 3.55Å; L418-V425 WeakPolarHBondContact O-CA 3.43Å; Y419-V425 HydrophobicContact CD1-CB 4.37Å; Y419-V425 HydrophobicContact CD1-CG1 3.95Å; Y419-V425 HydrophobicContact CD1-CG2 3.82Å; Y419-V425 HydrophobicContact CE1-CB 4.28Å; Y419-V425 HydrophobicContact CE1-CG1 3.67Å; Y419-V425 HydrophobicContact CE1-CG2 3.65Å; N423-V425 PolarHBondContact O-N 2.89Å; N423-V425 VanDerWaalsContact O-N 3.15Å; V425-T427 HydrophobicContact CG1-CG2 4.08Å; V425-T427 PolarHBondContact O-N 2.9Å; V425-K430 WeakPolarHBondContact O-CD 3.45Å
426	A	94.5	Very high	93.6	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.008	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	122.3	178.3	0	0	0	0	0	110.5	H417 L418 L420 K424 M437	H417-A426 CarbonylContact C-O 3.49Å; H417-A426 WeakPolarHBondContact CA-O 3.43Å; L418-A426 HydrophobicContact CB-CB 4.26Å; L418-A426 PolarHBondContact N-O 3.4Å; L418-A426 PolarHBondContact O-N 3.04Å; L420-A426 HydrophobicContact CD1-CB 4.33Å; K424-A426 PolarHBondContact O-N 3.21Å; A426-M437 HydrophobicContact CB-CE 4.46Å; A426-M437 HydrophobicContact CB-SD 4.2Å
427	T	95.2	Very high	93.6	Very high	30 Å²	30	57.6 Å²	57.6	18%	0.184	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	157.7	177.4	72.4	0	0	0	0	108.7	H417 V425 A429 K430 V431	H417-T427 HydrophobicContact CB-CG2 3.73Å; V425-T427 HydrophobicContact CG1-CG2 4.08Å; V425-T427 PolarHBondContact O-N 2.9Å; T427-A429 PolarHBondContact O-N 3.27Å; T427-K430 HydrophobicContact CG2-CD 4.41Å; T427-K430 PolarHBondContact O-N 3.28Å; T427-K430 WeakPolarHBondContact OG1-CG 3.16Å; T427-K430 PolarHBondContact OG1-N 3.36Å; T427-V431 PolarHBondContact O-N 2.93Å
428	F	93.1	Very high	93.6	Very high	67 Å²	67	57.4 Å²	57.4	29%	0.294	28%	0.279	S	S	.	.	H	α-helix	trans	-51.5	-35.3	-179.7	79.1	-84.9	0	0	0	112.9	N470 K473 L474 N477	F428-N470 HydrophobicContact CD1-CB 3.91Å; F428-N470 HydrophobicContact CE1-CB 4.03Å; F428-K473 HydrophobicContact CB-CB 3.94Å; F428-K473 HydrophobicContact CG-CB 4.25Å; F428-L474 HydrophobicContact CB-CB 4.25Å; F428-N477 PolarHBondContact O-ND2 3.47Å
429	A	92.6	Very high	93.6	Very high	46 Å²	46	62.3 Å²	62.3	38%	0.38	30%	0.302	S	S	.	.	H	α-helix	trans	-84.9	-9.7	-178.3	0	0	0	0	0	115	T427 K433	T427-A429 PolarHBondContact O-N 3.27Å; A429-K433 WeakPolarHBondContact O-CD 3.42Å
430	K	94.3	Very high	93.7	Very high	72 Å²	72	58.2 Å²	58.2	31%	0.313	29%	0.286	S	S	.	.	H	α-helix	trans	-107.5	-37	179.7	-76.1	178.7	154.9	-94	0	112.7	V425 T427 E432 K433 E434 M437	V425-K430 WeakPolarHBondContact O-CD 3.45Å; T427-K430 HydrophobicContact CG2-CD 4.41Å; T427-K430 PolarHBondContact O-N 3.28Å; T427-K430 WeakPolarHBondContact OG1-CG 3.16Å; T427-K430 PolarHBondContact OG1-N 3.36Å; K430-E432 PolarHBondContact O-N 3.41Å; K430-K433 PolarHBondContact O-N 3.47Å; K430-E434 WeakPolarHBondContact CB-OE1 3.4Å; K430-E434 WeakPolarHBondContact CD-OE1 3.33Å; K430-E434 WeakPolarHBondContact CE-OE1 3.39Å; K430-E434 WeakPolarHBondContact CG-OE1 3.37Å; K430-E434 IonicContact NZ-OE1 3.61Å; K430-E434 PolarHBondContact NZ-OE1 3.01Å; K430-E434 IonicContact NZ-OE2 2.81Å; K430-E434 PolarHBondContact O-N 3.45Å; K430-M437 HydrophobicContact CB-SD 4.34Å
431	V	94.6	Very high	93.9	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.2	-25.2	-171.2	77.4	0	0	0	0	113.6	T427 M437 I438 L474 N477 L478 L481	T427-V431 PolarHBondContact O-N 2.93Å; V431-M437 HydrophobicContact CG2-CB 4.49Å; V431-I438 VanDerWaalsContact O-CG1 3.31Å; V431-I438 WeakPolarHBondContact O-CG1 3.08Å; V431-L474 HydrophobicContact CB-CD1 4.32Å; V431-L474 HydrophobicContact CG1-CD1 4.05Å; V431-N477 HydrophobicContact CG1-CB 3.88Å; V431-L478 HydrophobicContact CG2-CD2 3.72Å; V431-L478 HydrophobicContact CG2-CG 4.44Å; V431-L481 HydrophobicContact CB-CD1 4.47Å; V431-L481 HydrophobicContact CG1-CD1 4.22Å; V431-L481 HydrophobicContact CG2-CD1 3.84Å; V431-L481 WeakPolarHBondContact O-CD1 3.33Å
432	E	92.7	Very high	93.8	Very high	91 Å²	91	63.5 Å²	63.5	43%	0.425	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	14.5	174.2	-58.6	176.6	144.8	0	0	113	K430 N477 L481	K430-E432 PolarHBondContact O-N 3.41Å; E432-N477 HydrophobicContact CG-CB 3.96Å; E432-N477 WeakPolarHBondContact OE1-CB 3.49Å; E432-N477 PolarHBondContact OE1-ND2 2.88Å; E432-N477 PolarHBondContact OE2-ND2 3.24Å; E432-L481 HydrophobicContact CG-CD1 4.44Å
433	K	93.4	Very high	94	Very high	160 Å²	160	63.1 Å²	63.1	70%	0.696	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.1	-27.8	-174.2	-59.1	-164.3	-173.6	-170.9	0	115.7	A429 K430	A429-K433 WeakPolarHBondContact O-CD 3.42Å; K430-K433 PolarHBondContact O-N 3.47Å
434	E	95.2	Very high	94.3	Very high	40 Å²	40	56.5 Å²	56.5	19%	0.187	27%	0.269	C	S	.	.			trans	-89.3	112.1	174.6	-75.7	173.1	-136.3	0	0	108.5	K430 D436 M437 I438	K430-E434 WeakPolarHBondContact CB-OE1 3.4Å; K430-E434 WeakPolarHBondContact CD-OE1 3.33Å; K430-E434 WeakPolarHBondContact CE-OE1 3.39Å; K430-E434 WeakPolarHBondContact CG-OE1 3.37Å; K430-E434 IonicContact NZ-OE1 3.61Å; K430-E434 PolarHBondContact NZ-OE1 3.01Å; K430-E434 IonicContact NZ-OE2 2.81Å; K430-E434 PolarHBondContact O-N 3.45Å; E434-D436 VanDerWaalsContact C-N 3.28Å; E434-D436 PolarHBondContact O-N 3.28Å; E434-M437 HydrophobicContact CB-CB 4.29Å; E434-M437 HydrophobicContact CB-CG 4.02Å; E434-M437 HydrophobicContact CB-SD 4.25Å; E434-M437 WeakPolarHBondContact O-CA 3.36Å; E434-M437 WeakPolarHBondContact O-CB 3.39Å; E434-M437 PolarHBondContact O-N 3.45Å; E434-M437 WeakPolarHBondContact OE2-CE 3.46Å; E434-I438 PolarHBondContact O-N 2.83Å
435	E	94.5	Very high	94.4	Very high	159 Å²	159	54.3 Å²	54.3	74%	0.743	26%	0.26	S	S	*	.	H	α-helix	trans	-54.8	-42.8	-173.5	-67.5	174.7	-179.7	0	0	111.9	M437 I438 H439	E435-M437 VanDerWaalsContact C-N 3.26Å; E435-M437 PolarHBondContact O-N 2.87Å; E435-I438 PolarHBondContact O-N 3.41Å; E435-I438 VanDerWaalsContact O-N 3.12Å; E435-H439 WeakPolarHBondContact O-CB 3.46Å; E435-H439 PolarHBondContact O-N 3.23Å
436	D	93.5	Very high	94.4	Very high	82 Å²	82	55.7 Å²	55.7	44%	0.439	26%	0.262	S	S	.	.	H	α-helix	trans	-57.9	-35.7	175.3	-38.1	33.4	0	0	0	112.5	F384 K424 E434 F440	F384-D436 HydrophobicContact CD2-CB 3.99Å; F384-D436 HydrophobicContact CE2-CB 4.21Å; K424-D436 WeakPolarHBondContact CE-OD2 3.29Å; K424-D436 IonicContact NZ-OD1 2.97Å; K424-D436 IonicContact NZ-OD2 3.32Å; K424-D436 PolarHBondContact NZ-OD2 2.89Å; E434-D436 VanDerWaalsContact C-N 3.28Å; E434-D436 PolarHBondContact O-N 3.28Å; D436-F440 VanDerWaalsContact O-CB 3.3Å; D436-F440 WeakPolarHBondContact O-CB 3.34Å; D436-F440 PolarHBondContact O-N 2.88Å
437	M	94.8	Very high	94.4	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-74.5	-42.4	176.3	-65.8	-172	-177.9	0	0	110.9	F384 K424 A426 K430 V431 E434 E435 H439 F440 W441	F384-M437 HydrophobicContact CE2-CG 4.15Å; F384-M437 HydrophobicContact CZ-CG 4.27Å; K424-M437 VanDerWaalsContact C-CE 3.47Å; K424-M437 HydrophobicContact CB-CE 3.89Å; K424-M437 HydrophobicContact CD-CE 4.36Å; A426-M437 HydrophobicContact CB-CE 4.46Å; A426-M437 HydrophobicContact CB-SD 4.2Å; K430-M437 HydrophobicContact CB-SD 4.34Å; V431-M437 HydrophobicContact CG2-CB 4.49Å; E434-M437 HydrophobicContact CB-CB 4.29Å; E434-M437 HydrophobicContact CB-CG 4.02Å; E434-M437 HydrophobicContact CB-SD 4.25Å; E434-M437 WeakPolarHBondContact O-CA 3.36Å; E434-M437 WeakPolarHBondContact O-CB 3.39Å; E434-M437 PolarHBondContact O-N 3.45Å; E434-M437 WeakPolarHBondContact OE2-CE 3.46Å; E435-M437 VanDerWaalsContact C-N 3.26Å; E435-M437 PolarHBondContact O-N 2.87Å; M437-H439 VanDerWaalsContact C-N 3.31Å; M437-H439 PolarHBondContact O-N 3.37Å; M437-F440 PolarHBondContact O-N 3.01Å; M437-W441 PolarHBondContact O-N 2.8Å
438	I	94.8	Very high	94.4	Very high	44 Å²	44	54.5 Å²	54.5	23%	0.226	25%	0.254	C	S	.	.	H	α-helix	trans	-60.1	-45.4	176.6	-63.1	167	0	0	0	109.6	V431 E434 E435 K442 L481	V431-I438 VanDerWaalsContact O-CG1 3.31Å; V431-I438 WeakPolarHBondContact O-CG1 3.08Å; E434-I438 PolarHBondContact O-N 2.83Å; E435-I438 PolarHBondContact O-N 3.41Å; E435-I438 VanDerWaalsContact O-N 3.12Å; I438-K442 HydrophobicContact CG2-CD 4.27Å; I438-K442 WeakPolarHBondContact O-CB 3.42Å; I438-K442 WeakPolarHBondContact O-CG 3.31Å; I438-K442 PolarHBondContact O-N 3Å; I438-L481 HydrophobicContact CG1-CD2 4.43Å; I438-L481 HydrophobicContact CG2-CD2 4.19Å
439	H	95.2	Very high	94.4	Very high	102 Å²	102	51.5 Å²	51.5	47%	0.472	24%	0.241	S	C	.	.	H	α-helix	trans	-61.7	-51.1	176.8	-164.3	88.1	0	0	0	111.1	E385 E435 M437 W441 K442 R443	E385-H439 IonicContact OE1-CD2 2.74Å; E435-H439 WeakPolarHBondContact O-CB 3.46Å; E435-H439 PolarHBondContact O-N 3.23Å; M437-H439 VanDerWaalsContact C-N 3.31Å; M437-H439 PolarHBondContact O-N 3.37Å; H439-W441 PolarHBondContact O-N 3.33Å; H439-K442 PolarHBondContact O-N 3.01Å; H439-R443 WeakPolarHBondContact O-CB 3.33Å; H439-R443 PolarHBondContact O-N 3.28Å
440	F	96.4	Very high	94.4	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-53.4	-50.4	178.3	173.9	-104	0	0	0	112.7	F384 I387 L388 L420 D436 M437 R443 L444	F384-F440 HydrophobicContact CB-CB 3.95Å; F384-F440 HydrophobicContact CB-CD2 3.71Å; F384-F440 HydrophobicContact CB-CG 4.1Å; F384-F440 HydrophobicContact CD1-CB 3.92Å; F384-F440 HydrophobicContact CD1-CD1 4.02Å; F384-F440 AromaticContact CD1-CD2 3.47Å; F384-F440 HydrophobicContact CD1-CD2 3.47Å; F384-F440 VanDerWaalsContact CD1-CD2 3.47Å; F384-F440 HydrophobicContact CD1-CE1 4.45Å; F384-F440 AromaticContact CD1-CE2 3.94Å; F384-F440 HydrophobicContact CD1-CE2 3.94Å; F384-F440 AromaticContact CD1-CG 3.5Å; F384-F440 HydrophobicContact CD1-CG 3.5Å; F384-F440 HydrophobicContact CD1-CZ 4.41Å; F384-F440 HydrophobicContact CD2-CB 4.16Å; F384-F440 HydrophobicContact CE1-CB 4.47Å; F384-F440 HydrophobicContact CE1-CD1 4.12Å; F384-F440 HydrophobicContact CE1-CD2 4.36Å; F384-F440 HydrophobicContact CE1-CE1 4.5Å; F384-F440 HydrophobicContact CE1-CG 4.04Å; F384-F440 HydrophobicContact CG-CB 3.77Å; F384-F440 AromaticContact CG-CD2 3.85Å; F384-F440 HydrophobicContact CG-CD2 3.85Å; F384-F440 AromaticContact CG-CG 3.86Å; F384-F440 HydrophobicContact CG-CG 3.86Å; I387-F440 HydrophobicContact CB-CE2 4.49Å; I387-F440 HydrophobicContact CG2-CE2 3.97Å; I387-F440 HydrophobicContact CG2-CZ 4.44Å; L388-F440 HydrophobicContact CD1-CD2 3.79Å; L388-F440 HydrophobicContact CD1-CE2 4.45Å; L388-F440 HydrophobicContact CD2-CD2 4.11Å; L388-F440 HydrophobicContact CD2-CE2 4.08Å; L388-F440 HydrophobicContact CG-CD2 3.85Å; L388-F440 HydrophobicContact CG-CE2 4Å; L420-F440 HydrophobicContact CD1-CE1 4.29Å; D436-F440 VanDerWaalsContact O-CB 3.3Å; D436-F440 WeakPolarHBondContact O-CB 3.34Å; D436-F440 PolarHBondContact O-N 2.88Å; M437-F440 PolarHBondContact O-N 3.01Å; F440-R443 PolarHBondContact O-N 2.99Å; F440-L444 HydrophobicContact CE1-CD2 4.11Å; F440-L444 HydrophobicContact CZ-CD2 4.04Å; F440-L444 WeakPolarHBondContact O-CB 3.37Å; F440-L444 PolarHBondContact O-N 3.04Å
441	W	95.9	Very high	94.2	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-70.9	-31.2	-178.5	-69.1	111.6	0	0	0	113.1	I409 L420 M437 H439 L444 S445 I458 L478 L481 M482 F489	I409-W441 HydrophobicContact CD1-CH2 3.8Å; I409-W441 HydrophobicContact CD1-CZ3 4.26Å; L420-W441 HydrophobicContact CD1-CZ2 3.94Å; M437-W441 PolarHBondContact O-N 2.8Å; H439-W441 PolarHBondContact O-N 3.33Å; W441-L444 HydrophobicContact CE3-CD2 3.83Å; W441-L444 HydrophobicContact CZ3-CD2 3.76Å; W441-S445 WeakPolarHBondContact O-CB 3.44Å; W441-S445 PolarHBondContact O-N 3.44Å; W441-S445 VanDerWaalsContact O-N 3.09Å; W441-I458 HydrophobicContact CZ3-CD1 4.36Å; W441-L478 HydrophobicContact CD2-CD2 3.44Å; W441-L478 VanDerWaalsContact CD2-CD2 3.44Å; W441-L478 HydrophobicContact CE3-CD2 3.99Å; W441-L478 HydrophobicContact CG-CD2 3.8Å; W441-L478 HydrophobicContact CH2-CD2 4.08Å; W441-L478 HydrophobicContact CZ2-CD1 4.48Å; W441-L478 HydrophobicContact CZ2-CD2 3.54Å; W441-L478 HydrophobicContact CZ3-CD2 4.29Å; W441-L481 HydrophobicContact CB-CB 4.41Å; W441-M482 HydrophobicContact CB-CG 4.44Å; W441-M482 HydrophobicContact CE3-CE 4.36Å; W441-M482 HydrophobicContact CE3-SD 3.69Å; W441-M482 HydrophobicContact CZ3-SD 4.17Å; W441-F489 HydrophobicContact CE3-CZ 4.3Å; W441-F489 HydrophobicContact CH2-CE1 4.14Å; W441-F489 HydrophobicContact CH2-CZ 4.46Å; W441-F489 AromaticContact CZ3-CE1 3.91Å; W441-F489 HydrophobicContact CZ3-CE1 3.91Å; W441-F489 AromaticContact CZ3-CZ 3.89Å; W441-F489 HydrophobicContact CZ3-CZ 3.89Å
442	K	94.4	Very high	94	Very high	122 Å²	122	49.5 Å²	49.5	53%	0.53	23%	0.228	S	C	.	.	H	α-helix	trans	-72.2	-38.9	172.4	-79.2	-170.7	168.8	-160.4	0	113.4	I438 H439 S445 R446	I438-K442 HydrophobicContact CG2-CD 4.27Å; I438-K442 WeakPolarHBondContact O-CB 3.42Å; I438-K442 WeakPolarHBondContact O-CG 3.31Å; I438-K442 PolarHBondContact O-N 3Å; H439-K442 PolarHBondContact O-N 3.01Å; K442-S445 PolarHBondContact O-N 3.29Å; K442-S445 PolarHBondContact O-OG 2.87Å; K442-R446 PolarHBondContact O-N 3.44Å
443	R	95.1	Very high	93.6	Very high	84 Å²	84	49.9 Å²	49.9	32%	0.317	24%	0.238	S	C	.	.	H	α-helix	trans	-72.7	-38.6	176	-176	63.4	-170.5	-174.4	7.4	110.7	L388 E392 H439 F440 S445 R446	L388-R443 HydrophobicContact CD1-CB 3.79Å; L388-R443 HydrophobicContact CD1-CG 3.77Å; L388-R443 HydrophobicContact CD2-CB 4.25Å; L388-R443 HydrophobicContact CD2-CG 4.11Å; L388-R443 HydrophobicContact CG-CG 4.35Å; E392-R443 IonicContact OE1-NH2 3.27Å; E392-R443 PolarHBondContact OE1-NH2 3.17Å; E392-R443 IonicContact OE2-CZ 2.68Å; E392-R443 IonicContact OE2-NE 3.39Å; E392-R443 IonicContact OE2-NH2 3.8Å; E392-R443 PolarHBondContact OE2-NH2 2.77Å; H439-R443 WeakPolarHBondContact O-CB 3.33Å; H439-R443 PolarHBondContact O-N 3.28Å; F440-R443 PolarHBondContact O-N 2.99Å; R443-S445 VanDerWaalsContact C-N 3.29Å; R443-S445 PolarHBondContact O-N 2.88Å; R443-R446 WeakPolarHBondContact O-CB 3.33Å; R443-R446 PolarHBondContact O-N 3.39Å
444	L	96.1	Very high	93.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.3	-33.6	172.8	-176.1	59.8	0	0	0	112.4	L388 I391 I404 M407 F440 W441 L447 M448 M482	L388-L444 HydrophobicContact CD2-CB 3.91Å; L388-L444 HydrophobicContact CD2-CD1 4.36Å; I391-L444 HydrophobicContact CD1-CD1 4.08Å; I404-L444 HydrophobicContact CD1-CD1 4.34Å; M407-L444 HydrophobicContact CE-CD1 4.12Å; M407-L444 HydrophobicContact CE-CD2 4.25Å; M407-L444 HydrophobicContact SD-CD1 4.21Å; M407-L444 HydrophobicContact SD-CD2 4.02Å; F440-L444 HydrophobicContact CE1-CD2 4.11Å; F440-L444 HydrophobicContact CZ-CD2 4.04Å; F440-L444 WeakPolarHBondContact O-CB 3.37Å; F440-L444 PolarHBondContact O-N 3.04Å; W441-L444 HydrophobicContact CE3-CD2 3.83Å; W441-L444 HydrophobicContact CZ3-CD2 3.76Å; L444-L447 WeakPolarHBondContact O-CB 3.5Å; L444-L447 PolarHBondContact O-N 2.82Å; L444-L447 VanDerWaalsContact O-N 3.15Å; L444-M448 HydrophobicContact CD1-CE 3.93Å; L444-M448 HydrophobicContact CD2-CE 4.43Å; L444-M448 HydrophobicContact CG-CE 3.89Å; L444-M482 HydrophobicContact CB-CE 4.21Å; L444-M482 HydrophobicContact CD2-CE 4.26Å; L444-M482 HydrophobicContact CG-CE 3.96Å
445	S	94	Very high	93.1	Very high	4 Å²	4	47.9 Å²	47.9	3%	0.028	24%	0.235	C	C	.	.	H	α-helix	trans	-68.4	-35.9	177.2	71.2	0	0	0	0	112.3	W441 K442 R443 L447 M448 Y485	W441-S445 WeakPolarHBondContact O-CB 3.44Å; W441-S445 PolarHBondContact O-N 3.44Å; W441-S445 VanDerWaalsContact O-N 3.09Å; K442-S445 PolarHBondContact O-N 3.29Å; K442-S445 PolarHBondContact O-OG 2.87Å; R443-S445 VanDerWaalsContact C-N 3.29Å; R443-S445 PolarHBondContact O-N 2.88Å; S445-L447 PolarHBondContact O-N 2.85Å; S445-M448 WeakPolarHBondContact O-CB 3.48Å; S445-M448 PolarHBondContact O-N 2.89Å; S445-Y485 VanDerWaalsContact CB-CD2 3.43Å; S445-Y485 WeakPolarHBondContact O-CD1 3.44Å; S445-Y485 VanDerWaalsContact O-CE1 3.24Å; S445-Y485 WeakPolarHBondContact O-CE1 3.47Å; S445-Y485 WeakPolarHBondContact OG-CD2 3.42Å; S445-Y485 VanDerWaalsContact OG-CE2 3.31Å; S445-Y485 WeakPolarHBondContact OG-CE2 3.35Å
446	R	92.4	Very high	93.2	Very high	64 Å²	64	40.4 Å²	40.4	24%	0.242	20%	0.2	C	C	.	.	H	α-helix	trans	-56.5	-21.8	169.5	-66.4	-165.2	67.5	129.1	-0.9	114.1	D326 E330 K403 K442 R443 Y485	D326-R446 IonicContact OD2-CZ 2.59Å; D326-R446 IonicContact OD2-NH1 2.75Å; D326-R446 PolarHBondContact OD2-NH1 3.25Å; D326-R446 IonicContact OD2-NH2 3.77Å; D326-R446 PolarHBondContact OD2-NH2 2.9Å; E330-R446 IonicContact OE1-CZ 2.59Å; E330-R446 IonicContact OE1-NE 2.77Å; E330-R446 IonicContact OE1-NH2 3.15Å; E330-R446 PolarHBondContact OE1-NH2 3.41Å; K403-R446 PolarHBondContact NZ-O 3.01Å; K442-R446 PolarHBondContact O-N 3.44Å; R443-R446 WeakPolarHBondContact O-CB 3.33Å; R443-R446 PolarHBondContact O-N 3.39Å; R446-Y485 WeakPolarHBondContact CG-OH 3.45Å
447	L	94.2	Very high	93.3	Very high	6 Å²	6	37 Å²	37	3%	0.031	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-8	177.4	-56.2	177.3	0	0	0	113.2	L388 I391 E392 K403 I404 L444 S445	L388-L447 HydrophobicContact CD2-CD1 4.2Å; I391-L447 HydrophobicContact CB-CD1 4.32Å; I391-L447 HydrophobicContact CG2-CD1 3.79Å; E392-L447 HydrophobicContact CB-CD1 4.49Å; E392-L447 HydrophobicContact CB-CD2 4.25Å; E392-L447 HydrophobicContact CG-CD2 4.17Å; K403-L447 WeakPolarHBondContact CB-O 3.37Å; I404-L447 HydrophobicContact CD1-CB 4.18Å; I404-L447 WeakPolarHBondContact CG1-O 3.46Å; I404-L447 PolarHBondContact N-O 3.25Å; L444-L447 WeakPolarHBondContact O-CB 3.5Å; L444-L447 PolarHBondContact O-N 2.82Å; L444-L447 VanDerWaalsContact O-N 3.15Å; S445-L447 PolarHBondContact O-N 2.85Å
448	M	95.1	Very high	93.4	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-81.8	152.9	173.8	-60.4	-71.9	152.5	0	0	111.4	I404 M407 L444 S445 N456 I458 M482 V487	I404-M448 HydrophobicContact CB-CE 4.21Å; I404-M448 HydrophobicContact CB-SD 3.83Å; I404-M448 HydrophobicContact CD1-CE 3.88Å; I404-M448 HydrophobicContact CG2-CE 4.13Å; I404-M448 HydrophobicContact CG2-SD 3.89Å; I404-M448 WeakPolarHBondContact O-CA 3.31Å; M407-M448 HydrophobicContact CB-CE 4.37Å; M407-M448 HydrophobicContact SD-CE 3.88Å; L444-M448 HydrophobicContact CD1-CE 3.93Å; L444-M448 HydrophobicContact CD2-CE 4.43Å; L444-M448 HydrophobicContact CG-CE 3.89Å; S445-M448 WeakPolarHBondContact O-CB 3.48Å; S445-M448 PolarHBondContact O-N 2.89Å; M448-N456 HydrophobicContact CB-CB 4.4Å; M448-N456 HydrophobicContact SD-CB 4.28Å; M448-I458 HydrophobicContact CE-CD1 3.78Å; M448-I458 HydrophobicContact CE-CG1 4.21Å; M448-I458 HydrophobicContact SD-CD1 4.47Å; M448-M482 HydrophobicContact CE-CE 4.24Å; M448-M482 HydrophobicContact CG-CE 4.08Å; M448-V487 HydrophobicContact CG-CG2 4.16Å
449	S	93.8	Very high	93.5	Very high	4 Å²	4	35.7 Å²	35.7	3%	0.028	18%	0.176	C	C	.	.			trans	-67.4	137.8	-175.4	179.9	0	0	0	0	114.1	E334 I404 W405 V451 N452 N456	E334-S449 WeakPolarHBondContact OE1-CA 3.34Å; E334-S449 WeakPolarHBondContact OE1-CB 3.29Å; E334-S449 PolarHBondContact OE1-OG 3.36Å; I404-S449 PolarHBondContact O-N 3.43Å; W405-S449 VanDerWaalsContact CD1-CB 3.42Å; W405-S449 PolarHBondContact NE1-OG 3.18Å; S449-V451 PolarHBondContact OG-N 2.77Å; S449-N452 WeakPolarHBondContact OG-CB 3.46Å; S449-N452 PolarHBondContact OG-N 2.68Å; S449-N456 WeakPolarHBondContact CB-OD1 3.35Å; S449-N456 PolarHBondContact O-ND2 2.89Å
450	K	92.1	Very high	93.6	Very high	25 Å²	25	30.9 Å²	30.9	11%	0.109	15%	0.153	C	C	.	.	S	Bend	trans	-96.2	-20	169.9	-58.1	-176	-177.9	62.6	0	113	W327 E330 K331 E334	W327-K450 HydrophobicContact CD2-CD 3.81Å; W327-K450 HydrophobicContact CE3-CD 4.06Å; W327-K450 VanDerWaalsContact CE3-CE 3.48Å; W327-K450 HydrophobicContact CG-CD 4.39Å; W327-K450 HydrophobicContact CH2-CD 4.03Å; W327-K450 HydrophobicContact CH2-CG 3.82Å; W327-K450 HydrophobicContact CZ2-CB 4.11Å; W327-K450 HydrophobicContact CZ2-CD 3.78Å; W327-K450 HydrophobicContact CZ2-CG 3.66Å; W327-K450 HydrophobicContact CZ3-CD 4.19Å; W327-K450 HydrophobicContact CZ3-CG 4.37Å; E330-K450 HydrophobicContact CB-CD 4.33Å; E330-K450 IonicContact OE2-NZ 3.58Å; E330-K450 PolarHBondContact OE2-NZ 2.67Å; K331-K450 HydrophobicContact CB-CB 3.87Å; K331-K450 HydrophobicContact CB-CD 3.79Å; K331-K450 HydrophobicContact CD-CB 4.09Å; K331-K450 HydrophobicContact CG-CB 3.8Å; E334-K450 PolarHBondContact OE1-N 3.37Å; E334-K450 WeakPolarHBondContact OE2-CB 3.25Å; E334-K450 PolarHBondContact OE2-N 3.02Å
451	V	91	Very high	93.5	Very high	43 Å²	43	31 Å²	31	26%	0.261	15%	0.154	S	C	.	.	S	Bend	trans	-94.5	-17.5	-178	-51	0	0	0	0	113.6	K331 E334 A335 W405 S449 P453	K331-V451 HydrophobicContact CG-CG1 3.99Å; K331-V451 WeakPolarHBondContact O-CG1 3.5Å; E334-V451 HydrophobicContact CB-CG1 4.07Å; E334-V451 HydrophobicContact CG-CG1 4.05Å; E334-V451 HydrophobicContact CG-CG2 4.07Å; A335-V451 HydrophobicContact CB-CG1 4.05Å; W405-V451 HydrophobicContact CZ2-CG2 4.09Å; S449-V451 PolarHBondContact OG-N 2.77Å; V451-P453 WeakPolarHBondContact O-CD 3.36Å
452	N	88.8	Confident	93.3	Very high	7 Å²	7	32.7 Å²	32.7	4%	0.037	17%	0.171	C	C	.	.			trans	-55.1	120.9	178	-178.6	5.6	0	0	0	111.4	W405 S449 E454 N456 R486	W405-N452 HydrophobicContact CD2-CB 3.81Å; W405-N452 HydrophobicContact CE3-CB 3.98Å; W405-N452 HydrophobicContact CG-CB 4.3Å; W405-N452 HydrophobicContact CH2-CB 4.46Å; W405-N452 HydrophobicContact CZ2-CB 4.3Å; W405-N452 HydrophobicContact CZ3-CB 4.3Å; S449-N452 WeakPolarHBondContact OG-CB 3.46Å; S449-N452 PolarHBondContact OG-N 2.68Å; N452-E454 VanDerWaalsContact C-N 3.32Å; N452-E454 PolarHBondContact ND2-O 2.74Å; N452-E454 PolarHBondContact O-N 2.86Å; N452-E454 PolarHBondContact OD1-N 3.27Å; N452-E454 PolarHBondContact OD1-O 3.46Å; N452-N456 PolarHBondContact ND2-OD1 3.36Å; N452-R486 PolarHBondContact O-NH1 3.45Å
453	P	85.8	Confident	93.1	Very high	99 Å²	99	28 Å²	28	64%	0.643	15%	0.153	S	C	*	.	S	Bend	trans	-68.5	-32.7	178	27.4	-34.5	0	0	0	111.9	V451 R486	V451-P453 WeakPolarHBondContact O-CD 3.36Å; P453-R486 PolarHBondContact O-NH1 2.91Å; P453-R486 VanDerWaalsContact O-NH1 3.12Å; P453-R486 PolarHBondContact O-NH2 2.96Å
454	E	88.7	Confident	92.9	Very high	112 Å²	112	29.6 Å²	29.6	52%	0.523	16%	0.16	S	C	.	.	S	Bend	trans	-79.9	162.9	172.4	-66.7	-165.4	154.6	0	0	111	N452 R486	N452-E454 VanDerWaalsContact C-N 3.32Å; N452-E454 PolarHBondContact ND2-O 2.74Å; N452-E454 PolarHBondContact O-N 2.86Å; N452-E454 PolarHBondContact OD1-N 3.27Å; N452-E454 PolarHBondContact OD1-O 3.46Å; E454-R486 PolarHBondContact O-NH1 3.17Å
455	P	89.4	Confident	92.8	Very high	46 Å²	46	29.6 Å²	29.6	30%	0.299	16%	0.16	S	C	.	.	P	Polyproline II helix	trans	-63	146.9	164.4	27.6	-35.1	0	0	0	111.6	V457 R486 T488	P455-V457 PolarHBondContact O-N 3.06Å; P455-R486 CarbonylContact C-O 3.42Å; P455-R486 WeakPolarHBondContact CA-O 3.37Å; P455-R486 WeakPolarHBondContact CB-O 3.44Å; P455-T488 HydrophobicContact CB-CG2 3.83Å; P455-T488 HydrophobicContact CG-CG2 4.06Å
456	N	94.9	Very high	92.7	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.011	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	124.9	175	-62.6	-54.5	0	0	0	109.9	I404 W405 M448 S449 N452 Y485 R486 V487 T488	I404-N456 PolarHBondContact O-OD1 3Å; W405-N456 WeakPolarHBondContact O-CA 3.3Å; M448-N456 HydrophobicContact CB-CB 4.4Å; M448-N456 HydrophobicContact SD-CB 4.28Å; S449-N456 WeakPolarHBondContact CB-OD1 3.35Å; S449-N456 PolarHBondContact O-ND2 2.89Å; N452-N456 PolarHBondContact ND2-OD1 3.36Å; N456-Y485 PolarHBondContact ND2-O 3.41Å; N456-R486 PolarHBondContact N-O 2.99Å; N456-R486 VanDerWaalsContact N-O 3.12Å; N456-V487 HydrophobicContact CB-CG2 4.46Å; N456-V487 CarbonylContact O-C 3.55Å; N456-V487 VanDerWaalsContact O-CA 3.3Å; N456-V487 WeakPolarHBondContact O-CA 3.35Å; N456-T488 PolarHBondContact O-N 2.97Å
457	V	95.9	Very high	92.5	Very high	12 Å²	12	30.9 Å²	30.9	7%	0.073	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	120	-170.2	-169.6	0	0	0	0	111.5	W405 K406 M407 P455 E490	W405-V457 PolarHBondContact O-N 2.94Å; K406-V457 CarbonylContact C-O 3.6Å; K406-V457 VanDerWaalsContact CA-O 3.32Å; K406-V457 WeakPolarHBondContact CA-O 3.35Å; K406-V457 HydrophobicContact CG-CB 4.39Å; M407-V457 PolarHBondContact N-O 3Å; P455-V457 PolarHBondContact O-N 3.06Å; V457-E490 HydrophobicContact CG1-CB 4.44Å; V457-E490 HydrophobicContact CG1-CG 4.13Å
458	I	97.6	Very high	92.5	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	103.8	169.5	-55.1	-175.9	0	0	0	109.2	M407 I409 W441 M448 I460 M482 V487 T488 F489 E490	M407-I458 HydrophobicContact CB-CB 4.44Å; M407-I458 HydrophobicContact CB-CG1 4.04Å; M407-I458 HydrophobicContact CB-CG2 4.28Å; M407-I458 HydrophobicContact SD-CD1 4.4Å; M407-I458 HydrophobicContact SD-CG2 4.43Å; I409-I458 HydrophobicContact CD1-CG2 3.76Å; I409-I458 HydrophobicContact CG1-CG2 4.08Å; W441-I458 HydrophobicContact CZ3-CD1 4.36Å; M448-I458 HydrophobicContact CE-CD1 3.78Å; M448-I458 HydrophobicContact CE-CG1 4.21Å; M448-I458 HydrophobicContact SD-CD1 4.47Å; I458-I460 HydrophobicContact CG2-CG1 4.38Å; I458-M482 HydrophobicContact CD1-CE 3.91Å; I458-M482 HydrophobicContact CD1-SD 3.76Å; I458-V487 HydrophobicContact CD1-CG1 3.7Å; I458-V487 HydrophobicContact CG1-CG1 3.78Å; I458-T488 PolarHBondContact N-O 2.8Å; I458-F489 HydrophobicContact CB-CD1 3.8Å; I458-F489 HydrophobicContact CB-CE1 3.76Å; I458-F489 HydrophobicContact CB-CZ 4.46Å; I458-F489 HydrophobicContact CD1-CE1 3.82Å; I458-F489 HydrophobicContact CD1-CZ 3.81Å; I458-F489 HydrophobicContact CG1-CE1 4.31Å; I458-F489 HydrophobicContact CG2-CD1 3.96Å; I458-F489 HydrophobicContact CG2-CE1 3.74Å; I458-F489 WeakPolarHBondContact O-CA 3.2Å; I458-E490 PolarHBondContact O-N 3.01Å
459	H	97.3	Very high	92.4	Very high	16 Å²	16	36.8 Å²	36.8	7%	0.074	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	138.9	170.8	-60.7	105.1	0	0	0	110.4	M407 L408 I409 E490 M502 Y506	M407-H459 PolarHBondContact O-N 3.43Å; L408-H459 WeakPolarHBondContact CA-O 3.21Å; L408-H459 HydrophobicContact CD1-CB 3.79Å; I409-H459 PolarHBondContact N-O 2.94Å; H459-E490 CarbonylContact C-O 3.54Å; H459-E490 VanDerWaalsContact CA-O 3.32Å; H459-E490 WeakPolarHBondContact CA-O 3.13Å; H459-M502 HydrophobicContact CB-CG 4.1Å; H459-M502 HydrophobicContact CB-SD 3.81Å; H459-Y506 AromaticContact ND1-CE2 3.5Å; H459-Y506 WeakPolarHBondContact ND1-CE2 3.44Å; H459-Y506 AromaticContact ND1-CZ 3.67Å; H459-Y506 PolarHBondContact ND1-OH 3.03Å
460	I	96.9	Very high	92.4	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	124.8	175	-39.8	-172.2	0	0	0	110.9	I409 L418 I458 I465 F475 F489 E490 S491	I409-I460 HydrophobicContact CB-CG2 4.32Å; I409-I460 HydrophobicContact CG2-CG2 4.47Å; I409-I460 WeakPolarHBondContact O-CA 3.4Å; L418-I460 HydrophobicContact CD1-CD1 3.78Å; L418-I460 HydrophobicContact CD1-CG2 4.12Å; L418-I460 HydrophobicContact CD2-CG2 3.99Å; I458-I460 HydrophobicContact CG2-CG1 4.38Å; I460-I465 HydrophobicContact CB-CD1 3.74Å; I460-I465 HydrophobicContact CD1-CD1 4.03Å; I460-I465 HydrophobicContact CG1-CD1 4.42Å; I460-I465 HydrophobicContact CG2-CD1 3.62Å; I460-F475 HydrophobicContact CD1-CE1 3.81Å; I460-F475 HydrophobicContact CD1-CZ 4.02Å; I460-F475 HydrophobicContact CG1-CZ 4.41Å; I460-F489 HydrophobicContact CD1-CD1 3.98Å; I460-F489 HydrophobicContact CD1-CE1 4.39Å; I460-F489 HydrophobicContact CG1-CD1 4.48Å; I460-E490 PolarHBondContact N-O 3.04Å; I460-S491 WeakPolarHBondContact O-CB 3.27Å; I460-S491 PolarHBondContact O-OG 3.25Å
461	M	94.8	Very high	92.6	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.02	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	158.4	-166.8	-167.1	-178.2	-155.9	0	0	111.7	L408 I409 F410 C411 E494 M502 I503 F507 Y512	L408-M461 HydrophobicContact CD1-CB 3.75Å; L408-M461 HydrophobicContact CD1-SD 4.37Å; L408-M461 HydrophobicContact CD2-SD 4.47Å; I409-M461 PolarHBondContact O-N 2.95Å; F410-M461 HydrophobicContact CD1-SD 4.32Å; F410-M461 HydrophobicContact CD2-CB 4.27Å; F410-M461 HydrophobicContact CD2-CG 4.33Å; F410-M461 HydrophobicContact CE1-SD 4.26Å; F410-M461 HydrophobicContact CE2-CG 4.34Å; F410-M461 HydrophobicContact CG-CB 4.41Å; F410-M461 HydrophobicContact CZ-SD 4.47Å; C411-M461 PolarHBondContact N-O 3.02Å; C411-M461 VanDerWaalsContact N-O 3.15Å; C411-M461 VanDerWaalsContact O-O 3.12Å; M461-E494 HydrophobicContact CE-CG 3.87Å; M461-M502 HydrophobicContact CB-CE 4.26Å; M461-M502 HydrophobicContact CE-CE 3.83Å; M461-M502 HydrophobicContact CG-CE 3.92Å; M461-M502 HydrophobicContact SD-CE 3.99Å; M461-I503 HydrophobicContact CE-CD1 3.9Å; M461-I503 HydrophobicContact CE-CG1 3.47Å; M461-I503 VanDerWaalsContact CE-CG1 3.47Å; M461-F507 HydrophobicContact CE-CE2 4.43Å; M461-F507 HydrophobicContact SD-CE2 3.96Å; M461-F507 HydrophobicContact SD-CZ 4.47Å; M461-Y512 HydrophobicContact CE-CE1 4.12Å; M461-Y512 HydrophobicContact CE-CE2 3.85Å; M461-Y512 VanDerWaalsContact CE-CZ 3.43Å; M461-Y512 WeakPolarHBondContact CE-OH 3.46Å; M461-Y512 HydrophobicContact SD-CE2 4.41Å
462	G	90.5	Very high	92.8	Very high	35 Å²	35	41.9 Å²	41.9	36%	0.361	24%	0.239	S	C	.	.	S	Bend	trans	93.1	-6.8	-178.3	0	0	0	0	0	114.8
463	C	91.2	Very high	93.1	Very high	23 Å²	23	46.6 Å²	46.6	16%	0.155	26%	0.259	C	S	.	.	S	Bend	trans	-150.2	166.2	178.1	56.3	0	0	0	0	112.1	G413 L418	G413-C463 WeakPolarHBondContact O-CB 3.41Å; L418-C463 WeakPolarHBondContact CD2-SG 3.48Å
464	Y	90.4	Very high	93.6	Very high	118 Å²	118	41.9 Å²	41.9	46%	0.463	23%	0.228	S	C	.	.			trans	-111.3	78.2	179.9	-179.5	-140.4	0	0	0	111.2	P415 L466 G467 L493	P415-Y464 WeakPolarHBondContact CA-O 3.3Å; Y464-L466 HydrophobicContact CE2-CB 4.39Å; Y464-G467 VanDerWaalsContact CZ-CA 3.41Å; Y464-G467 PolarHBondContact O-N 3.47Å; Y464-L493 HydrophobicContact CD2-CD2 3.51Å; Y464-L493 HydrophobicContact CD2-CG 4.46Å; Y464-L493 HydrophobicContact CE2-CD2 3.67Å; Y464-L493 HydrophobicContact CE2-CG 4.24Å; Y464-L493 HydrophobicContact CG-CD2 4.04Å
465	I	93.3	Very high	93.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-43.4	-173.5	-52.6	159.3	0	0	0	110.9	G416 L418 I460 G467 L474 F475	G416-I465 PolarHBondContact N-O 2.96Å; L418-I465 HydrophobicContact CD1-CD1 4.13Å; L418-I465 HydrophobicContact CD2-CD1 3.59Å; L418-I465 HydrophobicContact CD2-CG1 3.79Å; L418-I465 HydrophobicContact CG-CD1 4.06Å; L418-I465 HydrophobicContact CG-CG1 4.34Å; I460-I465 HydrophobicContact CB-CD1 3.74Å; I460-I465 HydrophobicContact CD1-CD1 4.03Å; I460-I465 HydrophobicContact CG1-CD1 4.42Å; I460-I465 HydrophobicContact CG2-CD1 3.62Å; I465-G467 PolarHBondContact O-N 3.12Å; I465-G467 VanDerWaalsContact O-N 3.16Å; I465-L474 HydrophobicContact CG2-CD2 4.17Å; I465-F475 HydrophobicContact CB-CE1 4.33Å; I465-F475 HydrophobicContact CB-CZ 4.43Å; I465-F475 HydrophobicContact CD1-CE1 3.76Å; I465-F475 HydrophobicContact CD1-CZ 3.8Å; I465-F475 HydrophobicContact CG2-CD1 4.48Å; I465-F475 HydrophobicContact CG2-CE1 3.86Å; I465-F475 HydrophobicContact CG2-CZ 4.4Å
466	L	92.6	Very high	94.2	Very high	59 Å²	59	41.5 Å²	41.5	31%	0.309	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	4.3	-177.8	-59.1	178.7	0	0	0	113.9	Y464 N468 E472 F475	Y464-L466 HydrophobicContact CE2-CB 4.39Å; L466-N468 PolarHBondContact O-N 3.38Å; L466-E472 HydrophobicContact CD2-CG 4.19Å; L466-F475 HydrophobicContact CD1-CE2 4.24Å; L466-F475 HydrophobicContact CD2-CD2 3.92Å; L466-F475 HydrophobicContact CD2-CE2 3.94Å; L466-F475 HydrophobicContact CD2-CG 4.44Å; L466-F475 HydrophobicContact CD2-CZ 4.47Å; L466-F475 HydrophobicContact CG-CE2 4.21Å
467	G	89.2	Confident	94.3	Very high	36 Å²	36	42.5 Å²	42.5	37%	0.371	23%	0.227	S	C	.	.	S	Bend	trans	-68.5	8.6	172.5	0	0	0	0	0	115.6	Y464 I465	Y464-G467 VanDerWaalsContact CZ-CA 3.41Å; Y464-G467 PolarHBondContact O-N 3.47Å; I465-G467 PolarHBondContact O-N 3.12Å; I465-G467 VanDerWaalsContact O-N 3.16Å
468	N	92.8	Very high	94.3	Very high	52 Å²	52	41.9 Å²	41.9	28%	0.278	22%	0.224	S	C	.	.	S	Bend	trans	-159.7	138.2	-178.3	177.4	-14	0	0	0	107.9	P415 L466 N470 G471	P415-N468 HydrophobicContact CB-CB 3.68Å; L466-N468 PolarHBondContact O-N 3.38Å; N468-N470 PolarHBondContact O-N 2.83Å; N468-N470 PolarHBondContact OD1-N 3.42Å; N468-G471 PolarHBondContact O-N 3.25Å
469	P	94	Very high	94.1	Very high	79 Å²	79	48.3 Å²	48.3	51%	0.513	25%	0.248	S	C	.	.	H	α-helix	trans	-57.3	-16	174.3	22.4	-35.3	0	0	0	114.7	G471 E472 K473	P469-G471 PolarHBondContact O-N 2.84Å; P469-E472 PolarHBondContact O-N 2.94Å; P469-K473 WeakPolarHBondContact O-CG 3.17Å; P469-K473 PolarHBondContact O-N 3.48Å
470	N	94.5	Very high	94	Very high	57 Å²	57	51.7 Å²	51.7	31%	0.305	27%	0.27	S	S	.	.	H	α-helix	trans	-63.1	-23.3	167.5	-69.4	-4.8	0	0	0	113.2	F428 N468 L474	F428-N470 HydrophobicContact CD1-CB 3.91Å; F428-N470 HydrophobicContact CE1-CB 4.03Å; N468-N470 PolarHBondContact O-N 2.83Å; N468-N470 PolarHBondContact OD1-N 3.42Å; N470-L474 WeakPolarHBondContact O-CB 3.49Å; N470-L474 PolarHBondContact O-N 3.37Å
471	G	94.6	Very high	93.8	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-76.3	-41	174.7	0	0	0	0	0	112.9	N468 P469 K473 L474 F475	N468-G471 PolarHBondContact O-N 3.25Å; P469-G471 PolarHBondContact O-N 2.84Å; G471-K473 VanDerWaalsContact C-N 3.28Å; G471-K473 PolarHBondContact O-N 3.49Å; G471-L474 WeakPolarHBondContact O-CB 3.48Å; G471-L474 PolarHBondContact O-N 3.23Å; G471-F475 PolarHBondContact O-N 3.21Å
472	E	94.9	Very high	93.7	Very high	122 Å²	122	52.7 Å²	52.7	57%	0.57	28%	0.275	S	S	*	.	H	α-helix	trans	-59.1	-43.1	171.5	-61.2	170.4	159.9	0	0	110.4	L466 P469 F475 Q476	L466-E472 HydrophobicContact CD2-CG 4.19Å; P469-E472 PolarHBondContact O-N 2.94Å; E472-F475 PolarHBondContact O-N 3.47Å; E472-Q476 WeakPolarHBondContact O-CB 3.29Å; E472-Q476 PolarHBondContact O-N 3.35Å
473	K	96.1	Very high	93.6	Very high	106 Å²	106	55.6 Å²	55.6	46%	0.461	29%	0.286	S	S	.	.	H	α-helix	trans	-63.8	-41.7	173.2	-69	-179.8	178.4	-173.3	0	113.1	F428 P469 G471 F475 Q476 N477	F428-K473 HydrophobicContact CB-CB 3.94Å; F428-K473 HydrophobicContact CG-CB 4.25Å; P469-K473 WeakPolarHBondContact O-CG 3.17Å; P469-K473 PolarHBondContact O-N 3.48Å; G471-K473 VanDerWaalsContact C-N 3.28Å; G471-K473 PolarHBondContact O-N 3.49Å; K473-F475 VanDerWaalsContact C-N 3.29Å; K473-F475 PolarHBondContact O-N 3.36Å; K473-Q476 PolarHBondContact O-N 2.88Å; K473-N477 WeakPolarHBondContact O-CB 3.34Å; K473-N477 PolarHBondContact O-N 2.97Å; K473-N477 PolarHBondContact O-OD1 2.96Å
474	L	96.1	Very high	93.3	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58.5	-44.1	174	173.3	57.7	0	0	0	110.7	L418 F428 V431 I465 N470 G471 N477 L478	L418-L474 HydrophobicContact CG-CD2 4.5Å; F428-L474 HydrophobicContact CB-CB 4.25Å; V431-L474 HydrophobicContact CB-CD1 4.32Å; V431-L474 HydrophobicContact CG1-CD1 4.05Å; I465-L474 HydrophobicContact CG2-CD2 4.17Å; N470-L474 WeakPolarHBondContact O-CB 3.49Å; N470-L474 PolarHBondContact O-N 3.37Å; G471-L474 WeakPolarHBondContact O-CB 3.48Å; G471-L474 PolarHBondContact O-N 3.23Å; L474-N477 PolarHBondContact O-N 2.95Å; L474-L478 HydrophobicContact CD1-CD1 3.85Å; L474-L478 HydrophobicContact CD1-CG 4.03Å; L474-L478 HydrophobicContact CG-CD1 3.92Å; L474-L478 WeakPolarHBondContact O-CB 3.38Å; L474-L478 WeakPolarHBondContact O-CD1 3.44Å; L474-L478 WeakPolarHBondContact O-CG 3.36Å; L474-L478 PolarHBondContact O-N 3.41Å
475	F	95.9	Very high	93	Very high	20 Å²	20	53.9 Å²	53.9	9%	0.088	29%	0.285	C	S	.	.	H	α-helix	trans	-68.3	-36.3	178	-76.7	16.1	0	0	0	112.6	I460 I465 L466 G471 E472 K473 L478 R479 F489	I460-F475 HydrophobicContact CD1-CE1 3.81Å; I460-F475 HydrophobicContact CD1-CZ 4.02Å; I460-F475 HydrophobicContact CG1-CZ 4.41Å; I465-F475 HydrophobicContact CB-CE1 4.33Å; I465-F475 HydrophobicContact CB-CZ 4.43Å; I465-F475 HydrophobicContact CD1-CE1 3.76Å; I465-F475 HydrophobicContact CD1-CZ 3.8Å; I465-F475 HydrophobicContact CG2-CD1 4.48Å; I465-F475 HydrophobicContact CG2-CE1 3.86Å; I465-F475 HydrophobicContact CG2-CZ 4.4Å; L466-F475 HydrophobicContact CD1-CE2 4.24Å; L466-F475 HydrophobicContact CD2-CD2 3.92Å; L466-F475 HydrophobicContact CD2-CE2 3.94Å; L466-F475 HydrophobicContact CD2-CG 4.44Å; L466-F475 HydrophobicContact CD2-CZ 4.47Å; L466-F475 HydrophobicContact CG-CE2 4.21Å; G471-F475 PolarHBondContact O-N 3.21Å; E472-F475 PolarHBondContact O-N 3.47Å; K473-F475 VanDerWaalsContact C-N 3.29Å; K473-F475 PolarHBondContact O-N 3.36Å; F475-L478 HydrophobicContact CD1-CD1 4.36Å; F475-R479 VanDerWaalsContact O-CB 3.29Å; F475-R479 WeakPolarHBondContact O-CB 3.41Å; F475-R479 PolarHBondContact O-N 3.26Å; F475-F489 HydrophobicContact CB-CB 4.09Å; F475-F489 HydrophobicContact CD1-CB 4.2Å; F475-F489 HydrophobicContact CD2-CB 3.54Å; F475-F489 WeakPolarHBondContact CD2-O 3.22Å; F475-F489 HydrophobicContact CE2-CB 3.89Å; F475-F489 HydrophobicContact CG-CB 3.7Å; F475-F489 HydrophobicContact CG-CG 4.49Å; F475-F489 HydrophobicContact CZ-CB 4.35Å
476	Q	95.4	Very high	92.6	Very high	130 Å²	130	60.2 Å²	60.2	61%	0.607	31%	0.309	S	S	*	.	H	α-helix	trans	-63.7	-49.7	173.5	-173.9	172.6	10.3	0	0	111.3	E472 K473 L478 R479 T480	E472-Q476 WeakPolarHBondContact O-CB 3.29Å; E472-Q476 PolarHBondContact O-N 3.35Å; K473-Q476 PolarHBondContact O-N 2.88Å; Q476-L478 PolarHBondContact O-N 2.85Å; Q476-R479 WeakPolarHBondContact O-CB 3.46Å; Q476-R479 PolarHBondContact O-N 3.17Å; Q476-T480 PolarHBondContact O-N 2.86Å; Q476-T480 PolarHBondContact O-OG1 2.88Å; Q476-T480 VanDerWaalsContact O-OG1 3.09Å
477	N	95.6	Very high	92.7	Very high	22 Å²	22	57.5 Å²	57.5	12%	0.118	30%	0.295	C	S	.	.	H	α-helix	trans	-61.9	-43.9	179.4	-68.1	19.9	0	0	0	111.4	F428 V431 E432 K473 L474 R479 T480 L481	F428-N477 PolarHBondContact O-ND2 3.47Å; V431-N477 HydrophobicContact CG1-CB 3.88Å; E432-N477 HydrophobicContact CG-CB 3.96Å; E432-N477 WeakPolarHBondContact OE1-CB 3.49Å; E432-N477 PolarHBondContact OE1-ND2 2.88Å; E432-N477 PolarHBondContact OE2-ND2 3.24Å; K473-N477 WeakPolarHBondContact O-CB 3.34Å; K473-N477 PolarHBondContact O-N 2.97Å; K473-N477 PolarHBondContact O-OD1 2.96Å; L474-N477 PolarHBondContact O-N 2.95Å; N477-R479 PolarHBondContact O-N 3.49Å; N477-T480 WeakPolarHBondContact O-CB 3.32Å; N477-T480 PolarHBondContact O-N 3.24Å; N477-L481 WeakPolarHBondContact O-CG 3.47Å; N477-L481 PolarHBondContact O-N 3.31Å
478	L	95.9	Very high	93	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-59.2	-43	173.1	-74.7	168.4	0	0	0	112.4	V431 W441 L474 F475 Q476 T480 L481 M482 F489	V431-L478 HydrophobicContact CG2-CD2 3.72Å; V431-L478 HydrophobicContact CG2-CG 4.44Å; W441-L478 HydrophobicContact CD2-CD2 3.44Å; W441-L478 VanDerWaalsContact CD2-CD2 3.44Å; W441-L478 HydrophobicContact CE3-CD2 3.99Å; W441-L478 HydrophobicContact CG-CD2 3.8Å; W441-L478 HydrophobicContact CH2-CD2 4.08Å; W441-L478 HydrophobicContact CZ2-CD1 4.48Å; W441-L478 HydrophobicContact CZ2-CD2 3.54Å; W441-L478 HydrophobicContact CZ3-CD2 4.29Å; L474-L478 HydrophobicContact CD1-CD1 3.85Å; L474-L478 HydrophobicContact CD1-CG 4.03Å; L474-L478 HydrophobicContact CG-CD1 3.92Å; L474-L478 WeakPolarHBondContact O-CB 3.38Å; L474-L478 WeakPolarHBondContact O-CD1 3.44Å; L474-L478 WeakPolarHBondContact O-CG 3.36Å; L474-L478 PolarHBondContact O-N 3.41Å; F475-L478 HydrophobicContact CD1-CD1 4.36Å; Q476-L478 PolarHBondContact O-N 2.85Å; L478-T480 VanDerWaalsContact C-N 3.34Å; L478-T480 PolarHBondContact O-N 3.15Å; L478-L481 PolarHBondContact O-N 3.01Å; L478-M482 WeakPolarHBondContact O-CG 3.5Å; L478-M482 PolarHBondContact O-N 3.16Å; L478-F489 HydrophobicContact CB-CD2 4.01Å; L478-F489 HydrophobicContact CB-CE1 4.31Å; L478-F489 HydrophobicContact CB-CE2 3.48Å; L478-F489 VanDerWaalsContact CB-CE2 3.48Å; L478-F489 HydrophobicContact CB-CZ 3.63Å; L478-F489 HydrophobicContact CD1-CD1 4.34Å; L478-F489 HydrophobicContact CD1-CE1 4.02Å; L478-F489 HydrophobicContact CD1-CZ 4.17Å; L478-F489 HydrophobicContact CD2-CZ 4.44Å; L478-F489 HydrophobicContact CG-CZ 4.31Å
479	R	94.9	Very high	93.1	Very high	134 Å²	134	55.6 Å²	55.6	51%	0.506	28%	0.276	S	S	.	.	H	α-helix	trans	-64.7	-37.3	177.2	-172.8	171.7	-166.4	-164.7	-2.2	112.5	F475 Q476 N477 M482 T483 V487 F489	F475-R479 VanDerWaalsContact O-CB 3.29Å; F475-R479 WeakPolarHBondContact O-CB 3.41Å; F475-R479 PolarHBondContact O-N 3.26Å; Q476-R479 WeakPolarHBondContact O-CB 3.46Å; Q476-R479 PolarHBondContact O-N 3.17Å; N477-R479 PolarHBondContact O-N 3.49Å; R479-M482 PolarHBondContact O-N 2.88Å; R479-T483 PolarHBondContact O-N 3.14Å; R479-T483 PolarHBondContact O-OG1 3.3Å; R479-V487 WeakPolarHBondContact CG-O 3.46Å; R479-V487 PolarHBondContact NE-O 3.49Å; R479-F489 HydrophobicContact CB-CD2 4.48Å
480	T	94	Very high	93.2	Very high	88 Å²	88	55.9 Å²	55.9	54%	0.54	27%	0.271	S	S	.	.	H	α-helix	trans	-62.3	-48.2	171.5	-53	0	0	0	0	110.7	Q476 N477 L478 M482 T483	Q476-T480 PolarHBondContact O-N 2.86Å; Q476-T480 PolarHBondContact O-OG1 2.88Å; Q476-T480 VanDerWaalsContact O-OG1 3.09Å; N477-T480 WeakPolarHBondContact O-CB 3.32Å; N477-T480 PolarHBondContact O-N 3.24Å; L478-T480 VanDerWaalsContact C-N 3.34Å; L478-T480 PolarHBondContact O-N 3.15Å; T480-M482 PolarHBondContact O-N 3.14Å; T480-T483 VanDerWaalsContact O-CB 3.29Å; T480-T483 WeakPolarHBondContact O-CB 3.4Å; T480-T483 PolarHBondContact O-N 3.17Å; T480-T483 VanDerWaalsContact O-N 3.14Å; T480-T483 PolarHBondContact O-OG1 3.47Å
481	L	93.4	Very high	93.2	Very high	25 Å²	25	53.6 Å²	53.6	13%	0.131	26%	0.259	C	S	.	.	H	α-helix	trans	-62.8	-27	179.5	-70.9	167.2	0	0	0	114	V431 E432 I438 W441 N477 L478	V431-L481 HydrophobicContact CB-CD1 4.47Å; V431-L481 HydrophobicContact CG1-CD1 4.22Å; V431-L481 HydrophobicContact CG2-CD1 3.84Å; V431-L481 WeakPolarHBondContact O-CD1 3.33Å; E432-L481 HydrophobicContact CG-CD1 4.44Å; I438-L481 HydrophobicContact CG1-CD2 4.43Å; I438-L481 HydrophobicContact CG2-CD2 4.19Å; W441-L481 HydrophobicContact CB-CB 4.41Å; N477-L481 WeakPolarHBondContact O-CG 3.47Å; N477-L481 PolarHBondContact O-N 3.31Å; L478-L481 PolarHBondContact O-N 3.01Å
482	M	93.3	Very high	93.2	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.005	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	12.9	177.5	-58.2	-170.3	85.4	0	0	114	W441 L444 M448 I458 L478 R479 T480 Y485 V487 F489	W441-M482 HydrophobicContact CB-CG 4.44Å; W441-M482 HydrophobicContact CE3-CE 4.36Å; W441-M482 HydrophobicContact CE3-SD 3.69Å; W441-M482 HydrophobicContact CZ3-SD 4.17Å; L444-M482 HydrophobicContact CB-CE 4.21Å; L444-M482 HydrophobicContact CD2-CE 4.26Å; L444-M482 HydrophobicContact CG-CE 3.96Å; M448-M482 HydrophobicContact CE-CE 4.24Å; M448-M482 HydrophobicContact CG-CE 4.08Å; I458-M482 HydrophobicContact CD1-CE 3.91Å; I458-M482 HydrophobicContact CD1-SD 3.76Å; L478-M482 WeakPolarHBondContact O-CG 3.5Å; L478-M482 PolarHBondContact O-N 3.16Å; R479-M482 PolarHBondContact O-N 2.88Å; T480-M482 PolarHBondContact O-N 3.14Å; M482-Y485 WeakPolarHBondContact O-CB 3.46Å; M482-Y485 PolarHBondContact O-N 3.16Å; M482-Y485 VanDerWaalsContact O-N 3.08Å; M482-V487 HydrophobicContact CB-CB 4.11Å; M482-V487 HydrophobicContact CB-CG2 3.81Å; M482-V487 HydrophobicContact CE-CG2 4.15Å; M482-V487 HydrophobicContact SD-CB 4.4Å; M482-V487 HydrophobicContact SD-CG1 4.05Å; M482-V487 HydrophobicContact SD-CG2 4.18Å; M482-F489 HydrophobicContact SD-CE2 3.99Å; M482-F489 HydrophobicContact SD-CZ 3.58Å; M482-F489 VanDerWaalsContact SD-CZ 3.58Å
483	T	87.6	Confident	93	Very high	95 Å²	95	53.1 Å²	53.1	58%	0.583	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	140.8	167.3	-63.5	0	0	0	0	108.9	R479 T480	R479-T483 PolarHBondContact O-N 3.14Å; R479-T483 PolarHBondContact O-OG1 3.3Å; T480-T483 VanDerWaalsContact O-CB 3.29Å; T480-T483 WeakPolarHBondContact O-CB 3.4Å; T480-T483 PolarHBondContact O-N 3.17Å; T480-T483 VanDerWaalsContact O-N 3.14Å; T480-T483 PolarHBondContact O-OG1 3.47Å
484	P	84.9	Confident	92.6	Very high	77 Å²	77	50.5 Å²	50.5	50%	0.5	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	cis	-90.6	4.7	8.3	35.7	-36.1	0	0	0	116.4	W327 R486	W327-P484 HydrophobicContact CE3-CG 4.21Å; W327-P484 HydrophobicContact CH2-CG 3.85Å; W327-P484 HydrophobicContact CZ3-CG 3.6Å; P484-R486 PolarHBondContact O-N 3.39Å
485	Y	83.5	Confident	92.2	Very high	28 Å²	28	59 Å²	59	11%	0.11	30%	0.295	C	S	.	.	S	Bend	trans	-67.1	21.7	-169.7	-56.7	-97.3	0	0	0	117.2	W327 S445 R446 N456 M482 V487	W327-Y485 HydrophobicContact CE3-CE1 4.23Å; W327-Y485 AromaticContact CH2-CD1 3.56Å; W327-Y485 HydrophobicContact CH2-CD1 3.56Å; W327-Y485 HydrophobicContact CH2-CD2 4.45Å; W327-Y485 AromaticContact CH2-CE1 3.71Å; W327-Y485 HydrophobicContact CH2-CE1 3.71Å; W327-Y485 AromaticContact CH2-CG 3.96Å; W327-Y485 HydrophobicContact CH2-CG 3.96Å; W327-Y485 AromaticContact CZ3-CD1 3.62Å; W327-Y485 HydrophobicContact CZ3-CD1 3.62Å; W327-Y485 HydrophobicContact CZ3-CD2 4.19Å; W327-Y485 AromaticContact CZ3-CE1 3.26Å; W327-Y485 HydrophobicContact CZ3-CE1 3.26Å; W327-Y485 AromaticContact CZ3-CE2 3.86Å; W327-Y485 HydrophobicContact CZ3-CE2 3.86Å; W327-Y485 HydrophobicContact CZ3-CG 4.07Å; W327-Y485 AromaticContact CZ3-CZ 3.38Å; S445-Y485 VanDerWaalsContact CB-CD2 3.43Å; S445-Y485 WeakPolarHBondContact O-CD1 3.44Å; S445-Y485 VanDerWaalsContact O-CE1 3.24Å; S445-Y485 WeakPolarHBondContact O-CE1 3.47Å; S445-Y485 WeakPolarHBondContact OG-CD2 3.42Å; S445-Y485 VanDerWaalsContact OG-CE2 3.31Å; S445-Y485 WeakPolarHBondContact OG-CE2 3.35Å; R446-Y485 WeakPolarHBondContact CG-OH 3.45Å; N456-Y485 PolarHBondContact ND2-O 3.41Å; M482-Y485 WeakPolarHBondContact O-CB 3.46Å; M482-Y485 PolarHBondContact O-N 3.16Å; M482-Y485 VanDerWaalsContact O-N 3.08Å; Y485-V487 WeakPolarHBondContact O-CG2 3.36Å; Y485-V487 PolarHBondContact O-N 3.19Å
486	R	85.6	Confident	92	Very high	133 Å²	133	59.8 Å²	59.8	50%	0.502	30%	0.304	S	S	.	.			trans	46.9	37.8	173.3	-66.1	176	66	-129.3	4.4	114.8	N452 P453 E454 P455 N456 P484	N452-R486 PolarHBondContact O-NH1 3.45Å; P453-R486 PolarHBondContact O-NH1 2.91Å; P453-R486 VanDerWaalsContact O-NH1 3.12Å; P453-R486 PolarHBondContact O-NH2 2.96Å; E454-R486 PolarHBondContact O-NH1 3.17Å; P455-R486 CarbonylContact C-O 3.42Å; P455-R486 WeakPolarHBondContact CA-O 3.37Å; P455-R486 WeakPolarHBondContact CB-O 3.44Å; N456-R486 PolarHBondContact N-O 2.99Å; N456-R486 VanDerWaalsContact N-O 3.12Å; P484-R486 PolarHBondContact O-N 3.39Å
487	V	94.4	Very high	91.9	Very high	3 Å²	3	57.3 Å²	57.3	2%	0.018	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	142.7	-177.6	-174.9	0	0	0	0	112.1	M448 N456 I458 R479 M482 Y485 F489	M448-V487 HydrophobicContact CG-CG2 4.16Å; N456-V487 HydrophobicContact CB-CG2 4.46Å; N456-V487 CarbonylContact O-C 3.55Å; N456-V487 VanDerWaalsContact O-CA 3.3Å; N456-V487 WeakPolarHBondContact O-CA 3.35Å; I458-V487 HydrophobicContact CD1-CG1 3.7Å; I458-V487 HydrophobicContact CG1-CG1 3.78Å; R479-V487 WeakPolarHBondContact CG-O 3.46Å; R479-V487 PolarHBondContact NE-O 3.49Å; M482-V487 HydrophobicContact CB-CB 4.11Å; M482-V487 HydrophobicContact CB-CG2 3.81Å; M482-V487 HydrophobicContact CE-CG2 4.15Å; M482-V487 HydrophobicContact SD-CB 4.4Å; M482-V487 HydrophobicContact SD-CG1 4.05Å; M482-V487 HydrophobicContact SD-CG2 4.18Å; Y485-V487 WeakPolarHBondContact O-CG2 3.36Å; Y485-V487 PolarHBondContact O-N 3.19Å; V487-F489 HydrophobicContact CG1-CD2 4.22Å; V487-F489 HydrophobicContact CG1-CE2 3.8Å; V487-F489 HydrophobicContact CG1-CZ 4.22Å
488	T	94.6	Very high	91.8	Very high	25 Å²	25	62.4 Å²	62.4	15%	0.153	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	148.6	164.4	48.9	0	0	0	0	110.8	P455 N456 I458	P455-T488 HydrophobicContact CB-CG2 3.83Å; P455-T488 HydrophobicContact CG-CG2 4.06Å; N456-T488 PolarHBondContact O-N 2.97Å; I458-T488 PolarHBondContact N-O 2.8Å
489	F	96.1	Very high	91.6	Very high	22 Å²	22	62.4 Å²	62.4	10%	0.096	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126.8	179.6	-77.8	-85.7	0	0	0	110.5	W441 I458 I460 F475 L478 R479 M482 V487	W441-F489 HydrophobicContact CE3-CZ 4.3Å; W441-F489 HydrophobicContact CH2-CE1 4.14Å; W441-F489 HydrophobicContact CH2-CZ 4.46Å; W441-F489 AromaticContact CZ3-CE1 3.91Å; W441-F489 HydrophobicContact CZ3-CE1 3.91Å; W441-F489 AromaticContact CZ3-CZ 3.89Å; W441-F489 HydrophobicContact CZ3-CZ 3.89Å; I458-F489 HydrophobicContact CB-CD1 3.8Å; I458-F489 HydrophobicContact CB-CE1 3.76Å; I458-F489 HydrophobicContact CB-CZ 4.46Å; I458-F489 HydrophobicContact CD1-CE1 3.82Å; I458-F489 HydrophobicContact CD1-CZ 3.81Å; I458-F489 HydrophobicContact CG1-CE1 4.31Å; I458-F489 HydrophobicContact CG2-CD1 3.96Å; I458-F489 HydrophobicContact CG2-CE1 3.74Å; I458-F489 WeakPolarHBondContact O-CA 3.2Å; I460-F489 HydrophobicContact CD1-CD1 3.98Å; I460-F489 HydrophobicContact CD1-CE1 4.39Å; I460-F489 HydrophobicContact CG1-CD1 4.48Å; F475-F489 HydrophobicContact CB-CB 4.09Å; F475-F489 HydrophobicContact CD1-CB 4.2Å; F475-F489 HydrophobicContact CD2-CB 3.54Å; F475-F489 WeakPolarHBondContact CD2-O 3.22Å; F475-F489 HydrophobicContact CE2-CB 3.89Å; F475-F489 HydrophobicContact CG-CB 3.7Å; F475-F489 HydrophobicContact CG-CG 4.49Å; F475-F489 HydrophobicContact CZ-CB 4.35Å; L478-F489 HydrophobicContact CB-CD2 4.01Å; L478-F489 HydrophobicContact CB-CE1 4.31Å; L478-F489 HydrophobicContact CB-CE2 3.48Å; L478-F489 VanDerWaalsContact CB-CE2 3.48Å; L478-F489 HydrophobicContact CB-CZ 3.63Å; L478-F489 HydrophobicContact CD1-CD1 4.34Å; L478-F489 HydrophobicContact CD1-CE1 4.02Å; L478-F489 HydrophobicContact CD1-CZ 4.17Å; L478-F489 HydrophobicContact CD2-CZ 4.44Å; L478-F489 HydrophobicContact CG-CZ 4.31Å; R479-F489 HydrophobicContact CB-CD2 4.48Å; M482-F489 HydrophobicContact SD-CE2 3.99Å; M482-F489 HydrophobicContact SD-CZ 3.58Å; M482-F489 VanDerWaalsContact SD-CZ 3.58Å; V487-F489 HydrophobicContact CG1-CD2 4.22Å; V487-F489 HydrophobicContact CG1-CE2 3.8Å; V487-F489 HydrophobicContact CG1-CZ 4.22Å
490	E	95.6	Very high	91.6	Very high	85 Å²	85	59.8 Å²	59.8	40%	0.397	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	139.2	-176.5	-66.2	-168.5	-150.8	0	0	111.2	V457 I458 H459 I460	V457-E490 HydrophobicContact CG1-CB 4.44Å; V457-E490 HydrophobicContact CG1-CG 4.13Å; I458-E490 PolarHBondContact O-N 3.01Å; H459-E490 CarbonylContact C-O 3.54Å; H459-E490 VanDerWaalsContact CA-O 3.32Å; H459-E490 WeakPolarHBondContact CA-O 3.13Å; I460-E490 PolarHBondContact N-O 3.04Å
491	S	95.6	Very high	91.6	Very high	9 Å²	9	61.5 Å²	61.5	6%	0.063	32%	0.322	C	S	.	.			trans	-145.6	67	174.5	-170	0	0	0	0	109.7	I460	I460-S491 WeakPolarHBondContact O-CB 3.27Å; I460-S491 PolarHBondContact O-OG 3.25Å
492	P	93.1	Very high	91.7	Very high	20 Å²	20	60.6 Å²	60.6	13%	0.13	32%	0.317	C	S	.	.			trans	-68.5	144.9	177.7	30.6	-35.8	0	0	0	110.6	E494 Q498 M502	P492-E494 PolarHBondContact O-N 3.03Å; P492-Q498 HydrophobicContact CB-CB 3.71Å; P492-Q498 HydrophobicContact CG-CB 4.43Å; P492-M502 HydrophobicContact CG-CB 4.1Å; P492-M502 HydrophobicContact CG-CE 4.27Å; P492-M502 HydrophobicContact CG-CG 4.49Å; P492-M502 HydrophobicContact CG-SD 3.68Å
493	L	90.6	Very high	91.8	Very high	92 Å²	92	60.7 Å²	60.7	48%	0.482	32%	0.318	S	S	.	.			trans	-61.4	127.2	175.7	-69.3	172.6	0	0	0	109.8	Y464 L495 S496 G499	Y464-L493 HydrophobicContact CD2-CD2 3.51Å; Y464-L493 HydrophobicContact CD2-CG 4.46Å; Y464-L493 HydrophobicContact CE2-CD2 3.67Å; Y464-L493 HydrophobicContact CE2-CG 4.24Å; Y464-L493 HydrophobicContact CG-CD2 4.04Å; L493-L495 PolarHBondContact O-N 3.3Å; L493-S496 VanDerWaalsContact O-CB 3.28Å; L493-S496 WeakPolarHBondContact O-CB 3.34Å; L493-S496 PolarHBondContact O-N 3.07Å; L493-S496 PolarHBondContact O-OG 3.14Å; L493-G499 WeakPolarHBondContact O-CA 3.44Å
494	E	87.8	Confident	92.1	Very high	52 Å²	52	59.3 Å²	59.3	24%	0.243	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-28	-176	-59.7	176.5	172.3	0	0	114.3	M461 P492 I503 K516	M461-E494 HydrophobicContact CE-CG 3.87Å; P492-E494 PolarHBondContact O-N 3.03Å; E494-I503 HydrophobicContact CB-CD1 4.25Å; E494-K516 IonicContact OE1-NZ 3.63Å; E494-K516 PolarHBondContact OE1-NZ 3.12Å; E494-K516 WeakPolarHBondContact OE2-CE 3.45Å; E494-K516 IonicContact OE2-NZ 3.82Å; E494-K516 PolarHBondContact OE2-NZ 2.88Å
495	L	87.8	Confident	92.6	Very high	178 Å²	178	57.8 Å²	57.8	93%	0.932	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-2.8	178.7	-59.3	177.6	0	0	0	114.2	L493	L493-L495 PolarHBondContact O-N 3.3Å
496	S	92.2	Very high	93.2	Very high	37 Å²	37	56.5 Å²	56.5	26%	0.259	29%	0.289	S	S	.	.	S	Bend	trans	-88	165.4	177.4	72.2	0	0	0	0	111.9	L493 Q498 G499 K500	L493-S496 VanDerWaalsContact O-CB 3.28Å; L493-S496 WeakPolarHBondContact O-CB 3.34Å; L493-S496 PolarHBondContact O-N 3.07Å; L493-S496 PolarHBondContact O-OG 3.14Å; S496-Q498 VanDerWaalsContact C-N 3.32Å; S496-Q498 PolarHBondContact O-N 2.83Å; S496-G499 PolarHBondContact O-N 3.01Å; S496-G499 PolarHBondContact OG-N 3.44Å; S496-K500 PolarHBondContact O-N 3.33Å
497	A	92.9	Very high	93.7	Very high	77 Å²	77	50.2 Å²	50.2	64%	0.636	27%	0.266	S	S	*	.	H	α-helix	trans	-59.8	-41	175.4	0	0	0	0	0	112.5	K500 Q501	A497-K500 PolarHBondContact O-N 3.05Å; A497-Q501 WeakPolarHBondContact O-CG 3.37Å; A497-Q501 PolarHBondContact O-N 3.46Å
498	Q	93.1	Very high	93.7	Very high	129 Å²	129	52.9 Å²	52.9	60%	0.603	28%	0.28	S	S	*	.	H	α-helix	trans	-65.7	-41.3	174.1	-69.6	172	-36.6	0	0	111.7	P492 S496 K500 Q501 M502	P492-Q498 HydrophobicContact CB-CB 3.71Å; P492-Q498 HydrophobicContact CG-CB 4.43Å; S496-Q498 VanDerWaalsContact C-N 3.32Å; S496-Q498 PolarHBondContact O-N 2.83Å; Q498-K500 VanDerWaalsContact C-N 3.32Å; Q498-K500 PolarHBondContact O-N 3.11Å; Q498-Q501 PolarHBondContact O-N 2.81Å; Q498-M502 WeakPolarHBondContact O-CB 3.48Å; Q498-M502 PolarHBondContact O-N 2.89Å
499	G	93.7	Very high	93.6	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.4	-37.5	175.3	0	0	0	0	0	112.7	L493 S496 M502 I503	L493-G499 WeakPolarHBondContact O-CA 3.44Å; S496-G499 PolarHBondContact O-N 3.01Å; S496-G499 PolarHBondContact OG-N 3.44Å; G499-M502 PolarHBondContact O-N 3.4Å; G499-I503 WeakPolarHBondContact O-CD1 3.48Å; G499-I503 WeakPolarHBondContact O-CG1 3.49Å; G499-I503 PolarHBondContact O-N 2.81Å
500	K	94.3	Very high	93.4	Very high	80 Å²	80	63.4 Å²	63.4	35%	0.348	32%	0.318	S	S	.	.	H	α-helix	trans	-62.5	-47	171.3	173.6	169.1	-172.5	-75.7	0	111.7	S496 A497 Q498 M502 I503 E504 F509	S496-K500 PolarHBondContact O-N 3.33Å; A497-K500 PolarHBondContact O-N 3.05Å; Q498-K500 VanDerWaalsContact C-N 3.32Å; Q498-K500 PolarHBondContact O-N 3.11Å; K500-M502 PolarHBondContact O-N 3.39Å; K500-I503 PolarHBondContact O-N 3.01Å; K500-E504 VanDerWaalsContact CE-OE1 3.25Å; K500-E504 WeakPolarHBondContact CE-OE1 3.28Å; K500-E504 HydrophobicContact CG-CG 4.43Å; K500-E504 WeakPolarHBondContact CG-OE2 3.26Å; K500-E504 IonicContact NZ-OE1 3.63Å; K500-E504 PolarHBondContact NZ-OE1 3.12Å; K500-E504 IonicContact NZ-OE2 3.45Å; K500-E504 PolarHBondContact NZ-OE2 3.5Å; K500-E504 WeakPolarHBondContact O-CB 3.42Å; K500-E504 WeakPolarHBondContact O-CG 3.46Å; K500-E504 PolarHBondContact O-N 3.12Å; K500-F509 HydrophobicContact CB-CE2 4.21Å; K500-F509 HydrophobicContact CD-CE1 4.43Å; K500-F509 HydrophobicContact CD-CE2 4.03Å; K500-F509 HydrophobicContact CD-CZ 3.91Å; K500-F509 HydrophobicContact CG-CD2 4.12Å; K500-F509 HydrophobicContact CG-CE2 3.69Å; K500-F509 HydrophobicContact CG-CZ 4.11Å
501	Q	94.1	Very high	93.2	Very high	123 Å²	123	61.2 Å²	61.2	58%	0.575	31%	0.309	S	S	*	.	H	α-helix	trans	-61.2	-42.3	177.2	-72.1	168.4	-34.3	0	0	112	A497 Q498 E504 T505	A497-Q501 WeakPolarHBondContact O-CG 3.37Å; A497-Q501 PolarHBondContact O-N 3.46Å; Q498-Q501 PolarHBondContact O-N 2.81Å; Q501-E504 PolarHBondContact O-N 3.02Å; Q501-T505 PolarHBondContact O-N 3.47Å; Q501-T505 VanDerWaalsContact O-N 3.1Å; Q501-T505 PolarHBondContact O-OG1 3.3Å
502	M	95.2	Very high	93.1	Very high	6 Å²	6	61.1 Å²	61.1	3%	0.03	31%	0.307	C	S	.	.	H	α-helix	trans	-59	-47.3	171.9	-179.6	-170.6	74.5	0	0	111.1	H459 M461 P492 Q498 G499 K500 E504 T505 Y506	H459-M502 HydrophobicContact CB-CG 4.1Å; H459-M502 HydrophobicContact CB-SD 3.81Å; M461-M502 HydrophobicContact CB-CE 4.26Å; M461-M502 HydrophobicContact CE-CE 3.83Å; M461-M502 HydrophobicContact CG-CE 3.92Å; M461-M502 HydrophobicContact SD-CE 3.99Å; P492-M502 HydrophobicContact CG-CB 4.1Å; P492-M502 HydrophobicContact CG-CE 4.27Å; P492-M502 HydrophobicContact CG-CG 4.49Å; P492-M502 HydrophobicContact CG-SD 3.68Å; Q498-M502 WeakPolarHBondContact O-CB 3.48Å; Q498-M502 PolarHBondContact O-N 2.89Å; G499-M502 PolarHBondContact O-N 3.4Å; K500-M502 PolarHBondContact O-N 3.39Å; M502-E504 PolarHBondContact O-N 2.94Å; M502-T505 WeakPolarHBondContact O-CB 3.42Å; M502-T505 PolarHBondContact O-N 2.91Å; M502-Y506 WeakPolarHBondContact O-CD2 3.44Å
503	I	95.5	Very high	93	Very high	4 Å²	4	68.8 Å²	68.8	2%	0.021	33%	0.333	C	S	.	.	H	α-helix	trans	-60.5	-47.6	177.1	-69.6	161.7	0	0	0	110.9	M461 E494 G499 K500 T505 Y506 F507 F509 Y512	M461-I503 HydrophobicContact CE-CD1 3.9Å; M461-I503 HydrophobicContact CE-CG1 3.47Å; M461-I503 VanDerWaalsContact CE-CG1 3.47Å; E494-I503 HydrophobicContact CB-CD1 4.25Å; G499-I503 WeakPolarHBondContact O-CD1 3.48Å; G499-I503 WeakPolarHBondContact O-CG1 3.49Å; G499-I503 PolarHBondContact O-N 2.81Å; K500-I503 PolarHBondContact O-N 3.01Å; I503-T505 PolarHBondContact O-N 2.69Å; I503-T505 VanDerWaalsContact O-N 3.11Å; I503-Y506 PolarHBondContact O-N 3.44Å; I503-Y506 VanDerWaalsContact O-N 3.1Å; I503-F507 HydrophobicContact CB-CD2 4.44Å; I503-F507 HydrophobicContact CG2-CB 4.16Å; I503-F507 HydrophobicContact CG2-CD2 3.96Å; I503-F507 HydrophobicContact CG2-CG 4.49Å; I503-F507 WeakPolarHBondContact O-CD2 3.48Å; I503-F507 PolarHBondContact O-N 3.49Å; I503-F509 HydrophobicContact CB-CD2 4.31Å; I503-F509 HydrophobicContact CG2-CD2 3.74Å; I503-F509 HydrophobicContact CG2-CE2 4.47Å; I503-Y512 HydrophobicContact CD1-CD1 4.07Å; I503-Y512 HydrophobicContact CD1-CE1 3.88Å; I503-Y512 HydrophobicContact CG1-CD1 4.42Å; I503-Y512 HydrophobicContact CG1-CE1 4.34Å; I503-Y512 HydrophobicContact CG2-CD1 3.89Å; I503-Y512 HydrophobicContact CG2-CD2 4.33Å; I503-Y512 HydrophobicContact CG2-CG 3.77Å
504	E	94.6	Very high	93	Very high	65 Å²	65	67 Å²	67	30%	0.304	32%	0.324	S	S	.	.	H	α-helix	trans	-65	-11.9	179.1	-74.9	175.4	144.5	0	0	113.9	R366 K500 Q501 M502 F509	R366-E504 WeakPolarHBondContact CD-O 3.49Å; R366-E504 PolarHBondContact NH1-O 3.33Å; K500-E504 VanDerWaalsContact CE-OE1 3.25Å; K500-E504 WeakPolarHBondContact CE-OE1 3.28Å; K500-E504 HydrophobicContact CG-CG 4.43Å; K500-E504 WeakPolarHBondContact CG-OE2 3.26Å; K500-E504 IonicContact NZ-OE1 3.63Å; K500-E504 PolarHBondContact NZ-OE1 3.12Å; K500-E504 IonicContact NZ-OE2 3.45Å; K500-E504 PolarHBondContact NZ-OE2 3.5Å; K500-E504 WeakPolarHBondContact O-CB 3.42Å; K500-E504 WeakPolarHBondContact O-CG 3.46Å; K500-E504 PolarHBondContact O-N 3.12Å; Q501-E504 PolarHBondContact O-N 3.02Å; M502-E504 PolarHBondContact O-N 2.94Å; E504-F509 HydrophobicContact CG-CB 3.82Å; E504-F509 HydrophobicContact CG-CD2 4.14Å; E504-F509 HydrophobicContact CG-CG 4.18Å
505	T	94.8	Very high	93.2	Very high	46 Å²	46	64.5 Å²	64.5	28%	0.282	31%	0.312	S	S	.	.	H	α-helix	trans	-81.8	-22.7	174.1	-57.3	0	0	0	0	113.2	Q501 M502 I503	Q501-T505 PolarHBondContact O-N 3.47Å; Q501-T505 VanDerWaalsContact O-N 3.1Å; Q501-T505 PolarHBondContact O-OG1 3.3Å; M502-T505 WeakPolarHBondContact O-CB 3.42Å; M502-T505 PolarHBondContact O-N 2.91Å; I503-T505 PolarHBondContact O-N 2.69Å; I503-T505 VanDerWaalsContact O-N 3.11Å
506	Y	95.9	Very high	93.3	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-125.5	-22.7	-175.6	-60.3	-86.8	0	0	0	114.3	K347 R366 I372 M407 L408 H459 M502 I503	K347-Y506 HydrophobicContact CB-CE1 4.07Å; R366-Y506 PolarHBondContact N-O 3.29Å; I372-Y506 HydrophobicContact CG2-CD1 4.47Å; M407-Y506 VanDerWaalsContact C-OH 3.32Å; M407-Y506 PolarHBondContact O-OH 2.97Å; L408-Y506 HydrophobicContact CB-CD1 3.96Å; L408-Y506 HydrophobicContact CB-CD2 4.18Å; L408-Y506 HydrophobicContact CB-CE1 3.66Å; L408-Y506 HydrophobicContact CB-CE2 3.93Å; L408-Y506 HydrophobicContact CB-CG 4.21Å; L408-Y506 HydrophobicContact CD2-CD1 4.19Å; L408-Y506 HydrophobicContact CD2-CD2 3.8Å; L408-Y506 HydrophobicContact CD2-CE2 4.35Å; L408-Y506 HydrophobicContact CD2-CG 3.73Å; L408-Y506 HydrophobicContact CG-CD2 4.47Å; H459-Y506 AromaticContact ND1-CE2 3.5Å; H459-Y506 WeakPolarHBondContact ND1-CE2 3.44Å; H459-Y506 AromaticContact ND1-CZ 3.67Å; H459-Y506 PolarHBondContact ND1-OH 3.03Å; M502-Y506 WeakPolarHBondContact O-CD2 3.44Å; I503-Y506 PolarHBondContact O-N 3.44Å; I503-Y506 VanDerWaalsContact O-N 3.1Å
507	F	95.8	Very high	93.1	Very high	1 Å²	1	60.8 Å²	60.8	0%	0.004	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-127.3	155.8	-172.4	-54.1	-77.1	0	0	0	113	M349 I361 I364 I365 R366 L408 F410 M461 I503 F509 Y512	M349-F507 HydrophobicContact CE-CE1 3.56Å; M349-F507 HydrophobicContact CE-CZ 3.4Å; M349-F507 HydrophobicContact SD-CE1 4.02Å; M349-F507 HydrophobicContact SD-CZ 4.03Å; I361-F507 HydrophobicContact CG2-CE1 3.87Å; I364-F507 HydrophobicContact CD1-CD1 4.06Å; I364-F507 HydrophobicContact CD1-CE1 4.27Å; I364-F507 HydrophobicContact CG1-CD1 4.08Å; I364-F507 HydrophobicContact CG1-CE1 4.44Å; I365-F507 HydrophobicContact CG1-CD1 4.46Å; R366-F507 WeakPolarHBondContact CG-O 3.48Å; L408-F507 HydrophobicContact CD2-CE2 3.83Å; L408-F507 HydrophobicContact CD2-CZ 3.92Å; F410-F507 HydrophobicContact CD1-CZ 4.33Å; F410-F507 HydrophobicContact CE1-CZ 4.43Å; M461-F507 HydrophobicContact CE-CE2 4.43Å; M461-F507 HydrophobicContact SD-CE2 3.96Å; M461-F507 HydrophobicContact SD-CZ 4.47Å; I503-F507 HydrophobicContact CB-CD2 4.44Å; I503-F507 HydrophobicContact CG2-CB 4.16Å; I503-F507 HydrophobicContact CG2-CD2 3.96Å; I503-F507 HydrophobicContact CG2-CG 4.49Å; I503-F507 WeakPolarHBondContact O-CD2 3.48Å; I503-F507 PolarHBondContact O-N 3.49Å; F507-F509 PolarHBondContact O-N 3.19Å; F507-Y512 HydrophobicContact CB-CD2 4.19Å; F507-Y512 HydrophobicContact CB-CG 4.42Å; F507-Y512 AromaticContact CD1-CD2 3.89Å; F507-Y512 HydrophobicContact CD1-CD2 3.89Å; F507-Y512 AromaticContact CD2-CD2 3.61Å; F507-Y512 HydrophobicContact CD2-CD2 3.61Å; F507-Y512 HydrophobicContact CD2-CE2 4.06Å; F507-Y512 HydrophobicContact CD2-CG 4.35Å; F507-Y512 HydrophobicContact CE1-CD2 4.07Å; F507-Y512 HydrophobicContact CE1-CE2 4.36Å; F507-Y512 AromaticContact CE2-CD2 3.82Å; F507-Y512 HydrophobicContact CE2-CD2 3.82Å; F507-Y512 AromaticContact CE2-CE2 3.8Å; F507-Y512 HydrophobicContact CE2-CE2 3.8Å; F507-Y512 AromaticContact CG-CD2 3.63Å; F507-Y512 HydrophobicContact CG-CD2 3.63Å; F507-Y512 HydrophobicContact CG-CE2 4.44Å; F507-Y512 HydrophobicContact CG-CG 4.31Å; F507-Y512 HydrophobicContact CZ-CD2 4.02Å; F507-Y512 AromaticContact CZ-CE2 3.94Å; F507-Y512 HydrophobicContact CZ-CE2 3.94Å
508	D	94.1	Very high	92.7	Very high	60 Å²	60	59.7 Å²	59.7	32%	0.321	28%	0.275	S	S	.	.			trans	-66.5	119.4	153.2	178.2	-65.6	0	0	0	108.2	I364 R510 L511 Y512	I364-D508 PolarHBondContact O-N 3.22Å; I364-D508 VanDerWaalsContact O-N 3.1Å; D508-R510 PolarHBondContact O-N 3.38Å; D508-R510 VanDerWaalsContact OD1-CA 3.27Å; D508-R510 WeakPolarHBondContact OD1-CA 3.49Å; D508-R510 WeakPolarHBondContact OD1-CB 3.38Å; D508-R510 PolarHBondContact OD1-N 3.15Å; D508-L511 HydrophobicContact CB-CB 4.06Å; D508-L511 HydrophobicContact CB-CD1 4.01Å; D508-L511 HydrophobicContact CB-CG 3.92Å; D508-L511 PolarHBondContact O-N 3.23Å; D508-L511 PolarHBondContact OD1-N 3.17Å; D508-Y512 WeakPolarHBondContact O-CB 3.26Å; D508-Y512 PolarHBondContact O-N 3.14Å
509	F	92.2	Very high	92.1	Very high	64 Å²	64	55 Å²	55	28%	0.281	25%	0.253	S	S	.	.	H	α-helix	trans	-63.4	-27.5	-175.5	-178.2	-101.4	0	0	0	113.6	K500 I503 E504 F507 R513	K500-F509 HydrophobicContact CB-CE2 4.21Å; K500-F509 HydrophobicContact CD-CE1 4.43Å; K500-F509 HydrophobicContact CD-CE2 4.03Å; K500-F509 HydrophobicContact CD-CZ 3.91Å; K500-F509 HydrophobicContact CG-CD2 4.12Å; K500-F509 HydrophobicContact CG-CE2 3.69Å; K500-F509 HydrophobicContact CG-CZ 4.11Å; I503-F509 HydrophobicContact CB-CD2 4.31Å; I503-F509 HydrophobicContact CG2-CD2 3.74Å; I503-F509 HydrophobicContact CG2-CE2 4.47Å; E504-F509 HydrophobicContact CG-CB 3.82Å; E504-F509 HydrophobicContact CG-CD2 4.14Å; E504-F509 HydrophobicContact CG-CG 4.18Å; F507-F509 PolarHBondContact O-N 3.19Å; F509-R513 WeakPolarHBondContact O-CB 3.47Å; F509-R513 PolarHBondContact O-N 3.26Å; F509-R513 VanDerWaalsContact O-N 3.12Å
510	R	91.8	Very high	91.3	Very high	203 Å²	203	61.7 Å²	61.7	77%	0.766	28%	0.284	S	S	*	.	H	α-helix	trans	-75.9	-47.6	177.2	-55.3	171.1	60.2	-169.3	-3.7	110.3	D508 R513 L514	D508-R510 PolarHBondContact O-N 3.38Å; D508-R510 VanDerWaalsContact OD1-CA 3.27Å; D508-R510 WeakPolarHBondContact OD1-CA 3.49Å; D508-R510 WeakPolarHBondContact OD1-CB 3.38Å; D508-R510 PolarHBondContact OD1-N 3.15Å; R510-R513 PolarHBondContact O-N 3.02Å; R510-L514 WeakPolarHBondContact O-CB 3.49Å; R510-L514 PolarHBondContact O-N 2.84Å
511	L	92.3	Very high	90.5	Very high	40 Å²	40	60 Å²	60	21%	0.209	28%	0.282	C	S	.	.	H	α-helix	trans	-64.1	-43.3	176.9	-59.5	-174	0	0	0	110.8	I364 D508 R513 L514 W515 L530	I364-L511 HydrophobicContact CB-CB 3.82Å; I364-L511 HydrophobicContact CG2-CB 3.79Å; D508-L511 HydrophobicContact CB-CB 4.06Å; D508-L511 HydrophobicContact CB-CD1 4.01Å; D508-L511 HydrophobicContact CB-CG 3.92Å; D508-L511 PolarHBondContact O-N 3.23Å; D508-L511 PolarHBondContact OD1-N 3.17Å; L511-R513 PolarHBondContact O-N 3.1Å; L511-L514 PolarHBondContact O-N 3.44Å; L511-W515 WeakPolarHBondContact O-CB 3.45Å; L511-W515 PolarHBondContact O-N 3.37Å; L511-L530 HydrophobicContact CD2-CD2 3.92Å
512	Y	92.9	Very high	89.2	Confident	6 Å²	6	64.3 Å²	64.3	2%	0.024	30%	0.299	C	S	.	.	H	α-helix	trans	-56.1	-49.5	172.8	-173.7	-86.9	0	0	0	111.8	I364 F410 M461 I503 F507 D508 L514 W515 K516	I364-Y512 HydrophobicContact CD1-CD2 3.99Å; F410-Y512 HydrophobicContact CE1-CE2 4.27Å; M461-Y512 HydrophobicContact CE-CE1 4.12Å; M461-Y512 HydrophobicContact CE-CE2 3.85Å; M461-Y512 VanDerWaalsContact CE-CZ 3.43Å; M461-Y512 WeakPolarHBondContact CE-OH 3.46Å; M461-Y512 HydrophobicContact SD-CE2 4.41Å; I503-Y512 HydrophobicContact CD1-CD1 4.07Å; I503-Y512 HydrophobicContact CD1-CE1 3.88Å; I503-Y512 HydrophobicContact CG1-CD1 4.42Å; I503-Y512 HydrophobicContact CG1-CE1 4.34Å; I503-Y512 HydrophobicContact CG2-CD1 3.89Å; I503-Y512 HydrophobicContact CG2-CD2 4.33Å; I503-Y512 HydrophobicContact CG2-CG 3.77Å; F507-Y512 HydrophobicContact CB-CD2 4.19Å; F507-Y512 HydrophobicContact CB-CG 4.42Å; F507-Y512 AromaticContact CD1-CD2 3.89Å; F507-Y512 HydrophobicContact CD1-CD2 3.89Å; F507-Y512 AromaticContact CD2-CD2 3.61Å; F507-Y512 HydrophobicContact CD2-CD2 3.61Å; F507-Y512 HydrophobicContact CD2-CE2 4.06Å; F507-Y512 HydrophobicContact CD2-CG 4.35Å; F507-Y512 HydrophobicContact CE1-CD2 4.07Å; F507-Y512 HydrophobicContact CE1-CE2 4.36Å; F507-Y512 AromaticContact CE2-CD2 3.82Å; F507-Y512 HydrophobicContact CE2-CD2 3.82Å; F507-Y512 AromaticContact CE2-CE2 3.8Å; F507-Y512 HydrophobicContact CE2-CE2 3.8Å; F507-Y512 AromaticContact CG-CD2 3.63Å; F507-Y512 HydrophobicContact CG-CD2 3.63Å; F507-Y512 HydrophobicContact CG-CE2 4.44Å; F507-Y512 HydrophobicContact CG-CG 4.31Å; F507-Y512 HydrophobicContact CZ-CD2 4.02Å; F507-Y512 AromaticContact CZ-CE2 3.94Å; F507-Y512 HydrophobicContact CZ-CE2 3.94Å; D508-Y512 WeakPolarHBondContact O-CB 3.26Å; D508-Y512 PolarHBondContact O-N 3.14Å; Y512-L514 VanDerWaalsContact C-N 3.29Å; Y512-L514 PolarHBondContact O-N 2.96Å; Y512-W515 HydrophobicContact CD2-CE3 4.43Å; Y512-W515 HydrophobicContact CE2-CE3 4.15Å; Y512-W515 AromaticContact CE2-CZ3 3.94Å; Y512-W515 HydrophobicContact CE2-CZ3 3.94Å; Y512-W515 PolarHBondContact O-N 2.89Å; Y512-K516 HydrophobicContact CD1-CB 4.47Å; Y512-K516 HydrophobicContact CE1-CB 4.15Å; Y512-K516 HydrophobicContact CE1-CD 3.99Å; Y512-K516 HydrophobicContact CE1-CG 4.2Å; Y512-K516 VanDerWaalsContact O-CB 3.23Å; Y512-K516 WeakPolarHBondContact O-CB 3.49Å; Y512-K516 PolarHBondContact O-N 3.07Å; Y512-K516 PolarHBondContact OH-NZ 3.11Å
513	R	91.8	Very high	87.1	Confident	181 Å²	181	70.6 Å²	70.6	68%	0.683	33%	0.332	S	S	*	.	H	α-helix	trans	-64.2	-35.7	-179.6	-159.5	-177.6	87.3	177	6.3	112.2	F509 R510 L511 S517	F509-R513 WeakPolarHBondContact O-CB 3.47Å; F509-R513 PolarHBondContact O-N 3.26Å; F509-R513 VanDerWaalsContact O-N 3.12Å; R510-R513 PolarHBondContact O-N 3.02Å; L511-R513 PolarHBondContact O-N 3.1Å; R513-S517 PolarHBondContact O-N 3.29Å; R513-S517 VanDerWaalsContact O-N 3.12Å
514	L	90.9	Very high	85	Confident	54 Å²	54	74.9 Å²	74.9	28%	0.283	35%	0.354	S	S	.	.	H	α-helix	trans	-66.7	-51.9	175.9	-178.3	58	0	0	0	111.5	R510 L511 Y512 K516 S517 R518 V529	R510-L514 WeakPolarHBondContact O-CB 3.49Å; R510-L514 PolarHBondContact O-N 2.84Å; L511-L514 PolarHBondContact O-N 3.44Å; Y512-L514 VanDerWaalsContact C-N 3.29Å; Y512-L514 PolarHBondContact O-N 2.96Å; L514-K516 PolarHBondContact O-N 3.01Å; L514-S517 PolarHBondContact O-N 3.27Å; L514-S517 PolarHBondContact O-OG 3.3Å; L514-R518 PolarHBondContact O-N 3.39Å; L514-V529 HydrophobicContact CD2-CG1 3.83Å
515	W	90.8	Very high	83.1	Confident	0 Å²	0	77.1 Å²	77.1	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-56.1	-47.8	174.4	171.1	91.1	0	0	0	111.3	V355 P356 K357 I361 I364 F410 L511 Y512 S517 R518 Q519 F526	V355-W515 HydrophobicContact CG1-CH2 3.77Å; V355-W515 HydrophobicContact CG1-CZ2 4.01Å; P356-W515 WeakPolarHBondContact O-CZ2 3.46Å; K357-W515 PolarHBondContact O-NE1 3.02Å; I361-W515 HydrophobicContact CD1-CH2 3.98Å; I361-W515 HydrophobicContact CD1-CZ2 3.62Å; I361-W515 HydrophobicContact CG1-CH2 4.3Å; I361-W515 HydrophobicContact CG1-CZ2 3.61Å; I364-W515 HydrophobicContact CD1-CB 3.97Å; I364-W515 HydrophobicContact CD1-CD2 3.97Å; I364-W515 HydrophobicContact CD1-CE3 4.14Å; I364-W515 HydrophobicContact CD1-CG 3.89Å; I364-W515 HydrophobicContact CG2-CB 4.32Å; F410-W515 AromaticContact CE1-CH2 3.83Å; F410-W515 HydrophobicContact CE1-CH2 3.83Å; F410-W515 HydrophobicContact CE1-CZ3 4.1Å; F410-W515 AromaticContact CZ-CH2 3.63Å; F410-W515 HydrophobicContact CZ-CH2 3.63Å; F410-W515 AromaticContact CZ-CZ3 3.95Å; F410-W515 HydrophobicContact CZ-CZ3 3.95Å; L511-W515 WeakPolarHBondContact O-CB 3.45Å; L511-W515 PolarHBondContact O-N 3.37Å; Y512-W515 HydrophobicContact CD2-CE3 4.43Å; Y512-W515 HydrophobicContact CE2-CE3 4.15Å; Y512-W515 AromaticContact CE2-CZ3 3.94Å; Y512-W515 HydrophobicContact CE2-CZ3 3.94Å; Y512-W515 PolarHBondContact O-N 2.89Å; W515-S517 VanDerWaalsContact C-N 3.27Å; W515-S517 PolarHBondContact O-N 3.07Å; W515-R518 CarbonylContact O-C 3.53Å; W515-R518 WeakPolarHBondContact O-CA 3.47Å; W515-R518 PolarHBondContact O-N 3.47Å; W515-Q519 PolarHBondContact O-N 2.92Å; W515-F526 HydrophobicContact CB-CE1 4.17Å; W515-F526 HydrophobicContact CB-CZ 4.47Å; W515-F526 AromaticContact CD1-CE1 4Å; W515-F526 AromaticContact CD1-CZ 3.89Å; W515-F526 HydrophobicContact CG-CE1 4.45Å; W515-F526 HydrophobicContact CG-CZ 4.43Å
516	K	90.1	Very high	81.1	Confident	49 Å²	49	75.1 Å²	75.1	21%	0.213	36%	0.356	C	S	.	.	H	α-helix	trans	-58.7	-36.5	178.3	-162.2	72.9	171	-156.3	0	112.8	E494 Y512 L514 R518 Q519	E494-K516 IonicContact OE1-NZ 3.63Å; E494-K516 PolarHBondContact OE1-NZ 3.12Å; E494-K516 WeakPolarHBondContact OE2-CE 3.45Å; E494-K516 IonicContact OE2-NZ 3.82Å; E494-K516 PolarHBondContact OE2-NZ 2.88Å; Y512-K516 HydrophobicContact CD1-CB 4.47Å; Y512-K516 HydrophobicContact CE1-CB 4.15Å; Y512-K516 HydrophobicContact CE1-CD 3.99Å; Y512-K516 HydrophobicContact CE1-CG 4.2Å; Y512-K516 VanDerWaalsContact O-CB 3.23Å; Y512-K516 WeakPolarHBondContact O-CB 3.49Å; Y512-K516 PolarHBondContact O-N 3.07Å; Y512-K516 PolarHBondContact OH-NZ 3.11Å; L514-K516 PolarHBondContact O-N 3.01Å; K516-R518 VanDerWaalsContact C-N 3.27Å; K516-R518 PolarHBondContact O-N 2.86Å; K516-Q519 WeakPolarHBondContact O-CG 3.46Å
517	S	88.1	Confident	79.1	Confident	89 Å²	89	80.7 Å²	80.7	62%	0.622	39%	0.386	S	S	*	.	H	α-helix	trans	-70.1	-22.2	175.2	78	0	0	0	0	113.9	R513 L514 W515	R513-S517 PolarHBondContact O-N 3.29Å; R513-S517 VanDerWaalsContact O-N 3.12Å; L514-S517 PolarHBondContact O-N 3.27Å; L514-S517 PolarHBondContact O-OG 3.3Å; W515-S517 VanDerWaalsContact C-N 3.27Å; W515-S517 PolarHBondContact O-N 3.07Å
518	R	85.6	Confident	77.2	Confident	53 Å²	53	87.5 Å²	87.5	20%	0.2	42%	0.422	C	S	.	.	H	α-helix	trans	-111.9	-5.4	-173.9	-69.9	-178.4	179.1	-164.6	2.5	114.4	L514 W515 K516 H520 S521 F526	L514-R518 PolarHBondContact O-N 3.39Å; W515-R518 CarbonylContact O-C 3.53Å; W515-R518 WeakPolarHBondContact O-CA 3.47Å; W515-R518 PolarHBondContact O-N 3.47Å; K516-R518 VanDerWaalsContact C-N 3.27Å; K516-R518 PolarHBondContact O-N 2.86Å; R518-H520 PolarHBondContact O-N 3.39Å; R518-S521 WeakPolarHBondContact O-CB 3.42Å; R518-S521 PolarHBondContact O-N 2.92Å; R518-F526 HydrophobicContact CB-CE1 4.23Å; R518-F526 HydrophobicContact CB-CE2 4.07Å; R518-F526 HydrophobicContact CB-CZ 3.48Å; R518-F526 VanDerWaalsContact CB-CZ 3.48Å
519	Q	80	Confident	75.4	Confident	31 Å²	31	87.5 Å²	87.5	15%	0.145	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-24.2	-178.6	75.8	180	-6	0	0	113.9	P356 W515 K516	P356-Q519 HydrophobicContact CB-CB 4.3Å; W515-Q519 PolarHBondContact O-N 2.92Å; K516-Q519 WeakPolarHBondContact O-CG 3.46Å
520	H	77.3	Confident	73.3	Confident	141 Å²	141	87.8 Å²	87.8	65%	0.653	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	5	176.2	-56	-43.9	0	0	0	113.5	R518	R518-H520 PolarHBondContact O-N 3.39Å
521	S	77.5	Confident	72.4	Confident	45 Å²	45	82 Å²	82	32%	0.315	41%	0.411	S	S	.	.			trans	-76.1	128.4	177	-171.2	0	0	0	0	110.6	K357 R518 L523	K357-S521 PolarHBondContact NZ-O 3.24Å; R518-S521 WeakPolarHBondContact O-CB 3.42Å; R518-S521 PolarHBondContact O-N 2.92Å; S521-L523 VanDerWaalsContact C-N 3.28Å; S521-L523 WeakPolarHBondContact CB-O 3.43Å; S521-L523 PolarHBondContact OG-N 3.09Å; S521-L523 PolarHBondContact OG-O 3.29Å
522	K	65.3	Low	71.4	Confident	213 Å²	213	84.2 Å²	84.2	93%	0.926	42%	0.422	S	S	*	.	S	Bend	trans	-80.8	-7.9	169.4	-63.7	-171.1	176.5	-170.7	0	113.5
523	L	52.8	Low	70.2	Confident	138 Å²	138	88.6 Å²	88.6	72%	0.723	44%	0.444	S	S	*	.	S	Bend	trans	-119	150.6	179.5	-70.2	167.8	0	0	0	109.5	S521	S521-L523 VanDerWaalsContact C-N 3.28Å; S521-L523 WeakPolarHBondContact CB-O 3.43Å; S521-L523 PolarHBondContact OG-N 3.09Å; S521-L523 PolarHBondContact OG-O 3.29Å
524	L	51.4	Low	68.9	Low	93 Å²	93	83.1 Å²	83.1	49%	0.487	43%	0.43	S	S	.	.			trans	70	107.1	-167.8	-51	176.3	0	0	0	112.9
525	D	53.4	Low	67.5	Low	113 Å²	113	84.9 Å²	84.9	60%	0.604	44%	0.439	S	S	*	.			trans	-54.1	151.9	147.7	-47.5	-74.4	0	0	0	109.1
526	F	52.3	Low	66	Low	3 Å²	3	90.6 Å²	90.6	1%	0.013	47%	0.468	C	S	.	.	S	Bend	trans	-90	-14	-175.4	-92.3	-92.3	0	0	0	113.1	K357 Y360 W515 R518 D528 V529 L530	K357-F526 HydrophobicContact CD-CD2 4.02Å; K357-F526 HydrophobicContact CD-CE2 3.48Å; K357-F526 VanDerWaalsContact CD-CE2 3.48Å; K357-F526 HydrophobicContact CD-CZ 4.48Å; Y360-F526 HydrophobicContact CD1-CB 3.52Å; Y360-F526 HydrophobicContact CD1-CG 4.25Å; Y360-F526 HydrophobicContact CD2-CB 4.25Å; Y360-F526 HydrophobicContact CD2-CD2 4.1Å; Y360-F526 HydrophobicContact CD2-CG 4.32Å; Y360-F526 HydrophobicContact CE1-CB 3.45Å; Y360-F526 VanDerWaalsContact CE1-CB 3.45Å; Y360-F526 HydrophobicContact CE1-CG 4.47Å; Y360-F526 HydrophobicContact CE2-CB 4.18Å; Y360-F526 HydrophobicContact CE2-CD2 4.2Å; Y360-F526 HydrophobicContact CG-CB 3.93Å; Y360-F526 HydrophobicContact CG-CD2 4.39Å; Y360-F526 HydrophobicContact CG-CG 4.16Å; W515-F526 HydrophobicContact CB-CE1 4.17Å; W515-F526 HydrophobicContact CB-CZ 4.47Å; W515-F526 AromaticContact CD1-CE1 4Å; W515-F526 AromaticContact CD1-CZ 3.89Å; W515-F526 HydrophobicContact CG-CE1 4.45Å; W515-F526 HydrophobicContact CG-CZ 4.43Å; R518-F526 HydrophobicContact CB-CE1 4.23Å; R518-F526 HydrophobicContact CB-CE2 4.07Å; R518-F526 HydrophobicContact CB-CZ 3.48Å; R518-F526 VanDerWaalsContact CB-CZ 3.48Å; F526-D528 VanDerWaalsContact C-N 3.26Å; F526-D528 PolarHBondContact O-N 3.33Å; F526-V529 PolarHBondContact O-N 3.31Å; F526-L530 HydrophobicContact CB-CD1 4.3Å; F526-L530 HydrophobicContact CD1-CD1 3.54Å; F526-L530 HydrophobicContact CD1-CG 4.07Å; F526-L530 HydrophobicContact CE1-CD1 4.27Å; F526-L530 HydrophobicContact CG-CD1 4.34Å; F526-L530 PolarHBondContact O-N 3.33Å
527	D	55.9	Low	64.3	Low	118 Å²	118	93.6 Å²	93.6	63%	0.631	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-22.8	-171.5	-47.5	-59	0	0	0	112.9	Y360 V529	Y360-D527 WeakPolarHBondContact CE1-OD1 3.48Å; D527-V529 VanDerWaalsContact C-N 3.28Å; D527-V529 PolarHBondContact O-N 3.27Å
528	D	54.4	Low	62.4	Low	144 Å²	144	93.9 Å²	93.9	77%	0.77	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-7.4	173.2	-80	-22.2	0	0	0	114	F526	F526-D528 VanDerWaalsContact C-N 3.26Å; F526-D528 PolarHBondContact O-N 3.33Å
529	V	56	Low	60.5	Low	60 Å²	60	97.3 Å²	97.3	36%	0.364	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.3	-4.5	-159.4	-169.9	0	0	0	0	116.4	L514 F526 D527	L514-V529 HydrophobicContact CD2-CG1 3.83Å; F526-V529 PolarHBondContact O-N 3.31Å; D527-V529 VanDerWaalsContact C-N 3.28Å; D527-V529 PolarHBondContact O-N 3.27Å
530	L	49.7	Very low	58.7	Low	69 Å²	69	103.4 Å²	103.4	36%	0.361	53%	0.531	S	S	.	.			trans	-123.7	0	-175.8	-67.9	-175.3	0	0	0	115	T363 I364 R367 L511 F526	T363-L530 VanDerWaalsContact OG1-CD1 3.27Å; T363-L530 WeakPolarHBondContact OG1-CD1 3.44Å; I364-L530 HydrophobicContact CG2-CD1 3.82Å; I364-L530 HydrophobicContact CG2-CD2 4.06Å; R367-L530 PolarHBondContact NH2-O 3.32Å; L511-L530 HydrophobicContact CD2-CD2 3.92Å; F526-L530 HydrophobicContact CB-CD1 4.3Å; F526-L530 HydrophobicContact CD1-CD1 3.54Å; F526-L530 HydrophobicContact CD1-CG 4.07Å; F526-L530 HydrophobicContact CE1-CD1 4.27Å; F526-L530 HydrophobicContact CG-CD1 4.34Å; F526-L530 PolarHBondContact O-N 3.33Å

Retrieved 530 of 530 residues in 210.2 ms (Link to these results)

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