A0A3Q0KD94_SCHMA Loading...

Serine/threonine-protein kinase RIO1

AlphaFold DB , UniProt , Accession A0A3Q0KD94, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 470 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.4	Very low	34.8	Very low	249 Å²	249	153.5 Å²	153.5	100%	1.227	85%	0.847	S	S	*	*				0	121.8	0	-76.1	178.5	-172.3	0	0	107.7
2	T	30.8	Very low	35	Very low	125 Å²	125	151.8 Å²	151.8	77%	0.767	83%	0.834	S	S	*	*			trans	-109.3	159.1	-159.7	27.8	0	0	0	0	110.5
3	L	29.8	Very low	35.1	Very low	170 Å²	170	156.6 Å²	156.6	89%	0.89	83%	0.833	S	S	*	*			trans	77.9	142.9	161	-58.8	151.8	0	0	0	115.4
4	S	32	Very low	35.4	Very low	101 Å²	101	151.9 Å²	151.9	71%	0.706	82%	0.819	S	S	*	*			cis	-165.4	142.7	2.4	106.8	0	0	0	0	107.7
5	I	29.6	Very low	35.9	Very low	170 Å²	170	147 Å²	147	87%	0.872	80%	0.8	S	S	*	*			trans	-85.3	129.1	166.8	-68.9	165.6	0	0	0	107.8
6	S	35.3	Very low	36.1	Very low	111 Å²	111	144.7 Å²	144.7	78%	0.776	79%	0.786	S	S	*	*			trans	-106.8	117.1	166.9	-177.6	0	0	0	0	110.1
7	S	34.2	Very low	36.4	Very low	102 Å²	102	143.8 Å²	143.8	71%	0.713	78%	0.781	S	S	*	*			trans	-69.7	128.6	175.9	51.2	0	0	0	0	112.3
8	R	37.1	Very low	36.8	Very low	238 Å²	238	144.6 Å²	144.6	90%	0.898	78%	0.779	S	S	*	*			trans	-155.4	18.9	162.9	-123.1	175	-168.8	-156.2	1.8	118.4
9	T	39.3	Very low	37.3	Very low	129 Å²	129	140.6 Å²	140.6	79%	0.791	77%	0.767	S	S	*	*	S	Bend	trans	-131.1	7.8	-175.2	48.1	0	0	0	0	117.1
10	M	37	Very low	37.5	Very low	182 Å²	182	143.2 Å²	143.2	90%	0.897	77%	0.766	S	S	*	*	S	Bend	trans	-105.3	-3.8	-174.9	-88.5	-168.5	-174.1	0	0	117.2
11	S	40.7	Very low	37.8	Very low	111 Å²	111	143.1 Å²	143.1	78%	0.776	77%	0.766	S	S	*	*	S	Bend	trans	-98	-0.5	-172.6	70.2	0	0	0	0	116.5
12	L	37.4	Very low	38.1	Very low	133 Å²	133	138 Å²	138	70%	0.696	74%	0.744	S	S	*	*	S	Bend	trans	-98.5	-1.2	-179	-99.9	158.4	0	0	0	114.4
13	W	36	Very low	38.4	Very low	215 Å²	215	139.5 Å²	139.5	81%	0.814	75%	0.746	S	S	*	*	S	Bend	trans	-107.8	-10	-171.5	-73.7	77	0	0	0	114.5
14	S	39.6	Very low	38.9	Very low	91 Å²	91	138.4 Å²	138.4	64%	0.636	74%	0.742	S	S	*	*	S	Bend	trans	-91.8	-10.4	175	84.8	0	0	0	0	114.1
15	S	42.9	Very low	39	Very low	78 Å²	78	141.7 Å²	141.7	55%	0.545	75%	0.75	S	S	.	*	S	Bend	trans	-92.7	-2	-178.9	87.1	0	0	0	0	114.2
16	L	39.3	Very low	39.4	Very low	110 Å²	110	137.4 Å²	137.4	58%	0.576	74%	0.735	S	S	*	*	S	Bend	trans	-96.6	-21.8	178.4	-104.3	95.5	0	0	0	113.4
17	D	41	Very low	39.3	Very low	129 Å²	129	141.2 Å²	141.2	69%	0.69	74%	0.741	S	S	*	*	S	Bend	trans	-79.7	-25.4	-179.5	-80.5	-18.3	0	0	0	112.7
18	E	43.1	Very low	39.4	Very low	159 Å²	159	141.4 Å²	141.4	74%	0.743	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-8.6	176.7	-71.1	-177.5	166.2	0	0	114	Y20	E18-Y20 VanDerWaalsContact C-N 3.35Å
19	A	46	Very low	39.2	Very low	68 Å²	68	138.3 Å²	138.3	56%	0.562	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-6.1	179	0	0	0	0	0	113.7
20	Y	42.2	Very low	39.3	Very low	192 Å²	192	134 Å²	134	75%	0.753	73%	0.725	S	S	*	*	S	Bend	trans	-92.1	-9.2	-177.5	-91.6	-86	0	0	0	114.7	E18	E18-Y20 VanDerWaalsContact C-N 3.35Å
21	D	44.3	Very low	39.5	Very low	142 Å²	142	133.6 Å²	133.6	76%	0.759	72%	0.721	S	S	*	*	S	Bend	trans	-106.2	7	-173.4	-76.1	-20.8	0	0	0	115
22	N	41.8	Very low	39.8	Very low	142 Å²	142	131.3 Å²	131.3	76%	0.759	71%	0.705	S	S	*	*			trans	-134.6	55.9	-176.5	-74.8	-47.2	0	0	0	114.2
23	L	38.4	Very low	40.4	Very low	156 Å²	156	128.5 Å²	128.5	82%	0.817	69%	0.691	S	S	*	*			trans	-115.6	101.7	167	-88.3	158.1	0	0	0	110.4
24	D	39	Very low	41.7	Very low	148 Å²	148	123.8 Å²	123.8	79%	0.791	68%	0.681	S	S	*	*			trans	-58.3	128.1	177.8	-152.9	-2.3	0	0	0	111.1
25	L	34.2	Very low	42.9	Very low	170 Å²	170	122.1 Å²	122.1	89%	0.89	67%	0.673	S	S	*	*			trans	-101.5	80.9	179.4	-74.8	170.3	0	0	0	108.5
26	S	37.9	Very low	43.9	Very low	79 Å²	79	119.6 Å²	119.6	55%	0.552	65%	0.654	S	S	*	*			trans	-143.8	121.6	166.1	64.9	0	0	0	0	111.1
27	E	33.6	Very low	45.1	Very low	192 Å²	192	118.5 Å²	118.5	90%	0.897	65%	0.645	S	S	*	*			trans	78.6	102.9	155.9	-58.1	178.9	175.8	0	0	117.8
28	S	36.4	Very low	46.1	Very low	106 Å²	106	116.2 Å²	116.2	74%	0.741	63%	0.632	S	S	*	*			trans	150.5	94.8	130.3	-178.7	0	0	0	0	112.6	G30	S28-G30 PolarHBondContact O-N 3.09Å
29	D	34	Very low	47.3	Very low	172 Å²	172	114.2 Å²	114.2	92%	0.92	62%	0.619	S	S	*	*	S	Bend	trans	43	43.8	140.8	-53.1	-22.8	0	0	0	120.4
30	G	41.4	Very low	48.1	Very low	39 Å²	39	111.9 Å²	111.9	40%	0.402	60%	0.596	S	S	.	*			trans	-148.7	15.1	175.8	0	0	0	0	0	116.9	S28 S32	S28-G30 PolarHBondContact O-N 3.09Å; G30-S32 PolarHBondContact O-N 3.43Å
31	E	40.4	Very low	49	Very low	173 Å²	173	107.4 Å²	107.4	81%	0.808	58%	0.583	S	S	*	*	H	α-helix	trans	-62.9	-29.9	-163.8	-72.2	-174.4	145.8	0	0	116	A35	E31-A35 PolarHBondContact O-N 3.36Å; E31-A35 VanDerWaalsContact O-N 3.15Å
32	S	47.6	Very low	49.7	Very low	64 Å²	64	106 Å²	106	45%	0.448	57%	0.569	S	S	.	*	H	α-helix	trans	-69.8	-44.7	-175.5	57.6	0	0	0	0	113.7	G30 N34 A35 T36 E89	G30-S32 PolarHBondContact O-N 3.43Å; S32-N34 VanDerWaalsContact C-N 3.26Å; S32-N34 PolarHBondContact O-N 3.31Å; S32-A35 PolarHBondContact O-N 2.89Å; S32-T36 PolarHBondContact O-N 2.94Å; S32-T36 PolarHBondContact O-OG1 3.01Å; S32-E89 WeakPolarHBondContact CB-OE1 3.45Å; S32-E89 PolarHBondContact OG-OE1 2.87Å
33	N	49.7	Very low	50.5	Low	74 Å²	74	102 Å²	102	40%	0.396	55%	0.545	S	S	.	.	H	α-helix	trans	-61.8	-38.5	-179.7	-82.9	-57.4	0	0	0	111.2	K37 E89	N33-K37 PolarHBondContact O-N 3.3Å; N33-E89 PolarHBondContact N-OE1 2.87Å; N33-E89 PolarHBondContact ND2-OE1 3.4Å; N33-E89 WeakPolarHBondContact OD1-CG 3.29Å; N33-E89 PolarHBondContact OD1-OE1 3.18Å; N33-E89 VanDerWaalsContact OD1-OE1 3.06Å
34	N	62.4	Low	51.2	Low	115 Å²	115	99.5 Å²	99.5	62%	0.615	53%	0.53	S	S	*	.	H	α-helix	trans	-75	-38.2	-178.9	-133.4	2.6	0	0	0	111.3	S32 T36 K37 L38	S32-N34 VanDerWaalsContact C-N 3.26Å; S32-N34 PolarHBondContact O-N 3.31Å; N34-T36 PolarHBondContact O-N 3.37Å; N34-K37 PolarHBondContact O-N 3.04Å; N34-L38 WeakPolarHBondContact O-CB 3.42Å; N34-L38 PolarHBondContact O-N 3.36Å
35	A	65.2	Low	51.6	Low	57 Å²	57	95.7 Å²	95.7	47%	0.471	52%	0.515	S	S	.	.	H	α-helix	trans	-61.4	-43.2	178.6	0	0	0	0	0	112.9	E31 S32 L38 Y39	E31-A35 PolarHBondContact O-N 3.36Å; E31-A35 VanDerWaalsContact O-N 3.15Å; S32-A35 PolarHBondContact O-N 2.89Å; A35-L38 PolarHBondContact O-N 3.5Å; A35-Y39 VanDerWaalsContact O-CB 3.29Å; A35-Y39 WeakPolarHBondContact O-CB 3.47Å; A35-Y39 PolarHBondContact O-N 3.35Å
36	T	63.8	Low	52.4	Low	24 Å²	24	95.3 Å²	95.3	15%	0.147	51%	0.506	C	S	.	.	H	α-helix	trans	-67	-44.4	178.7	-56.7	0	0	0	0	111.5	S32 N34 L38 Y39 M40 V90	S32-T36 PolarHBondContact O-N 2.94Å; S32-T36 PolarHBondContact O-OG1 3.01Å; N34-T36 PolarHBondContact O-N 3.37Å; T36-L38 VanDerWaalsContact C-N 3.32Å; T36-L38 PolarHBondContact O-N 3.48Å; T36-Y39 PolarHBondContact O-N 3.49Å; T36-M40 WeakPolarHBondContact O-CG 3.5Å; T36-M40 PolarHBondContact O-N 3.01Å; T36-V90 HydrophobicContact CG2-CB 3.98Å; T36-V90 HydrophobicContact CG2-CG2 4.11Å
37	K	64.8	Low	52.6	Low	88 Å²	88	93 Å²	93	38%	0.383	49%	0.489	S	S	.	.	H	α-helix	trans	-62.4	-43.8	176.7	-161.3	172.8	-178.5	178.4	0	110.8	N33 N34 M40 Q41 F79 M82	N33-K37 PolarHBondContact O-N 3.3Å; N34-K37 PolarHBondContact O-N 3.04Å; K37-M40 PolarHBondContact O-N 3.36Å; K37-Q41 WeakPolarHBondContact O-CB 3.37Å; K37-Q41 PolarHBondContact O-N 2.78Å; K37-F79 HydrophobicContact CG-CE2 4.4Å; K37-M82 HydrophobicContact CB-CE 3.45Å; K37-M82 VanDerWaalsContact CB-CE 3.45Å; K37-M82 HydrophobicContact CB-SD 4.49Å; K37-M82 HydrophobicContact CD-CE 4.26Å; K37-M82 HydrophobicContact CG-CE 3.79Å
38	L	62.6	Low	52.8	Low	81 Å²	81	90.1 Å²	90.1	42%	0.424	48%	0.479	S	S	.	.	H	α-helix	trans	-67.1	-35.2	177	-164.2	76.7	0	0	0	111.5	N34 A35 T36 Q41 K42	N34-L38 WeakPolarHBondContact O-CB 3.42Å; N34-L38 PolarHBondContact O-N 3.36Å; A35-L38 PolarHBondContact O-N 3.5Å; T36-L38 VanDerWaalsContact C-N 3.32Å; T36-L38 PolarHBondContact O-N 3.48Å; L38-Q41 PolarHBondContact O-N 3.24Å; L38-K42 HydrophobicContact CG-CD 4.39Å; L38-K42 HydrophobicContact CG-CG 4.5Å; L38-K42 WeakPolarHBondContact O-CA 3.39Å; L38-K42 WeakPolarHBondContact O-CB 3.47Å; L38-K42 WeakPolarHBondContact O-CG 3.43Å; L38-K42 PolarHBondContact O-N 3.31Å
39	Y	66.7	Low	52.6	Low	116 Å²	116	94.8 Å²	94.8	46%	0.455	49%	0.486	S	S	.	.	H	α-helix	trans	-65.4	-50.6	173.4	-178.7	-95	0	0	0	110.5	A35 T36 Q41 K42 F43	A35-Y39 VanDerWaalsContact O-CB 3.29Å; A35-Y39 WeakPolarHBondContact O-CB 3.47Å; A35-Y39 PolarHBondContact O-N 3.35Å; T36-Y39 PolarHBondContact O-N 3.49Å; Y39-Q41 VanDerWaalsContact C-N 3.28Å; Y39-Q41 PolarHBondContact O-N 2.97Å; Y39-K42 PolarHBondContact O-N 3.35Å; Y39-F43 AromaticContact CD1-CD2 3.87Å; Y39-F43 HydrophobicContact CD1-CD2 3.87Å; Y39-F43 HydrophobicContact CD1-CE2 4.12Å; Y39-F43 HydrophobicContact CD2-CD2 4.24Å; Y39-F43 HydrophobicContact CD2-CE2 4.05Å; Y39-F43 AromaticContact CE1-CD2 3.6Å; Y39-F43 HydrophobicContact CE1-CD2 3.6Å; Y39-F43 AromaticContact CE1-CE2 3.46Å; Y39-F43 HydrophobicContact CE1-CE2 3.46Å; Y39-F43 VanDerWaalsContact CE1-CE2 3.46Å; Y39-F43 HydrophobicContact CE1-CZ 4.26Å; Y39-F43 HydrophobicContact CE2-CD2 4.01Å; Y39-F43 AromaticContact CE2-CE2 3.38Å; Y39-F43 HydrophobicContact CE2-CE2 3.38Å; Y39-F43 HydrophobicContact CE2-CZ 4.37Å; Y39-F43 HydrophobicContact CG-CD2 4.19Å; Y39-F43 HydrophobicContact CG-CE2 4.39Å; Y39-F43 AromaticContact CZ-CD2 3.69Å; Y39-F43 AromaticContact CZ-CE2 3.04Å; Y39-F43 AromaticContact CZ-CZ 3.78Å; Y39-F43 WeakPolarHBondContact O-CB 3.37Å; Y39-F43 WeakPolarHBondContact O-CD2 3.26Å; Y39-F43 PolarHBondContact O-N 3.31Å; Y39-F43 WeakPolarHBondContact OH-CE2 3.4Å; Y39-F43 WeakPolarHBondContact OH-CZ 3.49Å
40	M	64.2	Low	52.7	Low	19 Å²	19	89.7 Å²	89.7	9%	0.094	46%	0.464	C	S	.	.	H	α-helix	trans	-59.8	-38.9	175.4	-72.5	-88	101.8	0	0	112	T36 K37 F43 Q44 L78 F79	T36-M40 WeakPolarHBondContact O-CG 3.5Å; T36-M40 PolarHBondContact O-N 3.01Å; K37-M40 PolarHBondContact O-N 3.36Å; M40-F43 WeakPolarHBondContact O-CB 3.46Å; M40-F43 PolarHBondContact O-N 3.17Å; M40-Q44 PolarHBondContact O-N 3.26Å; M40-L78 HydrophobicContact SD-CB 4.13Å; M40-F79 HydrophobicContact CB-CD2 3.96Å
41	Q	59.8	Low	52.3	Low	99 Å²	99	97.2 Å²	97.2	46%	0.463	49%	0.491	S	S	.	.	H	α-helix	trans	-72.4	-39	176.4	-171.1	175.3	-1.4	0	0	112.2	K37 L38 Y39 F43 Q44 S45	K37-Q41 WeakPolarHBondContact O-CB 3.37Å; K37-Q41 PolarHBondContact O-N 2.78Å; L38-Q41 PolarHBondContact O-N 3.24Å; Y39-Q41 VanDerWaalsContact C-N 3.28Å; Y39-Q41 PolarHBondContact O-N 2.97Å; Q41-F43 VanDerWaalsContact C-N 3.28Å; Q41-F43 PolarHBondContact O-N 3.19Å; Q41-Q44 CarbonylContact O-C 3.53Å; Q41-Q44 WeakPolarHBondContact O-CA 3.37Å; Q41-Q44 WeakPolarHBondContact O-CB 3.45Å; Q41-Q44 PolarHBondContact O-N 2.98Å; Q41-S45 PolarHBondContact O-N 3.24Å; Q41-S45 PolarHBondContact O-OG 3.1Å
42	K	58.8	Low	52.2	Low	111 Å²	111	97 Å²	97	48%	0.483	49%	0.488	S	S	.	.	H	α-helix	trans	-62.1	-36.5	170.8	-82.9	176.8	179	177.6	0	110.8	L38 Y39 Q44 S45 K46	L38-K42 HydrophobicContact CG-CD 4.39Å; L38-K42 HydrophobicContact CG-CG 4.5Å; L38-K42 WeakPolarHBondContact O-CA 3.39Å; L38-K42 WeakPolarHBondContact O-CB 3.47Å; L38-K42 WeakPolarHBondContact O-CG 3.43Å; L38-K42 PolarHBondContact O-N 3.31Å; Y39-K42 PolarHBondContact O-N 3.35Å; K42-Q44 VanDerWaalsContact C-N 3.3Å; K42-S45 WeakPolarHBondContact CA-OG 3.37Å; K42-S45 PolarHBondContact O-N 3.43Å; K42-S45 PolarHBondContact O-OG 2.89Å; K42-K46 WeakPolarHBondContact O-CB 3.2Å; K42-K46 WeakPolarHBondContact O-CG 3.38Å; K42-K46 PolarHBondContact O-N 3.03Å
43	F	58.8	Low	51.8	Low	59 Å²	59	100.7 Å²	100.7	26%	0.259	50%	0.503	S	S	.	.	H	α-helix	trans	-67.6	-33	171.8	-96.3	-92.5	0	0	0	112.3	Y39 M40 Q41 T66	Y39-F43 AromaticContact CD1-CD2 3.87Å; Y39-F43 HydrophobicContact CD1-CD2 3.87Å; Y39-F43 HydrophobicContact CD1-CE2 4.12Å; Y39-F43 HydrophobicContact CD2-CD2 4.24Å; Y39-F43 HydrophobicContact CD2-CE2 4.05Å; Y39-F43 AromaticContact CE1-CD2 3.6Å; Y39-F43 HydrophobicContact CE1-CD2 3.6Å; Y39-F43 AromaticContact CE1-CE2 3.46Å; Y39-F43 HydrophobicContact CE1-CE2 3.46Å; Y39-F43 VanDerWaalsContact CE1-CE2 3.46Å; Y39-F43 HydrophobicContact CE1-CZ 4.26Å; Y39-F43 HydrophobicContact CE2-CD2 4.01Å; Y39-F43 AromaticContact CE2-CE2 3.38Å; Y39-F43 HydrophobicContact CE2-CE2 3.38Å; Y39-F43 HydrophobicContact CE2-CZ 4.37Å; Y39-F43 HydrophobicContact CG-CD2 4.19Å; Y39-F43 HydrophobicContact CG-CE2 4.39Å; Y39-F43 AromaticContact CZ-CD2 3.69Å; Y39-F43 AromaticContact CZ-CE2 3.04Å; Y39-F43 AromaticContact CZ-CZ 3.78Å; Y39-F43 WeakPolarHBondContact O-CB 3.37Å; Y39-F43 WeakPolarHBondContact O-CD2 3.26Å; Y39-F43 PolarHBondContact O-N 3.31Å; Y39-F43 WeakPolarHBondContact OH-CE2 3.4Å; Y39-F43 WeakPolarHBondContact OH-CZ 3.49Å; M40-F43 WeakPolarHBondContact O-CB 3.46Å; M40-F43 PolarHBondContact O-N 3.17Å; Q41-F43 VanDerWaalsContact C-N 3.28Å; Q41-F43 PolarHBondContact O-N 3.19Å; F43-T66 HydrophobicContact CE1-CG2 3.64Å; F43-T66 HydrophobicContact CZ-CG2 4.1Å
44	Q	53.2	Low	51.7	Low	104 Å²	104	106.3 Å²	106.3	49%	0.486	53%	0.526	S	S	.	.	H	α-helix	trans	-72.1	-35.2	173	-169.2	175.4	-3.6	0	0	112.4	M40 Q41 K42	M40-Q44 PolarHBondContact O-N 3.26Å; Q41-Q44 CarbonylContact O-C 3.53Å; Q41-Q44 WeakPolarHBondContact O-CA 3.37Å; Q41-Q44 WeakPolarHBondContact O-CB 3.45Å; Q41-Q44 PolarHBondContact O-N 2.98Å; K42-Q44 VanDerWaalsContact C-N 3.3Å
45	S	48.9	Very low	51.1	Low	68 Å²	68	112 Å²	112	48%	0.476	54%	0.539	S	S	.	.	H	α-helix	trans	-92.1	-25.1	-176.8	65.2	0	0	0	0	114.8	Q41 K42 V47	Q41-S45 PolarHBondContact O-N 3.24Å; Q41-S45 PolarHBondContact O-OG 3.1Å; K42-S45 WeakPolarHBondContact CA-OG 3.37Å; K42-S45 PolarHBondContact O-N 3.43Å; K42-S45 PolarHBondContact O-OG 2.89Å; S45-V47 CarbonylContact O-C 3.46Å; S45-V47 PolarHBondContact O-N 3.12Å; S45-V47 VanDerWaalsContact O-N 3.11Å
46	K	50.4	Low	50.2	Low	161 Å²	161	117.3 Å²	117.3	70%	0.7	55%	0.551	S	S	*	*	S	Bend	trans	-67.8	0.4	168.3	-81.4	-175.5	173.9	-176.9	0	113.3	K42 D48	K42-K46 WeakPolarHBondContact O-CB 3.2Å; K42-K46 WeakPolarHBondContact O-CG 3.38Å; K42-K46 PolarHBondContact O-N 3.03Å; K46-D48 VanDerWaalsContact C-N 3.32Å; K46-D48 PolarHBondContact O-N 3.39Å
47	V	42	Very low	49.8	Very low	32 Å²	32	124 Å²	124	19%	0.194	59%	0.586	C	S	.	*	S	Bend	trans	-88.7	85.2	156.6	-169.4	0	0	0	0	106.1	S45 F49 D62	S45-V47 CarbonylContact O-C 3.46Å; S45-V47 PolarHBondContact O-N 3.12Å; S45-V47 VanDerWaalsContact O-N 3.11Å; V47-F49 PolarHBondContact O-N 3.07Å; V47-D62 WeakPolarHBondContact CG1-OD1 3.35Å
48	D	37.2	Very low	49.4	Very low	131 Å²	131	128.4 Å²	128.4	70%	0.701	61%	0.605	S	S	*	*			trans	-29.3	114.3	-174.8	-74.3	-37.8	0	0	0	114.6	K46 S50	K46-D48 VanDerWaalsContact C-N 3.32Å; K46-D48 PolarHBondContact O-N 3.39Å; D48-S50 PolarHBondContact O-N 3.43Å
49	F	32.7	Very low	49	Very low	203 Å²	203	129.3 Å²	129.3	89%	0.89	61%	0.61	S	S	*	*			trans	-75.7	27.4	153.5	-91.2	-87.7	0	0	0	111.7	V47 M51	V47-F49 PolarHBondContact O-N 3.07Å; F49-M51 PolarHBondContact O-N 3.2Å; F49-M51 VanDerWaalsContact O-N 3.15Å
50	S	36.2	Very low	48.7	Very low	65 Å²	65	133.2 Å²	133.2	46%	0.455	63%	0.629	S	S	.	*			trans	-70.2	112.6	167.2	-175.1	0	0	0	0	108	D48 K52	D48-S50 PolarHBondContact O-N 3.43Å; S50-K52 PolarHBondContact O-N 3.25Å
51	M	33	Very low	48.5	Very low	198 Å²	198	135.5 Å²	135.5	98%	0.975	65%	0.647	S	S	*	*			trans	-50	77.1	171.4	-141.8	176.9	176.3	0	0	111	F49	F49-M51 PolarHBondContact O-N 3.2Å; F49-M51 VanDerWaalsContact O-N 3.15Å
52	K	38.6	Very low	48.2	Very low	169 Å²	169	132.6 Å²	132.6	74%	0.735	64%	0.635	S	S	*	*			trans	-119.7	99.1	177.3	-80.8	-179	179.9	170.3	0	109.3	S50	S50-K52 PolarHBondContact O-N 3.25Å
53	N	39.5	Very low	48.2	Very low	141 Å²	141	135.3 Å²	135.3	75%	0.754	65%	0.647	S	S	*	*			trans	39	117.4	160.9	-75.5	-21.6	0	0	0	117.4	R55 K56	N53-R55 PolarHBondContact O-N 3.48Å; N53-K56 PolarHBondContact O-N 3.05Å
54	E	47.3	Very low	48	Very low	191 Å²	191	135.5 Å²	135.5	89%	0.893	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.7	-1.5	170.4	-65.4	-177.4	139.9	0	0	116.3
55	R	49.7	Very low	48.3	Very low	235 Å²	235	132.1 Å²	132.1	89%	0.887	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-3.1	-175.1	-64.6	-175.6	178.7	179.8	-0.1	115.1	N53	N53-R55 PolarHBondContact O-N 3.48Å
56	K	46.3	Very low	49	Very low	168 Å²	168	131.3 Å²	131.3	73%	0.73	64%	0.638	S	S	*	*			trans	-145.7	81.6	166.6	-73.4	-174.4	-178.5	171.4	0	112.1	N53 K58	N53-K56 PolarHBondContact O-N 3.05Å; K56-K58 PolarHBondContact O-N 3.45Å
57	L	55.8	Low	49.7	Very low	165 Å²	165	127.8 Å²	127.8	86%	0.864	63%	0.627	S	S	*	*	S	Bend	trans	-63.9	3.5	175.2	-83.3	153.7	0	0	0	115.6
58	K	55.4	Low	51.1	Low	181 Å²	181	131.5 Å²	131.5	79%	0.787	64%	0.642	S	S	*	*			trans	-141.1	112.4	-177.7	-68.8	179.6	-178.6	170.8	0	108.9	K56	K56-K58 PolarHBondContact O-N 3.45Å
59	D	54.9	Low	52.8	Low	100 Å²	100	125.3 Å²	125.3	54%	0.535	61%	0.608	S	S	.	*			trans	-98.7	155.6	175	-84.6	-28.6	0	0	0	111.7	S61 D62	D59-S61 WeakPolarHBondContact CB-OG 3.44Å; D59-S61 PolarHBondContact O-N 2.69Å; D59-D62 PolarHBondContact N-OD2 3.06Å; D59-D62 WeakPolarHBondContact O-CB 3.34Å; D59-D62 PolarHBondContact O-N 2.73Å; D59-D62 VanDerWaalsContact O-N 3.15Å
60	K	60	Low	55.1	Low	198 Å²	198	116.2 Å²	116.2	86%	0.861	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-61.8	-28.2	176.9	-71.9	-177.1	179.5	178.6	0	111.7	D62 K63 A64	K60-D62 PolarHBondContact O-N 2.79Å; K60-K63 PolarHBondContact O-N 3.07Å; K60-K63 VanDerWaalsContact O-N 3.16Å; K60-A64 PolarHBondContact O-N 3.24Å
61	S	60	Low	57.3	Low	67 Å²	67	113.8 Å²	113.8	47%	0.469	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-59.1	-30.8	175.3	51.6	0	0	0	0	112.6	D59 K63 A64	D59-S61 WeakPolarHBondContact CB-OG 3.44Å; D59-S61 PolarHBondContact O-N 2.69Å; S61-K63 PolarHBondContact O-N 3.19Å; S61-K63 VanDerWaalsContact O-N 3.13Å; S61-A64 VanDerWaalsContact O-CB 3.27Å; S61-A64 WeakPolarHBondContact O-CB 3.19Å; S61-A64 PolarHBondContact O-N 2.73Å
62	D	52.5	Low	59.7	Low	37 Å²	37	110.9 Å²	110.9	20%	0.198	53%	0.529	C	S	.	.	G	3₁₀ helix	trans	-62	-23.7	177.6	-70.4	-31.3	0	0	0	113.7	V47 D59 K60 R72	V47-D62 WeakPolarHBondContact CG1-OD1 3.35Å; D59-D62 PolarHBondContact N-OD2 3.06Å; D59-D62 WeakPolarHBondContact O-CB 3.34Å; D59-D62 PolarHBondContact O-N 2.73Å; D59-D62 VanDerWaalsContact O-N 3.15Å; K60-D62 PolarHBondContact O-N 2.79Å; D62-R72 VanDerWaalsContact CG-NH1 3.27Å; D62-R72 WeakPolarHBondContact O-CB 3.16Å; D62-R72 WeakPolarHBondContact OD1-CD 3.19Å; D62-R72 IonicContact OD1-CZ 3.61Å; D62-R72 IonicContact OD1-NE 2.57Å; D62-R72 IonicContact OD1-NH1 2.69Å; D62-R72 PolarHBondContact OD1-NH1 2.74Å; D62-R72 IonicContact OD2-NH1 2.69Å; D62-R72 PolarHBondContact OD2-NH1 2.98Å
63	K	59.5	Low	62	Low	168 Å²	168	109.7 Å²	109.7	73%	0.73	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-102.1	-3.8	176.7	-67.8	-177.9	178.7	176.8	0	113	K60 S61 T65	K60-K63 PolarHBondContact O-N 3.07Å; K60-K63 VanDerWaalsContact O-N 3.16Å; S61-K63 PolarHBondContact O-N 3.19Å; S61-K63 VanDerWaalsContact O-N 3.13Å; K63-T65 PolarHBondContact O-N 3.03Å; K63-T65 PolarHBondContact O-OG1 3.42Å
64	A	55.2	Low	64.3	Low	63 Å²	63	103 Å²	103	52%	0.521	48%	0.484	S	S	.	.			trans	-61.3	133.4	176.5	0	0	0	0	0	108.7	K60 S61	K60-A64 PolarHBondContact O-N 3.24Å; S61-A64 VanDerWaalsContact O-CB 3.27Å; S61-A64 WeakPolarHBondContact O-CB 3.19Å; S61-A64 PolarHBondContact O-N 2.73Å
65	T	59	Low	66.2	Low	34 Å²	34	94.6 Å²	94.6	21%	0.209	45%	0.447	C	S	.	.			trans	-112.8	120.6	-177	-48.8	0	0	0	0	107.9	K63 H68 A69	K63-T65 PolarHBondContact O-N 3.03Å; K63-T65 PolarHBondContact O-OG1 3.42Å; T65-H68 WeakPolarHBondContact CG2-O 3.38Å; T65-A69 VanDerWaalsContact CG2-N 3.32Å
66	T	63	Low	68.1	Low	50 Å²	50	85.6 Å²	85.6	31%	0.307	42%	0.42	S	S	.	.	B	Isolated β-bridge	trans	-86.4	143.6	168.3	47.4	0	0	0	0	109.5	F43 H68 A69 L70	F43-T66 HydrophobicContact CE1-CG2 3.64Å; F43-T66 HydrophobicContact CZ-CG2 4.1Å; T66-H68 PolarHBondContact O-N 3.15Å; T66-A69 PolarHBondContact O-N 3.47Å; T66-L70 PolarHBondContact N-O 2.95Å; T66-L70 WeakPolarHBondContact O-CB 3.41Å; T66-L70 PolarHBondContact O-N 3.5Å; T66-L70 PolarHBondContact OG1-O 3.26Å
67	D	66.1	Low	70.3	Confident	87 Å²	87	78.5 Å²	78.5	47%	0.465	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	30	-174.4	-57.9	-22.9	0	0	0	114.7	A69 N101	D67-A69 PolarHBondContact O-N 3.38Å; D67-N101 PolarHBondContact O-ND2 2.93Å
68	H	70.5	Confident	72	Confident	111 Å²	111	71.2 Å²	71.2	51%	0.514	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	-12.2	-178.9	-51.2	-74.5	0	0	0	117.3	T65 T66 M119	T65-H68 WeakPolarHBondContact CG2-O 3.38Å; T66-H68 PolarHBondContact O-N 3.15Å; H68-M119 HydrophobicContact CB-CE 3.74Å; H68-M119 HydrophobicContact CB-SD 4.05Å; H68-M119 WeakPolarHBondContact O-CG 3.21Å
69	A	74.4	Confident	73.7	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.1	-23.4	-179.7	0	0	0	0	0	115.2	T65 T66 D67 D71 N101 V117 M119	T65-A69 VanDerWaalsContact CG2-N 3.32Å; T66-A69 PolarHBondContact O-N 3.47Å; D67-A69 PolarHBondContact O-N 3.38Å; A69-D71 PolarHBondContact O-N 2.93Å; A69-N101 HydrophobicContact CB-CB 4.1Å; A69-V117 HydrophobicContact CB-CB 4.35Å; A69-V117 HydrophobicContact CB-CG1 4.09Å; A69-M119 HydrophobicContact CB-CG 3.95Å
70	L	80.7	Confident	75.4	Confident	13 Å²	13	65.2 Å²	65.2	7%	0.068	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-91	85.9	-175.1	-62.7	174.9	0	0	0	111.1	T66 L78 Y103 V117	T66-L70 PolarHBondContact N-O 2.95Å; T66-L70 WeakPolarHBondContact O-CB 3.41Å; T66-L70 PolarHBondContact O-N 3.5Å; T66-L70 PolarHBondContact OG1-O 3.26Å; L70-L78 HydrophobicContact CD2-CD1 3.68Å; L70-Y103 HydrophobicContact CD1-CE1 4.3Å; L70-Y103 WeakPolarHBondContact CD1-OH 3.17Å; L70-Y103 HydrophobicContact CD2-CE2 4.21Å; L70-Y103 HydrophobicContact CG-CE2 4.46Å; L70-Y103 WeakPolarHBondContact CG-OH 3.44Å; L70-V117 HydrophobicContact CD2-CG1 4.35Å; L70-V117 HydrophobicContact CD2-CG2 4.4Å
71	D	81.5	Confident	77	Confident	14 Å²	14	56.2 Å²	56.2	8%	0.075	28%	0.282	C	S	.	.			trans	-84.9	164.6	166.8	70.7	23.3	0	0	0	111.4	A69 R73 S74 C75 T120 W148	A69-D71 PolarHBondContact O-N 2.93Å; D71-R73 PolarHBondContact O-N 2.86Å; D71-R73 WeakPolarHBondContact OD1-CA 3.19Å; D71-R73 WeakPolarHBondContact OD1-CB 3.29Å; D71-R73 PolarHBondContact OD1-N 3.25Å; D71-R73 VanDerWaalsContact OD1-N 3.1Å; D71-S74 PolarHBondContact O-N 2.84Å; D71-S74 VanDerWaalsContact O-N 3.12Å; D71-S74 WeakPolarHBondContact OD1-CB 3.15Å; D71-S74 PolarHBondContact OD1-N 3.33Å; D71-S74 PolarHBondContact OD1-OG 2.91Å; D71-S74 VanDerWaalsContact OD1-OG 3.13Å; D71-C75 PolarHBondContact O-N 2.62Å; D71-C75 PolarHBondContact O-SG 3.15Å; D71-C75 VanDerWaalsContact O-SG 3.41Å; D71-T120 PolarHBondContact OD2-OG1 3.39Å; D71-W148 WeakPolarHBondContact OD2-CZ3 3.5Å
72	R	83.1	Confident	78.5	Confident	137 Å²	137	54 Å²	54	52%	0.517	26%	0.264	S	S	.	.	H	α-helix	trans	-51.2	-32.7	180	-175.8	-179.7	172.2	-168.3	-2	112.6	D62 S76	D62-R72 VanDerWaalsContact CG-NH1 3.27Å; D62-R72 WeakPolarHBondContact O-CB 3.16Å; D62-R72 WeakPolarHBondContact OD1-CD 3.19Å; D62-R72 IonicContact OD1-CZ 3.61Å; D62-R72 IonicContact OD1-NE 2.57Å; D62-R72 IonicContact OD1-NH1 2.69Å; D62-R72 PolarHBondContact OD1-NH1 2.74Å; D62-R72 IonicContact OD2-NH1 2.69Å; D62-R72 PolarHBondContact OD2-NH1 2.98Å; R72-S76 WeakPolarHBondContact O-CB 3.25Å; R72-S76 PolarHBondContact O-N 3.23Å; R72-S76 VanDerWaalsContact O-N 3.1Å
73	R	87.6	Confident	80.4	Confident	143 Å²	143	55.9 Å²	55.9	54%	0.54	27%	0.274	S	S	.	.	H	α-helix	trans	-78.2	-42.5	-177.1	-170.3	172.6	179.8	-178.1	0.7	111.8	D71 S76 I77 W148	D71-R73 PolarHBondContact O-N 2.86Å; D71-R73 WeakPolarHBondContact OD1-CA 3.19Å; D71-R73 WeakPolarHBondContact OD1-CB 3.29Å; D71-R73 PolarHBondContact OD1-N 3.25Å; D71-R73 VanDerWaalsContact OD1-N 3.1Å; R73-S76 PolarHBondContact O-N 3.1Å; R73-I77 WeakPolarHBondContact O-CG1 3.37Å; R73-I77 PolarHBondContact O-N 3.14Å; R73-I77 VanDerWaalsContact O-N 3.09Å; R73-W148 HydrophobicContact CB-CH2 3.84Å; R73-W148 HydrophobicContact CB-CZ3 3.87Å; R73-W148 VanDerWaalsContact CD-CH2 3.43Å; R73-W148 VanDerWaalsContact CD-CZ2 3.42Å; R73-W148 HydrophobicContact CG-CH2 3.46Å; R73-W148 VanDerWaalsContact CG-CH2 3.46Å; R73-W148 HydrophobicContact CG-CZ2 3.81Å; R73-W148 HydrophobicContact CG-CZ3 3.92Å; R73-W148 VanDerWaalsContact NE-CZ2 3.31Å; R73-W148 VanDerWaalsContact NH1-CD1 3.3Å; R73-W148 VanDerWaalsContact NH1-CE2 3.35Å
74	S	87.5	Confident	81.9	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.4	-45.2	172.9	-67.3	0	0	0	0	110.7	D71 S76 I77 L78 V182	D71-S74 PolarHBondContact O-N 2.84Å; D71-S74 VanDerWaalsContact O-N 3.12Å; D71-S74 WeakPolarHBondContact OD1-CB 3.15Å; D71-S74 PolarHBondContact OD1-N 3.33Å; D71-S74 PolarHBondContact OD1-OG 2.91Å; D71-S74 VanDerWaalsContact OD1-OG 3.13Å; S74-S76 VanDerWaalsContact C-N 3.32Å; S74-S76 PolarHBondContact O-N 2.83Å; S74-I77 WeakPolarHBondContact O-CB 3.34Å; S74-I77 PolarHBondContact O-N 2.92Å; S74-L78 WeakPolarHBondContact O-CG 3.41Å; S74-L78 PolarHBondContact O-N 3.4Å; S74-V182 VanDerWaalsContact OG-CG2 3.3Å; S74-V182 WeakPolarHBondContact OG-CG2 3.41Å
75	C	87.6	Confident	83.6	Confident	16 Å²	16	56.5 Å²	56.5	11%	0.108	27%	0.269	C	S	.	.	H	α-helix	trans	-59.8	-41.5	174.6	-64.9	0	0	0	0	112.1	D71 I77 L78 F79	D71-C75 PolarHBondContact O-N 2.62Å; D71-C75 PolarHBondContact O-SG 3.15Å; D71-C75 VanDerWaalsContact O-SG 3.41Å; C75-I77 VanDerWaalsContact C-N 3.28Å; C75-I77 PolarHBondContact O-N 3.32Å; C75-L78 PolarHBondContact O-N 2.97Å; C75-F79 WeakPolarHBondContact O-CB 3.21Å; C75-F79 PolarHBondContact O-N 3.38Å
76	S	89.8	Confident	85.1	Confident	46 Å²	46	56.4 Å²	56.4	32%	0.322	27%	0.267	S	S	.	.	H	α-helix	trans	-62.9	-33.2	174.8	-173.9	0	0	0	0	113	R72 R73 S74 K80	R72-S76 WeakPolarHBondContact O-CB 3.25Å; R72-S76 PolarHBondContact O-N 3.23Å; R72-S76 VanDerWaalsContact O-N 3.1Å; R73-S76 PolarHBondContact O-N 3.1Å; S74-S76 VanDerWaalsContact C-N 3.32Å; S74-S76 PolarHBondContact O-N 2.83Å; S76-K80 WeakPolarHBondContact O-CB 3.14Å; S76-K80 VanDerWaalsContact O-CG 3.27Å; S76-K80 WeakPolarHBondContact O-CG 3.39Å; S76-K80 PolarHBondContact O-N 2.71Å; S76-K80 VanDerWaalsContact O-N 3.13Å
77	I	92.1	Very high	86.4	Confident	19 Å²	19	54.1 Å²	54.1	10%	0.097	25%	0.253	C	S	.	.	H	α-helix	trans	-69.4	-46.6	175.2	-68.7	163.9	0	0	0	110.3	R73 S74 C75 K80 M81 W148 K180 V183	R73-I77 WeakPolarHBondContact O-CG1 3.37Å; R73-I77 PolarHBondContact O-N 3.14Å; R73-I77 VanDerWaalsContact O-N 3.09Å; S74-I77 WeakPolarHBondContact O-CB 3.34Å; S74-I77 PolarHBondContact O-N 2.92Å; C75-I77 VanDerWaalsContact C-N 3.28Å; C75-I77 PolarHBondContact O-N 3.32Å; I77-K80 PolarHBondContact O-N 3.43Å; I77-M81 HydrophobicContact CG2-CE 4.37Å; I77-M81 HydrophobicContact CG2-SD 4.07Å; I77-M81 WeakPolarHBondContact O-CG 3.48Å; I77-M81 PolarHBondContact O-N 2.97Å; I77-W148 HydrophobicContact CD1-CH2 4.1Å; I77-W148 HydrophobicContact CD1-CZ2 4.12Å; I77-K180 HydrophobicContact CG1-CG 4.34Å; I77-K180 HydrophobicContact CG2-CB 3.74Å; I77-K180 HydrophobicContact CG2-CG 3.71Å; I77-V183 HydrophobicContact CB-CG2 4.18Å; I77-V183 HydrophobicContact CG2-CB 3.91Å; I77-V183 HydrophobicContact CG2-CG1 4.48Å; I77-V183 HydrophobicContact CG2-CG2 3.8Å
78	L	91.2	Very high	87.5	Confident	11 Å²	11	50.9 Å²	50.9	6%	0.058	24%	0.237	C	C	.	.	H	α-helix	trans	-60	-47.6	177.3	-66.8	171.9	0	0	0	111.5	M40 L70 S74 C75 K80 M81 M82 F87 I115 V183	M40-L78 HydrophobicContact SD-CB 4.13Å; L70-L78 HydrophobicContact CD2-CD1 3.68Å; S74-L78 WeakPolarHBondContact O-CG 3.41Å; S74-L78 PolarHBondContact O-N 3.4Å; C75-L78 PolarHBondContact O-N 2.97Å; L78-K80 VanDerWaalsContact C-N 3.3Å; L78-K80 PolarHBondContact O-N 3.25Å; L78-M81 WeakPolarHBondContact O-CB 3.32Å; L78-M81 PolarHBondContact O-N 3.41Å; L78-M82 WeakPolarHBondContact O-CB 3.46Å; L78-M82 PolarHBondContact O-N 3.08Å; L78-F87 HydrophobicContact CD2-CZ 4.29Å; L78-I115 HydrophobicContact CD2-CD1 3.86Å; L78-I115 HydrophobicContact CD2-CG2 3.92Å; L78-V183 HydrophobicContact CD2-CG1 3.63Å; L78-V183 HydrophobicContact CD2-CG2 4.43Å
79	F	90.4	Very high	88.3	Confident	32 Å²	32	46.7 Å²	46.7	14%	0.14	22%	0.218	C	C	.	.	H	α-helix	trans	-60.2	-38.7	177.2	-173.6	-108.8	0	0	0	112.5	K37 M40 C75 M82 N83	K37-F79 HydrophobicContact CG-CE2 4.4Å; M40-F79 HydrophobicContact CB-CD2 3.96Å; C75-F79 WeakPolarHBondContact O-CB 3.21Å; C75-F79 PolarHBondContact O-N 3.38Å; F79-M82 PolarHBondContact O-N 3.26Å; F79-N83 VanDerWaalsContact CD1-ND2 3.31Å; F79-N83 WeakPolarHBondContact CD1-ND2 3.47Å; F79-N83 WeakPolarHBondContact CE1-ND2 3.42Å; F79-N83 WeakPolarHBondContact CZ-ND2 3.36Å; F79-N83 WeakPolarHBondContact O-CB 3.44Å; F79-N83 VanDerWaalsContact O-CG 3.27Å; F79-N83 PolarHBondContact O-N 2.88Å; F79-N83 PolarHBondContact O-ND2 3.18Å
80	K	92.6	Very high	89	Confident	124 Å²	124	48.6 Å²	48.6	54%	0.539	23%	0.229	S	C	.	.	H	α-helix	trans	-66.3	-38.2	173.9	-77.6	173.4	-178	173.8	0	112.6	S76 I77 L78 Q84	S76-K80 WeakPolarHBondContact O-CB 3.14Å; S76-K80 VanDerWaalsContact O-CG 3.27Å; S76-K80 WeakPolarHBondContact O-CG 3.39Å; S76-K80 PolarHBondContact O-N 2.71Å; S76-K80 VanDerWaalsContact O-N 3.13Å; I77-K80 PolarHBondContact O-N 3.43Å; L78-K80 VanDerWaalsContact C-N 3.3Å; L78-K80 PolarHBondContact O-N 3.25Å; K80-Q84 WeakPolarHBondContact O-CB 3.49Å; K80-Q84 WeakPolarHBondContact O-CG 3.46Å; K80-Q84 PolarHBondContact O-N 2.95Å
81	M	92.5	Very high	88.9	Confident	9 Å²	9	51.6 Å²	51.6	4%	0.044	25%	0.245	C	C	.	.	H	α-helix	trans	-67.6	-39.9	176.3	-71.7	173.1	150.3	0	0	111.4	I77 L78 Q84 E85 I86 F87 R178 K180 V183	I77-M81 HydrophobicContact CG2-CE 4.37Å; I77-M81 HydrophobicContact CG2-SD 4.07Å; I77-M81 WeakPolarHBondContact O-CG 3.48Å; I77-M81 PolarHBondContact O-N 2.97Å; L78-M81 WeakPolarHBondContact O-CB 3.32Å; L78-M81 PolarHBondContact O-N 3.41Å; M81-Q84 PolarHBondContact O-N 3.01Å; M81-E85 PolarHBondContact O-N 3.13Å; M81-I86 HydrophobicContact CB-CD1 4.16Å; M81-I86 HydrophobicContact CG-CD1 4.15Å; M81-I86 WeakPolarHBondContact O-CB 3.3Å; M81-I86 PolarHBondContact O-N 2.92Å; M81-F87 HydrophobicContact CB-CD1 4.3Å; M81-F87 HydrophobicContact CB-CE1 3.47Å; M81-F87 VanDerWaalsContact CB-CE1 3.47Å; M81-F87 HydrophobicContact CB-CZ 4.07Å; M81-F87 HydrophobicContact SD-CE1 4.4Å; M81-R178 HydrophobicContact CE-CB 4.34Å; M81-K180 HydrophobicContact CE-CB 3.58Å; M81-V183 HydrophobicContact CE-CG1 4.45Å; M81-V183 HydrophobicContact SD-CG1 3.96Å
82	M	91.6	Very high	88.8	Confident	19 Å²	19	52.5 Å²	52.5	9%	0.094	26%	0.258	C	S	.	.	H	α-helix	trans	-64.6	-44.1	174.8	-171.7	-178.9	169.1	0	0	111.8	K37 L78 F79 Q84 E85 F87 S88	K37-M82 HydrophobicContact CB-CE 3.45Å; K37-M82 VanDerWaalsContact CB-CE 3.45Å; K37-M82 HydrophobicContact CB-SD 4.49Å; K37-M82 HydrophobicContact CD-CE 4.26Å; K37-M82 HydrophobicContact CG-CE 3.79Å; L78-M82 WeakPolarHBondContact O-CB 3.46Å; L78-M82 PolarHBondContact O-N 3.08Å; F79-M82 PolarHBondContact O-N 3.26Å; M82-Q84 PolarHBondContact O-N 3.41Å; M82-E85 WeakPolarHBondContact O-CA 3.35Å; M82-E85 PolarHBondContact O-N 3.44Å; M82-F87 HydrophobicContact CB-CD2 4.47Å; M82-F87 HydrophobicContact CB-CE2 3.92Å; M82-F87 HydrophobicContact CB-CZ 4.21Å; M82-F87 HydrophobicContact CG-CE2 4.33Å; M82-S88 WeakPolarHBondContact CE-O 3.47Å
83	N	91.5	Very high	88.9	Confident	78 Å²	78	48.7 Å²	48.7	42%	0.417	25%	0.251	S	S	.	.	H	α-helix	trans	-67.4	-21.1	174.5	-72.4	-23.3	0	0	0	113.8	F79	F79-N83 VanDerWaalsContact CD1-ND2 3.31Å; F79-N83 WeakPolarHBondContact CD1-ND2 3.47Å; F79-N83 WeakPolarHBondContact CE1-ND2 3.42Å; F79-N83 WeakPolarHBondContact CZ-ND2 3.36Å; F79-N83 WeakPolarHBondContact O-CB 3.44Å; F79-N83 VanDerWaalsContact O-CG 3.27Å; F79-N83 PolarHBondContact O-N 2.88Å; F79-N83 PolarHBondContact O-ND2 3.18Å
84	Q	92.2	Very high	88.9	Confident	127 Å²	127	44.2 Å²	44.2	59%	0.593	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	3.6	170.9	-74.7	173.7	-4.7	0	0	112.4	K80 M81 M82 I86	K80-Q84 WeakPolarHBondContact O-CB 3.49Å; K80-Q84 WeakPolarHBondContact O-CG 3.46Å; K80-Q84 PolarHBondContact O-N 2.95Å; M81-Q84 PolarHBondContact O-N 3.01Å; M82-Q84 PolarHBondContact O-N 3.41Å; Q84-I86 HydrophobicContact CB-CD1 4.09Å; Q84-I86 HydrophobicContact CB-CG1 3.94Å; Q84-I86 PolarHBondContact O-N 2.95Å
85	E	90.3	Very high	88.7	Confident	116 Å²	116	46 Å²	46	54%	0.542	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	31.3	179.4	-47	-171.4	146.7	0	0	112.7	M81 M82 N107 K108	M81-E85 PolarHBondContact O-N 3.13Å; M82-E85 WeakPolarHBondContact O-CA 3.35Å; M82-E85 PolarHBondContact O-N 3.44Å; E85-N107 PolarHBondContact O-OD1 3.2Å; E85-K108 VanDerWaalsContact CD-CE 3.49Å; E85-K108 IonicContact OE1-NZ 2.92Å; E85-K108 PolarHBondContact OE1-NZ 2.96Å; E85-K108 IonicContact OE2-NZ 3.48Å; E85-K108 PolarHBondContact OE2-NZ 3.34Å
86	I	90.7	Very high	88.5	Confident	33 Å²	33	50.2 Å²	50.2	17%	0.169	28%	0.276	C	S	.	.	S	Bend	trans	-73.9	-36.1	174.3	-59.9	176.2	0	0	0	110.1	M81 Q84 N107 L185	M81-I86 HydrophobicContact CB-CD1 4.16Å; M81-I86 HydrophobicContact CG-CD1 4.15Å; M81-I86 WeakPolarHBondContact O-CB 3.3Å; M81-I86 PolarHBondContact O-N 2.92Å; Q84-I86 HydrophobicContact CB-CD1 4.09Å; Q84-I86 HydrophobicContact CB-CG1 3.94Å; Q84-I86 PolarHBondContact O-N 2.95Å; I86-N107 PolarHBondContact O-OD1 3.39Å; I86-L185 HydrophobicContact CG2-CD2 3.34Å
87	F	91.3	Very high	87.8	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.009	28%	0.276	C	S	.	.			trans	-146.3	153.4	170	60.3	-94.3	0	0	0	108.4	L78 M81 M82 V90 V105 K106 I115	L78-F87 HydrophobicContact CD2-CZ 4.29Å; M81-F87 HydrophobicContact CB-CD1 4.3Å; M81-F87 HydrophobicContact CB-CE1 3.47Å; M81-F87 VanDerWaalsContact CB-CE1 3.47Å; M81-F87 HydrophobicContact CB-CZ 4.07Å; M81-F87 HydrophobicContact SD-CE1 4.4Å; M82-F87 HydrophobicContact CB-CD2 4.47Å; M82-F87 HydrophobicContact CB-CE2 3.92Å; M82-F87 HydrophobicContact CB-CZ 4.21Å; M82-F87 HydrophobicContact CG-CE2 4.33Å; F87-V90 HydrophobicContact CD2-CG2 4.08Å; F87-V90 HydrophobicContact CE2-CG2 3.6Å; F87-V105 HydrophobicContact CB-CB 4.12Å; F87-V105 HydrophobicContact CB-CG2 3.92Å; F87-V105 HydrophobicContact CD1-CG2 4.45Å; F87-V105 HydrophobicContact CD2-CB 4.17Å; F87-V105 HydrophobicContact CD2-CG1 4.28Å; F87-V105 HydrophobicContact CG-CB 4.15Å; F87-V105 HydrophobicContact CG-CG2 4.1Å; F87-K106 CarbonylContact C-O 3.52Å; F87-K106 WeakPolarHBondContact CA-O 3.39Å; F87-K106 WeakPolarHBondContact CB-O 3.39Å; F87-I115 HydrophobicContact CD1-CD1 3.88Å; F87-I115 HydrophobicContact CE1-CD1 3.44Å; F87-I115 VanDerWaalsContact CE1-CD1 3.44Å; F87-I115 HydrophobicContact CE2-CD1 4.35Å; F87-I115 HydrophobicContact CG-CD1 4.49Å; F87-I115 HydrophobicContact CZ-CD1 3.72Å
88	S	89	Confident	86.9	Confident	18 Å²	18	56.5 Å²	56.5	13%	0.126	31%	0.306	C	S	.	.	S	Bend	trans	-101.7	-38.5	-177.7	50.1	0	0	0	0	112.5	M82 K106 N107	M82-S88 WeakPolarHBondContact CE-O 3.47Å; S88-K106 PolarHBondContact N-O 3.05Å; S88-K106 PolarHBondContact OG-O 2.72Å; S88-K106 VanDerWaalsContact OG-O 3.09Å; S88-N107 VanDerWaalsContact OG-C 3.31Å
89	E	87.7	Confident	86.5	Confident	24 Å²	24	57 Å²	57	11%	0.112	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	149.2	-172.2	-58.2	-176.2	155.9	0	0	111.6	S32 N33 N91 V105 K106	S32-E89 WeakPolarHBondContact CB-OE1 3.45Å; S32-E89 PolarHBondContact OG-OE1 2.87Å; N33-E89 PolarHBondContact N-OE1 2.87Å; N33-E89 PolarHBondContact ND2-OE1 3.4Å; N33-E89 WeakPolarHBondContact OD1-CG 3.29Å; N33-E89 PolarHBondContact OD1-OE1 3.18Å; N33-E89 VanDerWaalsContact OD1-OE1 3.06Å; E89-N91 WeakPolarHBondContact CB-OD1 3.35Å; E89-V105 WeakPolarHBondContact O-CA 3.48Å; E89-V105 WeakPolarHBondContact O-CB 3.39Å; E89-K106 PolarHBondContact N-O 3.43Å; E89-K106 PolarHBondContact O-N 3.41Å
90	V	88	Confident	86.5	Confident	40 Å²	40	55.9 Å²	55.9	24%	0.242	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	104.1	174.9	-176.4	0	0	0	0	107.1	T36 F87 V105	T36-V90 HydrophobicContact CG2-CB 3.98Å; T36-V90 HydrophobicContact CG2-CG2 4.11Å; F87-V90 HydrophobicContact CD2-CG2 4.08Å; F87-V90 HydrophobicContact CE2-CG2 3.6Å; V90-V105 HydrophobicContact CB-CG1 4.19Å; V90-V105 HydrophobicContact CG1-CG1 4.09Å; V90-V105 HydrophobicContact CG2-CG1 3.81Å
91	N	78.7	Confident	86.4	Confident	75 Å²	75	50 Å²	50	40%	0.401	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	0.1	-162	-61.2	-23.5	0	0	0	114.3	E89 H104	E89-N91 WeakPolarHBondContact CB-OD1 3.35Å; N91-H104 WeakPolarHBondContact CB-ND1 3.46Å; N91-H104 PolarHBondContact N-O 2.99Å; N91-H104 PolarHBondContact ND2-ND1 3.25Å
92	G	79.6	Confident	86.4	Confident	33 Å²	33	51.5 Å²	51.5	34%	0.34	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	143.5	175.2	176.7	0	0	0	0	0	113.7	Y103 H104	G92-Y103 WeakPolarHBondContact O-CA 3.47Å; G92-H104 PolarHBondContact O-N 3.48Å
93	C	85.8	Confident	86.5	Confident	57 Å²	57	51.2 Å²	51.2	39%	0.385	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	121.6	174.1	-170	0	0	0	0	109.9	I102 Y103	C93-I102 CarbonylContact C-O 3.57Å; C93-I102 PolarHBondContact SG-O 3.08Å; C93-Y103 HydrophobicContact CB-CD1 3.94Å; C93-Y103 HydrophobicContact CB-CE1 3.83Å
94	I	86.1	Confident	86.6	Confident	49 Å²	49	48.2 Å²	48.2	25%	0.251	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	-46.8	175.6	-68.3	158.5	0	0	0	110.1	I102 H104 F188 P195	I94-I102 HydrophobicContact CB-CB 4.35Å; I94-I102 HydrophobicContact CB-CG2 4.26Å; I94-I102 HydrophobicContact CD1-CG2 3.85Å; I94-I102 PolarHBondContact N-O 3.45Å; I94-H104 HydrophobicContact CD1-CB 3.73Å; I94-H104 HydrophobicContact CG1-CB 3.79Å; I94-F188 HydrophobicContact CD1-CD2 3.93Å; I94-F188 HydrophobicContact CD1-CE2 3.52Å; I94-F188 HydrophobicContact CG1-CE2 4.22Å; I94-P195 HydrophobicContact CG2-CB 3.69Å; I94-P195 HydrophobicContact CG2-CG 3.9Å
95	S	84	Confident	86.7	Confident	39 Å²	39	42.1 Å²	42.1	27%	0.273	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	128.1	-172.7	179	0	0	0	0	110.2	N101 I102	S95-N101 WeakPolarHBondContact O-CA 3.4Å; S95-I102 PolarHBondContact N-O 2.75Å; S95-I102 PolarHBondContact O-N 3.2Å
96	T	82.7	Confident	86.8	Confident	103 Å²	103	39.3 Å²	39.3	63%	0.632	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	107.9	170.3	55	0	0	0	0	108.7
97	G	75.6	Confident	86.8	Confident	33 Å²	33	39 Å²	39	34%	0.34	22%	0.224	S	C	.	.			trans	-95.7	174.9	179.5	0	0	0	0	0	113	E99 A100 M119	G97-E99 VanDerWaalsContact C-N 3.25Å; G97-E99 PolarHBondContact O-N 3.37Å; G97-A100 WeakPolarHBondContact CA-O 3.48Å; G97-A100 PolarHBondContact N-O 3Å; G97-M119 WeakPolarHBondContact O-CE 3.42Å
98	K	74.4	Confident	86.8	Confident	164 Å²	164	44.6 Å²	44.6	71%	0.713	25%	0.248	S	C	*	.	S	Bend	trans	-70.5	-21.9	174	-67.2	179.1	-178.2	172.4	0	113.1	P124	K98-P124 HydrophobicContact CB-CG 4.4Å; K98-P124 WeakPolarHBondContact O-CD 3.26Å; K98-P124 WeakPolarHBondContact O-CG 3.5Å
99	E	82.7	Confident	86.9	Confident	23 Å²	23	49.8 Å²	49.8	11%	0.107	28%	0.275	C	S	.	.	S	Bend	trans	-121.5	-23.7	-172.3	-51.2	-155.9	121.3	0	0	113.5	G97 Y118 M119 F125 R128	G97-E99 VanDerWaalsContact C-N 3.25Å; G97-E99 PolarHBondContact O-N 3.37Å; E99-Y118 WeakPolarHBondContact O-CA 3.48Å; E99-M119 PolarHBondContact O-N 3.11Å; E99-F125 WeakPolarHBondContact OE1-CD1 3.03Å; E99-R128 VanDerWaalsContact CD-NH2 3.3Å; E99-R128 IonicContact OE1-CZ 2.72Å; E99-R128 VanDerWaalsContact OE1-CZ 3.26Å; E99-R128 IonicContact OE1-NE 2.82Å; E99-R128 PolarHBondContact OE1-NE 3.25Å; E99-R128 VanDerWaalsContact OE1-NE 3.08Å; E99-R128 IonicContact OE1-NH2 3.59Å; E99-R128 PolarHBondContact OE1-NH2 3.44Å
100	A	89.9	Confident	86.9	Confident	7 Å²	7	54 Å²	54	6%	0.058	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	154.5	-176.7	0	0	0	0	0	110.3	G97 K116 V117 Y118	G97-A100 WeakPolarHBondContact CA-O 3.48Å; G97-A100 PolarHBondContact N-O 3Å; A100-K116 HydrophobicContact CB-CD 4.31Å; A100-K116 HydrophobicContact CB-CG 3.67Å; A100-V117 CarbonylContact C-O 3.51Å; A100-V117 WeakPolarHBondContact CA-O 3.37Å; A100-V117 WeakPolarHBondContact CB-O 3.35Å; A100-Y118 HydrophobicContact CB-CD1 3.97Å; A100-Y118 HydrophobicContact CB-CG 4.24Å
101	N	91	Very high	87.2	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	145.3	165.4	-68.3	2.7	0	0	0	109.4	D67 A69 S95 Y103 K116 V117 M119	D67-N101 PolarHBondContact O-ND2 2.93Å; A69-N101 HydrophobicContact CB-CB 4.1Å; S95-N101 WeakPolarHBondContact O-CA 3.4Å; N101-Y103 HydrophobicContact CB-CD2 4.41Å; N101-Y103 HydrophobicContact CB-CE2 3.58Å; N101-Y103 PolarHBondContact ND2-OH 3.04Å; N101-Y103 VanDerWaalsContact ND2-OH 3.14Å; N101-K116 CarbonylContact O-C 3.6Å; N101-K116 WeakPolarHBondContact O-CA 3.42Å; N101-V117 PolarHBondContact N-O 3.42Å; N101-V117 PolarHBondContact O-N 3.46Å; N101-M119 WeakPolarHBondContact OD1-CE 3.08Å
102	I	92.6	Very high	87.9	Confident	40 Å²	40	53.9 Å²	53.9	21%	0.205	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	129.3	175.7	-52.6	177.4	0	0	0	107.7	C93 I94 S95 A114 I115 K116	C93-I102 CarbonylContact C-O 3.57Å; C93-I102 PolarHBondContact SG-O 3.08Å; I94-I102 HydrophobicContact CB-CB 4.35Å; I94-I102 HydrophobicContact CB-CG2 4.26Å; I94-I102 HydrophobicContact CD1-CG2 3.85Å; I94-I102 PolarHBondContact N-O 3.45Å; S95-I102 PolarHBondContact N-O 2.75Å; S95-I102 PolarHBondContact O-N 3.2Å; I102-A114 HydrophobicContact CG2-CB 4.09Å; I102-I115 CarbonylContact C-O 3.44Å; I102-I115 VanDerWaalsContact CA-O 3.29Å; I102-I115 WeakPolarHBondContact CA-O 3.24Å; I102-K116 HydrophobicContact CG1-CG 4.34Å
103	Y	92.7	Very high	88.7	Confident	14 Å²	14	53.8 Å²	53.8	6%	0.055	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	142.8	178.2	-60	-88.1	0	0	0	110.2	L70 G92 C93 N101 A114 I115 V117	L70-Y103 HydrophobicContact CD1-CE1 4.3Å; L70-Y103 WeakPolarHBondContact CD1-OH 3.17Å; L70-Y103 HydrophobicContact CD2-CE2 4.21Å; L70-Y103 HydrophobicContact CG-CE2 4.46Å; L70-Y103 WeakPolarHBondContact CG-OH 3.44Å; G92-Y103 WeakPolarHBondContact O-CA 3.47Å; C93-Y103 HydrophobicContact CB-CD1 3.94Å; C93-Y103 HydrophobicContact CB-CE1 3.83Å; N101-Y103 HydrophobicContact CB-CD2 4.41Å; N101-Y103 HydrophobicContact CB-CE2 3.58Å; N101-Y103 PolarHBondContact ND2-OH 3.04Å; N101-Y103 VanDerWaalsContact ND2-OH 3.14Å; Y103-A114 WeakPolarHBondContact O-CA 3.43Å; Y103-I115 PolarHBondContact N-O 2.96Å; Y103-I115 PolarHBondContact O-N 3.34Å; Y103-V117 HydrophobicContact CD2-CG2 3.86Å; Y103-V117 HydrophobicContact CE2-CB 4.12Å; Y103-V117 HydrophobicContact CE2-CG2 3.81Å
104	H	93.7	Very high	89.1	Confident	14 Å²	14	51.4 Å²	51.4	7%	0.065	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	132	172.8	178.2	-119.6	0	0	0	109.6	N91 G92 I94 D112 F188	N91-H104 WeakPolarHBondContact CB-ND1 3.46Å; N91-H104 PolarHBondContact N-O 2.99Å; N91-H104 PolarHBondContact ND2-ND1 3.25Å; G92-H104 PolarHBondContact O-N 3.48Å; I94-H104 HydrophobicContact CD1-CB 3.73Å; I94-H104 HydrophobicContact CG1-CB 3.79Å; H104-D112 IonicContact CD2-OD1 2.67Å; H104-D112 IonicContact CE1-OD1 2.86Å; H104-D112 PolarHBondContact CE1-OD1 3.39Å; H104-D112 IonicContact NE2-OD1 3.42Å; H104-D112 PolarHBondContact NE2-OD1 3.31Å; H104-F188 AromaticContact CD2-CD2 3.95Å; H104-F188 AromaticContact CD2-CE2 3.9Å
105	V	93.5	Very high	89.5	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	149.6	176	-53.3	0	0	0	0	110.9	F87 E89 V90 F113 I115 L185	F87-V105 HydrophobicContact CB-CB 4.12Å; F87-V105 HydrophobicContact CB-CG2 3.92Å; F87-V105 HydrophobicContact CD1-CG2 4.45Å; F87-V105 HydrophobicContact CD2-CB 4.17Å; F87-V105 HydrophobicContact CD2-CG1 4.28Å; F87-V105 HydrophobicContact CG-CB 4.15Å; F87-V105 HydrophobicContact CG-CG2 4.1Å; E89-V105 WeakPolarHBondContact O-CA 3.48Å; E89-V105 WeakPolarHBondContact O-CB 3.39Å; V90-V105 HydrophobicContact CB-CG1 4.19Å; V90-V105 HydrophobicContact CG1-CG1 4.09Å; V90-V105 HydrophobicContact CG2-CG1 3.81Å; V105-F113 HydrophobicContact CG2-CB 3.65Å; V105-F113 PolarHBondContact N-O 2.99Å; V105-F113 PolarHBondContact O-N 3.29Å; V105-I115 HydrophobicContact CB-CD1 4.31Å; V105-I115 HydrophobicContact CB-CG1 4.5Å; V105-I115 HydrophobicContact CG1-CB 4.48Å; V105-I115 HydrophobicContact CG1-CD1 3.46Å; V105-I115 VanDerWaalsContact CG1-CD1 3.46Å; V105-I115 HydrophobicContact CG1-CG1 3.77Å; V105-I115 HydrophobicContact CG2-CD1 3.96Å; V105-I115 HydrophobicContact CG2-CG1 3.84Å; V105-L185 HydrophobicContact CG2-CD1 4.06Å
106	K	92.6	Very high	90.1	Very high	56 Å²	56	47.9 Å²	47.9	24%	0.243	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	146.5	173.1	-72.3	-175	179.8	-174	0	110.3	F87 S88 E89 V111 D112	F87-K106 CarbonylContact C-O 3.52Å; F87-K106 WeakPolarHBondContact CA-O 3.39Å; F87-K106 WeakPolarHBondContact CB-O 3.39Å; S88-K106 PolarHBondContact N-O 3.05Å; S88-K106 PolarHBondContact OG-O 2.72Å; S88-K106 VanDerWaalsContact OG-O 3.09Å; E89-K106 PolarHBondContact N-O 3.43Å; E89-K106 PolarHBondContact O-N 3.41Å; K106-V111 WeakPolarHBondContact CA-O 3.45Å; K106-D112 WeakPolarHBondContact CE-OD1 3.36Å; K106-D112 WeakPolarHBondContact CG-OD1 3.26Å
107	N	91.7	Very high	90.6	Very high	27 Å²	27	43 Å²	43	14%	0.144	22%	0.221	C	C	.	.			trans	-91.6	172.3	167.9	-170	24.3	0	0	0	111.3	E85 I86 S88 D109 N110 V111 F113	E85-N107 PolarHBondContact O-OD1 3.2Å; I86-N107 PolarHBondContact O-OD1 3.39Å; S88-N107 VanDerWaalsContact OG-C 3.31Å; N107-D109 PolarHBondContact O-N 3.32Å; N107-D109 VanDerWaalsContact O-N 3.11Å; N107-N110 WeakPolarHBondContact O-CA 3.49Å; N107-N110 PolarHBondContact O-N 3.39Å; N107-V111 PolarHBondContact N-O 2.94Å; N107-V111 VanDerWaalsContact N-O 3.14Å; N107-F113 HydrophobicContact CB-CD2 4.24Å; N107-F113 HydrophobicContact CB-CE2 3.68Å
108	K	90.2	Very high	91.3	Very high	119 Å²	119	41.6 Å²	41.6	52%	0.517	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-32.1	175.7	-67.2	-174.8	170.2	-171.7	0	113.6	E85 N110	E85-K108 VanDerWaalsContact CD-CE 3.49Å; E85-K108 IonicContact OE1-NZ 2.92Å; E85-K108 PolarHBondContact OE1-NZ 2.96Å; E85-K108 IonicContact OE2-NZ 3.48Å; E85-K108 PolarHBondContact OE2-NZ 3.34Å; K108-N110 PolarHBondContact O-N 2.94Å
109	D	91.7	Very high	91.9	Very high	127 Å²	127	34.4 Å²	34.4	68%	0.679	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	12.7	177.4	-51.3	-49.8	0	0	0	113.4	N107 V111	N107-D109 PolarHBondContact O-N 3.32Å; N107-D109 VanDerWaalsContact O-N 3.11Å; D109-V111 HydrophobicContact CB-CG2 4.18Å; D109-V111 PolarHBondContact O-N 3Å; D109-V111 VanDerWaalsContact O-N 3.12Å
110	N	88.8	Confident	91.9	Very high	113 Å²	113	33.4 Å²	33.4	60%	0.604	17%	0.171	S	C	*	.			trans	56.7	21.1	-174.8	-77.4	-35	0	0	0	115.5	N107 K108	N107-N110 WeakPolarHBondContact O-CA 3.49Å; N107-N110 PolarHBondContact O-N 3.39Å; K108-N110 PolarHBondContact O-N 2.94Å
111	V	92.9	Very high	91.1	Very high	75 Å²	75	36.2 Å²	36.2	46%	0.455	19%	0.189	S	C	.	.			trans	-80.4	130.9	173.7	-179.1	0	0	0	0	110.4	K106 N107 D109 F113	K106-V111 WeakPolarHBondContact CA-O 3.45Å; N107-V111 PolarHBondContact N-O 2.94Å; N107-V111 VanDerWaalsContact N-O 3.14Å; D109-V111 HydrophobicContact CB-CG2 4.18Å; D109-V111 PolarHBondContact O-N 3Å; D109-V111 VanDerWaalsContact O-N 3.12Å; V111-F113 HydrophobicContact CB-CE2 3.99Å; V111-F113 HydrophobicContact CB-CZ 4.11Å; V111-F113 HydrophobicContact CG1-CE1 4.13Å; V111-F113 HydrophobicContact CG1-CE2 3.91Å; V111-F113 HydrophobicContact CG1-CZ 3.63Å; V111-F113 WeakPolarHBondContact O-CD2 3.48Å; V111-F113 WeakPolarHBondContact O-CE2 3.39Å
112	D	94	Very high	90	Very high	37 Å²	37	40.1 Å²	40.1	20%	0.198	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	133.1	179.2	-62.2	-63.6	0	0	0	112.9	H104 K106 F188	H104-D112 IonicContact CD2-OD1 2.67Å; H104-D112 IonicContact CE1-OD1 2.86Å; H104-D112 PolarHBondContact CE1-OD1 3.39Å; H104-D112 IonicContact NE2-OD1 3.42Å; H104-D112 PolarHBondContact NE2-OD1 3.31Å; K106-D112 WeakPolarHBondContact CE-OD1 3.36Å; K106-D112 WeakPolarHBondContact CG-OD1 3.26Å; D112-F188 HydrophobicContact CB-CB 3.81Å; D112-F188 HydrophobicContact CB-CD1 3.77Å; D112-F188 HydrophobicContact CB-CG 4.01Å; D112-F188 WeakPolarHBondContact O-CB 3.44Å
113	F	95.4	Very high	88.8	Confident	31 Å²	31	41 Å²	41	14%	0.136	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	162.2	172.7	-58.4	-75.3	0	0	0	111.2	V105 N107 V111 L177 L185	V105-F113 HydrophobicContact CG2-CB 3.65Å; V105-F113 PolarHBondContact N-O 2.99Å; V105-F113 PolarHBondContact O-N 3.29Å; N107-F113 HydrophobicContact CB-CD2 4.24Å; N107-F113 HydrophobicContact CB-CE2 3.68Å; V111-F113 HydrophobicContact CB-CE2 3.99Å; V111-F113 HydrophobicContact CB-CZ 4.11Å; V111-F113 HydrophobicContact CG1-CE1 4.13Å; V111-F113 HydrophobicContact CG1-CE2 3.91Å; V111-F113 HydrophobicContact CG1-CZ 3.63Å; V111-F113 WeakPolarHBondContact O-CD2 3.48Å; V111-F113 WeakPolarHBondContact O-CE2 3.39Å; F113-L177 HydrophobicContact CD1-CD1 3.3Å; F113-L177 HydrophobicContact CE1-CD1 3.28Å; F113-L177 HydrophobicContact CG-CD1 4.33Å; F113-L177 HydrophobicContact CZ-CD1 4.29Å; F113-L185 HydrophobicContact CB-CD1 3.79Å; F113-L185 HydrophobicContact CG-CD1 4.4Å
114	A	95.6	Very high	87.3	Confident	7 Å²	7	44.3 Å²	44.3	6%	0.058	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	134.3	173.4	0	0	0	0	0	110.2	I102 Y103 M186 F188	I102-A114 HydrophobicContact CG2-CB 4.09Å; Y103-A114 WeakPolarHBondContact O-CA 3.43Å; A114-M186 HydrophobicContact CB-CE 4.09Å; A114-M186 HydrophobicContact CB-CG 4.03Å; A114-M186 PolarHBondContact N-O 2.83Å; A114-M186 PolarHBondContact O-N 3.23Å; A114-F188 HydrophobicContact CB-CD2 4.33Å
115	I	95	Very high	85.7	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	116.7	171.1	-62.8	-174.1	0	0	0	109.4	L78 F87 I102 Y103 V105 V117 V183 L184 L185	L78-I115 HydrophobicContact CD2-CD1 3.86Å; L78-I115 HydrophobicContact CD2-CG2 3.92Å; F87-I115 HydrophobicContact CD1-CD1 3.88Å; F87-I115 HydrophobicContact CE1-CD1 3.44Å; F87-I115 VanDerWaalsContact CE1-CD1 3.44Å; F87-I115 HydrophobicContact CE2-CD1 4.35Å; F87-I115 HydrophobicContact CG-CD1 4.49Å; F87-I115 HydrophobicContact CZ-CD1 3.72Å; I102-I115 CarbonylContact C-O 3.44Å; I102-I115 VanDerWaalsContact CA-O 3.29Å; I102-I115 WeakPolarHBondContact CA-O 3.24Å; Y103-I115 PolarHBondContact N-O 2.96Å; Y103-I115 PolarHBondContact O-N 3.34Å; V105-I115 HydrophobicContact CB-CD1 4.31Å; V105-I115 HydrophobicContact CB-CG1 4.5Å; V105-I115 HydrophobicContact CG1-CB 4.48Å; V105-I115 HydrophobicContact CG1-CD1 3.46Å; V105-I115 VanDerWaalsContact CG1-CD1 3.46Å; V105-I115 HydrophobicContact CG1-CG1 3.77Å; V105-I115 HydrophobicContact CG2-CD1 3.96Å; V105-I115 HydrophobicContact CG2-CG1 3.84Å; I115-V117 HydrophobicContact CG2-CG2 3.79Å; I115-V183 HydrophobicContact CG2-CG1 3.51Å; I115-L184 CarbonylContact C-O 3.48Å; I115-L184 WeakPolarHBondContact CA-O 3.38Å; I115-L185 HydrophobicContact CD1-CD1 4.2Å; I115-L185 HydrophobicContact CG1-CD1 3.58Å
116	K	94.7	Very high	84.2	Confident	13 Å²	13	55.8 Å²	55.8	6%	0.057	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	115.1	169.7	-170	174.1	-171.2	-179.6	0	109.4	A100 N101 I102 Y118 E158 L184 M186 D256	A100-K116 HydrophobicContact CB-CD 4.31Å; A100-K116 HydrophobicContact CB-CG 3.67Å; N101-K116 CarbonylContact O-C 3.6Å; N101-K116 WeakPolarHBondContact O-CA 3.42Å; I102-K116 HydrophobicContact CG1-CG 4.34Å; K116-Y118 HydrophobicContact CD-CE1 4.2Å; K116-Y118 HydrophobicContact CG-CE2 4.39Å; K116-E158 WeakPolarHBondContact CE-OE2 3.07Å; K116-E158 IonicContact NZ-OE1 3.26Å; K116-E158 PolarHBondContact NZ-OE1 3.45Å; K116-E158 IonicContact NZ-OE2 3.14Å; K116-E158 PolarHBondContact NZ-OE2 2.81Å; K116-L184 HydrophobicContact CB-CB 4.32Å; K116-L184 PolarHBondContact N-O 3Å; K116-L184 PolarHBondContact O-N 3.4Å; K116-M186 HydrophobicContact CB-CE 3.83Å; K116-M186 HydrophobicContact CD-CE 4.42Å; K116-D256 IonicContact NZ-OD1 2.66Å; K116-D256 PolarHBondContact NZ-OD1 2.76Å
117	V	93.3	Very high	82.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	112.7	175.4	-174	0	0	0	0	108.8	A69 L70 A100 N101 Y103 I115 V183	A69-V117 HydrophobicContact CB-CB 4.35Å; A69-V117 HydrophobicContact CB-CG1 4.09Å; L70-V117 HydrophobicContact CD2-CG1 4.35Å; L70-V117 HydrophobicContact CD2-CG2 4.4Å; A100-V117 CarbonylContact C-O 3.51Å; A100-V117 WeakPolarHBondContact CA-O 3.37Å; A100-V117 WeakPolarHBondContact CB-O 3.35Å; N101-V117 PolarHBondContact N-O 3.42Å; N101-V117 PolarHBondContact O-N 3.46Å; Y103-V117 HydrophobicContact CD2-CG2 3.86Å; Y103-V117 HydrophobicContact CE2-CB 4.12Å; Y103-V117 HydrophobicContact CE2-CG2 3.81Å; I115-V117 HydrophobicContact CG2-CG2 3.79Å; V117-V183 HydrophobicContact CG1-CG2 4.44Å; V117-V183 HydrophobicContact CG2-CG2 4.4Å
118	Y	91.3	Very high	81.9	Confident	5 Å²	5	56 Å²	56	2%	0.02	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	141.9	-179.6	-57.7	-97.8	0	0	0	111.8	E99 A100 K116 V151 E158 V182 L184	E99-Y118 WeakPolarHBondContact O-CA 3.48Å; A100-Y118 HydrophobicContact CB-CD1 3.97Å; A100-Y118 HydrophobicContact CB-CG 4.24Å; K116-Y118 HydrophobicContact CD-CE1 4.2Å; K116-Y118 HydrophobicContact CG-CE2 4.39Å; Y118-V151 HydrophobicContact CG-CG1 4.09Å; Y118-E158 WeakPolarHBondContact CE1-OE2 3.21Å; Y118-E158 VanDerWaalsContact CZ-OE2 3.26Å; Y118-E158 WeakPolarHBondContact OH-CB 3.08Å; Y118-E158 PolarHBondContact OH-OE2 2.91Å; Y118-V182 VanDerWaalsContact CD2-O 3.29Å; Y118-V182 WeakPolarHBondContact CD2-O 3.29Å; Y118-V182 PolarHBondContact N-O 3.13Å; Y118-L184 HydrophobicContact CE2-CB 4.2Å
119	M	87.4	Confident	81.1	Confident	13 Å²	13	52.7 Å²	52.7	6%	0.064	28%	0.283	C	S	.	.			trans	-72.8	127	177.6	-60.1	-177.1	-179.6	0	0	110.9	H68 A69 G97 E99 N101	H68-M119 HydrophobicContact CB-CE 3.74Å; H68-M119 HydrophobicContact CB-SD 4.05Å; H68-M119 WeakPolarHBondContact O-CG 3.21Å; A69-M119 HydrophobicContact CB-CG 3.95Å; G97-M119 WeakPolarHBondContact O-CE 3.42Å; E99-M119 PolarHBondContact O-N 3.11Å; N101-M119 WeakPolarHBondContact OD1-CE 3.08Å
120	T	82.5	Confident	80.3	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.012	28%	0.278	C	S	.	.	S	Bend	trans	-106.4	-37.4	-175.5	52.4	0	0	0	0	113.2	D71 S147 W148 V151 V182	D71-T120 PolarHBondContact OD2-OG1 3.39Å; T120-S147 WeakPolarHBondContact O-CB 3.46Å; T120-S147 PolarHBondContact O-OG 3.39Å; T120-W148 HydrophobicContact CG2-CD2 4.41Å; T120-W148 HydrophobicContact CG2-CE3 3.58Å; T120-W148 HydrophobicContact CG2-CZ3 3.8Å; T120-V151 HydrophobicContact CG2-CB 4.39Å; T120-V151 HydrophobicContact CG2-CG1 4.24Å; T120-V182 HydrophobicContact CG2-CB 4.26Å; T120-V182 HydrophobicContact CG2-CG1 3.79Å; T120-V182 HydrophobicContact CG2-CG2 4.03Å
121	S	71.8	Confident	79.4	Confident	65 Å²	65	49.1 Å²	49.1	46%	0.455	26%	0.255	S	S	.	.	S	Bend	trans	-95.2	-44	-173.1	-62.4	0	0	0	0	112.3
122	I	68.9	Low	78.4	Confident	84 Å²	84	46 Å²	46	43%	0.431	24%	0.237	S	C	.	.			trans	-103.2	95.9	179.6	-55.3	173	0	0	0	107.3	P124	I122-P124 WeakPolarHBondContact O-CD 3.22Å
123	M	67.4	Low	77.2	Confident	58 Å²	58	51.2 Å²	51.2	29%	0.286	26%	0.257	S	S	.	.			trans	-105.5	93.5	177.5	-70.7	-161.6	-56.3	0	0	109.6	F125 R128 V151	M123-F125 PolarHBondContact O-N 3.04Å; M123-R128 PolarHBondContact SD-NH1 2.83Å; M123-R128 VanDerWaalsContact SD-NH1 3.42Å; M123-V151 HydrophobicContact SD-CG2 4.02Å
124	P	61.4	Low	76	Confident	83 Å²	83	52.2 Å²	52.2	54%	0.539	28%	0.276	S	S	.	.			trans	-66	-27.9	176.3	26.4	-33.2	0	0	0	111.5	K98 I122	K98-P124 HydrophobicContact CB-CG 4.4Å; K98-P124 WeakPolarHBondContact O-CD 3.26Å; K98-P124 WeakPolarHBondContact O-CG 3.5Å; I122-P124 WeakPolarHBondContact O-CD 3.22Å
125	F	60.2	Low	74.9	Confident	66 Å²	66	52.2 Å²	52.2	29%	0.289	28%	0.275	S	S	.	.			trans	-93.7	103.2	-176.2	-157.9	-106.2	0	0	0	112.6	E99 M123 R128 Y131	E99-F125 WeakPolarHBondContact OE1-CD1 3.03Å; M123-F125 PolarHBondContact O-N 3.04Å; F125-R128 HydrophobicContact CD1-CG 3.62Å; F125-R128 HydrophobicContact CE1-CG 4.2Å; F125-R128 VanDerWaalsContact O-CZ 3.31Å; F125-R128 PolarHBondContact O-NH1 3.18Å; F125-Y131 HydrophobicContact CE1-CE2 4.1Å; F125-Y131 HydrophobicContact CZ-CE2 4.35Å
126	K	61.4	Low	73.9	Confident	190 Å²	190	58.8 Å²	58.8	83%	0.826	30%	0.304	S	S	*	.			trans	-91	-18.6	-179.4	-68	179.3	-179.4	174.1	0	114	R128	K126-R128 PolarHBondContact O-N 2.96Å
127	S	64.2	Low	73	Confident	72 Å²	72	60.5 Å²	60.5	50%	0.503	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-84.6	30.7	-171	-60.4	0	0	0	0	114.9	D129	S127-D129 VanDerWaalsContact C-N 3.31Å; S127-D129 PolarHBondContact O-N 3.2Å
128	R	71.1	Confident	71.9	Confident	14 Å²	14	61 Å²	61	5%	0.053	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-70.6	-23	-174	-73.4	-167.2	169.7	117.2	-11.1	114.7	E99 M123 F125 K126 K130 Y131 V132 W154	E99-R128 VanDerWaalsContact CD-NH2 3.3Å; E99-R128 IonicContact OE1-CZ 2.72Å; E99-R128 VanDerWaalsContact OE1-CZ 3.26Å; E99-R128 IonicContact OE1-NE 2.82Å; E99-R128 PolarHBondContact OE1-NE 3.25Å; E99-R128 VanDerWaalsContact OE1-NE 3.08Å; E99-R128 IonicContact OE1-NH2 3.59Å; E99-R128 PolarHBondContact OE1-NH2 3.44Å; M123-R128 PolarHBondContact SD-NH1 2.83Å; M123-R128 VanDerWaalsContact SD-NH1 3.42Å; F125-R128 HydrophobicContact CD1-CG 3.62Å; F125-R128 HydrophobicContact CE1-CG 4.2Å; F125-R128 VanDerWaalsContact O-CZ 3.31Å; F125-R128 PolarHBondContact O-NH1 3.18Å; K126-R128 PolarHBondContact O-N 2.96Å; R128-K130 PolarHBondContact O-N 2.8Å; R128-K130 VanDerWaalsContact O-N 3.13Å; R128-Y131 PolarHBondContact O-N 3.15Å; R128-V132 WeakPolarHBondContact O-CG2 3.39Å; R128-W154 HydrophobicContact CB-CH2 3.63Å; R128-W154 HydrophobicContact CB-CZ2 3.33Å; R128-W154 VanDerWaalsContact CD-CZ2 3.47Å; R128-W154 HydrophobicContact CG-CH2 3.25Å; R128-W154 HydrophobicContact CG-CZ2 3.48Å; R128-W154 VanDerWaalsContact CG-CZ2 3.48Å; R128-W154 HydrophobicContact CG-CZ3 3.94Å; R128-W154 VanDerWaalsContact NE-CZ3 3.33Å
129	D	73	Confident	71	Confident	51 Å²	51	69.9 Å²	69.9	27%	0.273	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-61	-24.5	-175.8	-84.1	-9.7	0	0	0	113.1	S127 V132 K133 Y142 K144	S127-D129 VanDerWaalsContact C-N 3.31Å; S127-D129 PolarHBondContact O-N 3.2Å; D129-V132 PolarHBondContact O-N 3.24Å; D129-K133 WeakPolarHBondContact O-CB 3.45Å; D129-K133 VanDerWaalsContact O-CG 3.22Å; D129-K133 WeakPolarHBondContact O-CG 3.48Å; D129-K133 PolarHBondContact O-N 2.99Å; D129-Y142 PolarHBondContact OD1-OH 2.9Å; D129-Y142 VanDerWaalsContact OD1-OH 3.05Å; D129-K144 IonicContact OD1-NZ 3.91Å; D129-K144 IonicContact OD2-NZ 2.82Å; D129-K144 PolarHBondContact OD2-NZ 3.12Å
130	K	76	Confident	70.1	Confident	130 Å²	130	75.9 Å²	75.9	57%	0.565	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-66.3	-42.5	178.9	-64	-174.9	179.3	-175.4	0	112.5	R128 V132 Q267	R128-K130 PolarHBondContact O-N 2.8Å; R128-K130 VanDerWaalsContact O-N 3.13Å; K130-V132 PolarHBondContact O-N 3.01Å; K130-Q267 PolarHBondContact O-OE1 2.8Å
131	Y	70.4	Confident	69.3	Low	34 Å²	34	78.7 Å²	78.7	13%	0.133	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-79.7	-2.9	-179.8	-52.2	-75.1	0	0	0	114	F125 R128 K157 A238 Q259 Y271	F125-Y131 HydrophobicContact CE1-CE2 4.1Å; F125-Y131 HydrophobicContact CZ-CE2 4.35Å; R128-Y131 PolarHBondContact O-N 3.15Å; Y131-K157 PolarHBondContact O-NZ 3.3Å; Y131-A238 HydrophobicContact CD1-CB 4.42Å; Y131-A238 HydrophobicContact CE1-CB 4.31Å; Y131-Q259 HydrophobicContact CD1-CB 4.08Å; Y131-Q259 HydrophobicContact CE1-CB 4.31Å; Y131-Q259 HydrophobicContact CG-CB 4.29Å; Y131-Q259 PolarHBondContact OH-OE1 2.88Å; Y131-Y271 HydrophobicContact CD1-CE1 4.34Å; Y131-Y271 HydrophobicContact CD1-CE2 4.41Å; Y131-Y271 HydrophobicContact CE1-CD1 4.5Å; Y131-Y271 AromaticContact CE1-CE1 3.82Å; Y131-Y271 HydrophobicContact CE1-CE1 3.82Å; Y131-Y271 AromaticContact CE1-CZ 3.94Å
132	V	72	Confident	69	Low	11 Å²	11	77.8 Å²	77.8	7%	0.067	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-38.3	-179.6	179	0	0	0	0	111.5	R128 D129 K130 G134 D135 M138 Y142 W154	R128-V132 WeakPolarHBondContact O-CG2 3.39Å; D129-V132 PolarHBondContact O-N 3.24Å; K130-V132 PolarHBondContact O-N 3.01Å; V132-G134 PolarHBondContact O-N 2.84Å; V132-D135 PolarHBondContact O-N 2.89Å; V132-M138 HydrophobicContact CB-CE 4Å; V132-M138 HydrophobicContact CB-SD 4.31Å; V132-M138 HydrophobicContact CG1-CB 3.8Å; V132-M138 HydrophobicContact CG1-CE 3.98Å; V132-M138 HydrophobicContact CG1-CG 4.46Å; V132-M138 HydrophobicContact CG1-SD 3.85Å; V132-M138 HydrophobicContact CG2-CE 3.84Å; V132-M138 HydrophobicContact CG2-SD 3.91Å; V132-Y142 HydrophobicContact CB-CE2 4.17Å; V132-Y142 HydrophobicContact CG1-CD1 4.36Å; V132-Y142 HydrophobicContact CG1-CD2 3.67Å; V132-Y142 HydrophobicContact CG1-CE1 4.14Å; V132-Y142 HydrophobicContact CG1-CE2 3.45Å; V132-Y142 VanDerWaalsContact CG1-CE2 3.45Å; V132-Y142 HydrophobicContact CG1-CG 4.13Å; V132-Y142 HydrophobicContact CG2-CE2 3.85Å; V132-W154 HydrophobicContact CG2-CZ2 4.13Å
133	K	69.2	Low	68.6	Low	146 Å²	146	75.8 Å²	75.8	64%	0.635	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	123.6	177.3	-77.8	175.2	-179.1	-175.7	0	109.4	D129	D129-K133 WeakPolarHBondContact O-CB 3.45Å; D129-K133 VanDerWaalsContact O-CG 3.22Å; D129-K133 WeakPolarHBondContact O-CG 3.48Å; D129-K133 PolarHBondContact O-N 2.99Å
134	G	68.6	Low	68.6	Low	52 Å²	52	79.6 Å²	79.6	54%	0.536	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.4	-15.8	-179.5	0	0	0	0	0	114.6	V132 F136	V132-G134 PolarHBondContact O-N 2.84Å; G134-F136 PolarHBondContact O-N 2.66Å
135	D	74	Confident	68.8	Low	6 Å²	6	80 Å²	80	3%	0.032	40%	0.403	C	S	.	.			trans	-76.3	112.7	174	-170.7	-27.3	0	0	0	110.1	V132 R137 M138 R139	V132-D135 PolarHBondContact O-N 2.89Å; D135-R137 PolarHBondContact O-N 3.18Å; D135-R137 WeakPolarHBondContact OD1-CA 3.19Å; D135-R137 WeakPolarHBondContact OD1-CB 3.39Å; D135-R137 WeakPolarHBondContact OD1-CG 3.22Å; D135-R137 PolarHBondContact OD1-N 3.39Å; D135-M138 HydrophobicContact CB-CB 4.45Å; D135-M138 HydrophobicContact CB-CE 3.69Å; D135-M138 PolarHBondContact O-N 3.18Å; D135-M138 VanDerWaalsContact OD2-CE 3.27Å; D135-M138 WeakPolarHBondContact OD2-CE 3.4Å; D135-R139 PolarHBondContact O-N 3.42Å
136	F	74.1	Confident	69.6	Low	139 Å²	139	79.9 Å²	79.9	61%	0.61	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-33.7	-179.8	-177	-97.2	0	0	0	112.1	G134 M138 R139	G134-F136 PolarHBondContact O-N 2.66Å; F136-M138 PolarHBondContact O-N 3.34Å; F136-R139 PolarHBondContact O-N 2.95Å
137	R	74.5	Confident	70.6	Confident	50 Å²	50	72.9 Å²	72.9	19%	0.189	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-24.4	-179.4	-60	161.4	50	179.2	-10.6	112.3	D135 K157 N161 E262	D135-R137 PolarHBondContact O-N 3.18Å; D135-R137 WeakPolarHBondContact OD1-CA 3.19Å; D135-R137 WeakPolarHBondContact OD1-CB 3.39Å; D135-R137 WeakPolarHBondContact OD1-CG 3.22Å; D135-R137 PolarHBondContact OD1-N 3.39Å; R137-K157 PolarHBondContact NH2-O 3.24Å; R137-N161 PolarHBondContact NH1-OD1 3.26Å; R137-N161 PolarHBondContact NH2-OD1 2.86Å; R137-E262 WeakPolarHBondContact CD-OE1 3.36Å; R137-E262 IonicContact NH1-OE1 2.88Å
138	M	71.3	Confident	71.5	Confident	10 Å²	10	70.7 Å²	70.7	5%	0.049	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-11.8	-178.8	-66.6	-167.7	-82.8	0	0	113.7	V132 D135 F136 H140 Y142 K157	V132-M138 HydrophobicContact CB-CE 4Å; V132-M138 HydrophobicContact CB-SD 4.31Å; V132-M138 HydrophobicContact CG1-CB 3.8Å; V132-M138 HydrophobicContact CG1-CE 3.98Å; V132-M138 HydrophobicContact CG1-CG 4.46Å; V132-M138 HydrophobicContact CG1-SD 3.85Å; V132-M138 HydrophobicContact CG2-CE 3.84Å; V132-M138 HydrophobicContact CG2-SD 3.91Å; D135-M138 HydrophobicContact CB-CB 4.45Å; D135-M138 HydrophobicContact CB-CE 3.69Å; D135-M138 PolarHBondContact O-N 3.18Å; D135-M138 VanDerWaalsContact OD2-CE 3.27Å; D135-M138 WeakPolarHBondContact OD2-CE 3.4Å; F136-M138 PolarHBondContact O-N 3.34Å; M138-H140 PolarHBondContact O-N 3.46Å; M138-H140 VanDerWaalsContact O-N 3.11Å; M138-Y142 VanDerWaalsContact O-CB 3.31Å; M138-Y142 WeakPolarHBondContact O-CB 3.24Å; M138-K157 HydrophobicContact CE-CD 3.64Å; M138-K157 HydrophobicContact SD-CD 4.22Å
139	R	71.1	Confident	72.2	Confident	192 Å²	192	75.9 Å²	75.9	73%	0.725	39%	0.387	S	S	*	.	S	Bend	trans	-52.3	-37.8	-179.5	-172.6	176	-179.7	177.9	0.7	113.5	D135 F136	D135-R139 PolarHBondContact O-N 3.42Å; F136-R139 PolarHBondContact O-N 2.95Å
140	H	69	Low	72.7	Confident	138 Å²	138	74.4 Å²	74.4	64%	0.639	38%	0.379	S	S	*	.	S	Bend	trans	-100.3	129.3	-179.6	-61.6	95	0	0	0	112	M138 Y142 K153	M138-H140 PolarHBondContact O-N 3.46Å; M138-H140 VanDerWaalsContact O-N 3.11Å; H140-Y142 VanDerWaalsContact C-N 3.32Å; H140-Y142 PolarHBondContact O-N 3.29Å; H140-K153 PolarHBondContact O-NZ 2.82Å
141	G	64.8	Low	73.2	Confident	61 Å²	61	68.6 Å²	68.6	63%	0.629	35%	0.354	S	S	*	.	S	Bend	trans	74.8	11.8	176.1	0	0	0	0	0	115.3	S143 K153	G141-S143 PolarHBondContact O-N 3.38Å; G141-K153 WeakPolarHBondContact O-CE 3.35Å; G141-K153 PolarHBondContact O-NZ 2.73Å
142	Y	65.6	Low	74.1	Confident	46 Å²	46	67.7 Å²	67.7	18%	0.18	35%	0.353	C	S	.	.			trans	-66.4	89.3	170.1	-172.6	-106.4	0	0	0	108.8	D129 V132 M138 H140 K144 L150 K153	D129-Y142 PolarHBondContact OD1-OH 2.9Å; D129-Y142 VanDerWaalsContact OD1-OH 3.05Å; V132-Y142 HydrophobicContact CB-CE2 4.17Å; V132-Y142 HydrophobicContact CG1-CD1 4.36Å; V132-Y142 HydrophobicContact CG1-CD2 3.67Å; V132-Y142 HydrophobicContact CG1-CE1 4.14Å; V132-Y142 HydrophobicContact CG1-CE2 3.45Å; V132-Y142 VanDerWaalsContact CG1-CE2 3.45Å; V132-Y142 HydrophobicContact CG1-CG 4.13Å; V132-Y142 HydrophobicContact CG2-CE2 3.85Å; M138-Y142 VanDerWaalsContact O-CB 3.31Å; M138-Y142 WeakPolarHBondContact O-CB 3.24Å; H140-Y142 VanDerWaalsContact C-N 3.32Å; H140-Y142 PolarHBondContact O-N 3.29Å; Y142-K144 HydrophobicContact CD1-CG 3.95Å; Y142-K144 HydrophobicContact CE1-CD 4.3Å; Y142-K144 HydrophobicContact CE1-CG 3.66Å; Y142-K144 PolarHBondContact O-N 2.87Å; Y142-L150 HydrophobicContact CD2-CD1 4.05Å; Y142-L150 HydrophobicContact CE2-CD1 3.1Å; Y142-L150 VanDerWaalsContact CZ-CD1 3.46Å; Y142-L150 WeakPolarHBondContact OH-CD1 3.42Å; Y142-K153 HydrophobicContact CD2-CD 4.42Å; Y142-K153 VanDerWaalsContact N-NZ 3.11Å
143	S	62	Low	74.9	Confident	43 Å²	43	69.4 Å²	69.4	30%	0.301	36%	0.359	S	S	.	.			trans	-90.8	105.3	179.3	-167.2	0	0	0	0	108.1	G141 S145	G141-S143 PolarHBondContact O-N 3.38Å; S143-S145 PolarHBondContact O-N 3.21Å; S143-S145 VanDerWaalsContact O-N 3.17Å; S143-S145 PolarHBondContact OG-OG 3.19Å
144	K	66.1	Low	75.7	Confident	138 Å²	138	62.8 Å²	62.8	60%	0.6	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-7	172.3	-64.8	-171.8	175.6	-166.2	0	112.9	D129 Y142 T146	D129-K144 IonicContact OD1-NZ 3.91Å; D129-K144 IonicContact OD2-NZ 2.82Å; D129-K144 PolarHBondContact OD2-NZ 3.12Å; Y142-K144 HydrophobicContact CD1-CG 3.95Å; Y142-K144 HydrophobicContact CE1-CD 4.3Å; Y142-K144 HydrophobicContact CE1-CG 3.66Å; Y142-K144 PolarHBondContact O-N 2.87Å; K144-T146 PolarHBondContact O-N 3.4Å
145	S	65.5	Low	76.8	Confident	91 Å²	91	60.3 Å²	60.3	64%	0.636	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-18.9	-167.4	68.5	0	0	0	0	114.9	S143	S143-S145 PolarHBondContact O-N 3.21Å; S143-S145 VanDerWaalsContact O-N 3.17Å; S143-S145 PolarHBondContact OG-OG 3.19Å
146	T	78.5	Confident	77.7	Confident	63 Å²	63	63.7 Å²	63.7	39%	0.387	32%	0.32	S	S	.	.			trans	-140.8	124.2	177.2	-46.6	0	0	0	0	110.4	K144 W148 K149 L150	K144-T146 PolarHBondContact O-N 3.4Å; T146-W148 HydrophobicContact CG2-CB 4.06Å; T146-W148 PolarHBondContact O-N 2.92Å; T146-K149 PolarHBondContact O-N 3.35Å; T146-L150 PolarHBondContact O-N 3.31Å; T146-L150 VanDerWaalsContact O-N 3.14Å
147	S	81.5	Confident	78.5	Confident	43 Å²	43	57.3 Å²	57.3	30%	0.301	29%	0.292	S	S	.	.	H	α-helix	trans	-52.2	-41.9	177.6	60.2	0	0	0	0	111.8	T120 K149 L150 V151	T120-S147 WeakPolarHBondContact O-CB 3.46Å; T120-S147 PolarHBondContact O-OG 3.39Å; S147-K149 PolarHBondContact O-N 3.48Å; S147-L150 WeakPolarHBondContact O-CB 3.45Å; S147-L150 PolarHBondContact O-N 3.25Å; S147-V151 WeakPolarHBondContact O-CB 3.49Å; S147-V151 VanDerWaalsContact O-CG2 3.25Å; S147-V151 WeakPolarHBondContact O-CG2 3.25Å; S147-V151 PolarHBondContact O-N 3.45Å
148	W	84.3	Confident	79.4	Confident	26 Å²	26	55.1 Å²	55.1	10%	0.098	28%	0.284	C	S	.	.	H	α-helix	trans	-54.8	-48.4	175.5	-176.1	-79.9	0	0	0	113.5	D71 R73 I77 T120 T146 L150 V151 C152 V182	D71-W148 WeakPolarHBondContact OD2-CZ3 3.5Å; R73-W148 HydrophobicContact CB-CH2 3.84Å; R73-W148 HydrophobicContact CB-CZ3 3.87Å; R73-W148 VanDerWaalsContact CD-CH2 3.43Å; R73-W148 VanDerWaalsContact CD-CZ2 3.42Å; R73-W148 HydrophobicContact CG-CH2 3.46Å; R73-W148 VanDerWaalsContact CG-CH2 3.46Å; R73-W148 HydrophobicContact CG-CZ2 3.81Å; R73-W148 HydrophobicContact CG-CZ3 3.92Å; R73-W148 VanDerWaalsContact NE-CZ2 3.31Å; R73-W148 VanDerWaalsContact NH1-CD1 3.3Å; R73-W148 VanDerWaalsContact NH1-CE2 3.35Å; I77-W148 HydrophobicContact CD1-CH2 4.1Å; I77-W148 HydrophobicContact CD1-CZ2 4.12Å; T120-W148 HydrophobicContact CG2-CD2 4.41Å; T120-W148 HydrophobicContact CG2-CE3 3.58Å; T120-W148 HydrophobicContact CG2-CZ3 3.8Å; T146-W148 HydrophobicContact CG2-CB 4.06Å; T146-W148 PolarHBondContact O-N 2.92Å; W148-L150 VanDerWaalsContact C-N 3.33Å; W148-L150 PolarHBondContact O-N 3.41Å; W148-V151 PolarHBondContact O-N 3Å; W148-C152 PolarHBondContact NE1-SG 2.98Å; W148-C152 PolarHBondContact O-N 3.05Å; W148-C152 PolarHBondContact O-SG 3.04Å; W148-V182 HydrophobicContact CD2-CG1 4.41Å; W148-V182 HydrophobicContact CE3-CG1 4.46Å; W148-V182 HydrophobicContact CH2-CB 4.49Å; W148-V182 HydrophobicContact CH2-CG1 4.18Å; W148-V182 HydrophobicContact CH2-CG2 3.56Å; W148-V182 HydrophobicContact CZ2-CG1 4.12Å; W148-V182 HydrophobicContact CZ2-CG2 4.2Å; W148-V182 HydrophobicContact CZ3-CG1 4.35Å; W148-V182 HydrophobicContact CZ3-CG2 3.85Å
149	K	84.7	Confident	80.6	Confident	123 Å²	123	57.5 Å²	57.5	54%	0.535	29%	0.293	S	S	.	.	H	α-helix	trans	-67.4	-37.7	-179	-71.6	-176	-179.2	176	0	111.3	T146 S147 K153	T146-K149 PolarHBondContact O-N 3.35Å; S147-K149 PolarHBondContact O-N 3.48Å; K149-K153 PolarHBondContact O-N 3.45Å
150	L	83.5	Confident	81.7	Confident	20 Å²	20	53.6 Å²	53.6	11%	0.105	28%	0.278	C	S	.	.	H	α-helix	trans	-61.3	-51.4	174.8	174.2	62.8	0	0	0	110.8	Y142 T146 S147 W148 C152 K153 W154	Y142-L150 HydrophobicContact CD2-CD1 4.05Å; Y142-L150 HydrophobicContact CE2-CD1 3.1Å; Y142-L150 VanDerWaalsContact CZ-CD1 3.46Å; Y142-L150 WeakPolarHBondContact OH-CD1 3.42Å; T146-L150 PolarHBondContact O-N 3.31Å; T146-L150 VanDerWaalsContact O-N 3.14Å; S147-L150 WeakPolarHBondContact O-CB 3.45Å; S147-L150 PolarHBondContact O-N 3.25Å; W148-L150 VanDerWaalsContact C-N 3.33Å; W148-L150 PolarHBondContact O-N 3.41Å; L150-C152 PolarHBondContact O-N 3.08Å; L150-K153 WeakPolarHBondContact O-CB 3.43Å; L150-K153 PolarHBondContact O-N 2.98Å; L150-W154 VanDerWaalsContact O-CD1 3.23Å; L150-W154 PolarHBondContact O-N 3.2Å; L150-W154 VanDerWaalsContact O-N 3.1Å
151	V	87.5	Confident	83	Confident	8 Å²	8	47 Å²	47	5%	0.048	25%	0.248	C	C	.	.	H	α-helix	trans	-66.6	-35.5	-178.5	177.9	0	0	0	0	111.7	Y118 T120 M123 S147 W148 K153 W154 S155 V182	Y118-V151 HydrophobicContact CG-CG1 4.09Å; T120-V151 HydrophobicContact CG2-CB 4.39Å; T120-V151 HydrophobicContact CG2-CG1 4.24Å; M123-V151 HydrophobicContact SD-CG2 4.02Å; S147-V151 WeakPolarHBondContact O-CB 3.49Å; S147-V151 VanDerWaalsContact O-CG2 3.25Å; S147-V151 WeakPolarHBondContact O-CG2 3.25Å; S147-V151 PolarHBondContact O-N 3.45Å; W148-V151 PolarHBondContact O-N 3Å; V151-K153 VanDerWaalsContact C-N 3.29Å; V151-K153 PolarHBondContact O-N 3.29Å; V151-W154 WeakPolarHBondContact O-CB 3.36Å; V151-W154 PolarHBondContact O-N 3.34Å; V151-W154 VanDerWaalsContact O-N 3.13Å; V151-S155 PolarHBondContact O-N 3.35Å; V151-S155 PolarHBondContact O-OG 2.81Å; V151-V182 HydrophobicContact CB-CG1 4.11Å; V151-V182 HydrophobicContact CG1-CB 4.12Å; V151-V182 HydrophobicContact CG1-CG1 3.63Å
152	C	89.3	Confident	84.5	Confident	16 Å²	16	44.2 Å²	44.2	11%	0.108	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-37	170.2	-72.1	0	0	0	0	112.8	W148 L150 W154 S155 E156	W148-C152 PolarHBondContact NE1-SG 2.98Å; W148-C152 PolarHBondContact O-N 3.05Å; W148-C152 PolarHBondContact O-SG 3.04Å; L150-C152 PolarHBondContact O-N 3.08Å; C152-W154 VanDerWaalsContact C-N 3.3Å; C152-S155 WeakPolarHBondContact CA-OG 3.38Å; C152-S155 PolarHBondContact O-OG 3.49Å; C152-E156 WeakPolarHBondContact O-CB 3.44Å; C152-E156 VanDerWaalsContact O-CG 3.29Å; C152-E156 WeakPolarHBondContact O-CG 3.48Å; C152-E156 PolarHBondContact O-N 3.43Å
153	K	87.1	Confident	86	Confident	46 Å²	46	44.7 Å²	44.7	20%	0.2	22%	0.224	C	C	.	.	H	α-helix	trans	-68	-34.4	175.1	-76.8	-174.3	159.9	-136.4	0	112.1	H140 G141 Y142 K149 L150 V151 K157	H140-K153 PolarHBondContact O-NZ 2.82Å; G141-K153 WeakPolarHBondContact O-CE 3.35Å; G141-K153 PolarHBondContact O-NZ 2.73Å; Y142-K153 HydrophobicContact CD2-CD 4.42Å; Y142-K153 VanDerWaalsContact N-NZ 3.11Å; K149-K153 PolarHBondContact O-N 3.45Å; L150-K153 WeakPolarHBondContact O-CB 3.43Å; L150-K153 PolarHBondContact O-N 2.98Å; V151-K153 VanDerWaalsContact C-N 3.29Å; V151-K153 PolarHBondContact O-N 3.29Å; K153-K157 WeakPolarHBondContact O-CB 3.47Å; K153-K157 PolarHBondContact O-N 2.89Å
154	W	87.3	Confident	87.6	Confident	7 Å²	7	46.3 Å²	46.3	3%	0.027	22%	0.223	C	C	.	.	H	α-helix	trans	-67.9	-46.1	176.3	-81	43.5	0	0	0	111.7	R128 V132 L150 V151 C152 E156 K157 E158	R128-W154 HydrophobicContact CB-CH2 3.63Å; R128-W154 HydrophobicContact CB-CZ2 3.33Å; R128-W154 VanDerWaalsContact CD-CZ2 3.47Å; R128-W154 HydrophobicContact CG-CH2 3.25Å; R128-W154 HydrophobicContact CG-CZ2 3.48Å; R128-W154 VanDerWaalsContact CG-CZ2 3.48Å; R128-W154 HydrophobicContact CG-CZ3 3.94Å; R128-W154 VanDerWaalsContact NE-CZ3 3.33Å; V132-W154 HydrophobicContact CG2-CZ2 4.13Å; L150-W154 VanDerWaalsContact O-CD1 3.23Å; L150-W154 PolarHBondContact O-N 3.2Å; L150-W154 VanDerWaalsContact O-N 3.1Å; V151-W154 WeakPolarHBondContact O-CB 3.36Å; V151-W154 PolarHBondContact O-N 3.34Å; V151-W154 VanDerWaalsContact O-N 3.13Å; C152-W154 VanDerWaalsContact C-N 3.3Å; W154-E156 VanDerWaalsContact C-N 3.32Å; W154-E156 PolarHBondContact O-N 2.91Å; W154-K157 WeakPolarHBondContact O-CA 3.35Å; W154-K157 VanDerWaalsContact O-CB 3.31Å; W154-K157 WeakPolarHBondContact O-CB 3.31Å; W154-K157 PolarHBondContact O-N 3.36Å; W154-E158 PolarHBondContact O-N 2.71Å
155	S	91.1	Very high	89	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.3	-38.4	174.8	66.2	0	0	0	0	112.1	V151 C152 K157 E158 Y159 G181	V151-S155 PolarHBondContact O-N 3.35Å; V151-S155 PolarHBondContact O-OG 2.81Å; C152-S155 WeakPolarHBondContact CA-OG 3.38Å; C152-S155 PolarHBondContact O-OG 3.49Å; S155-K157 VanDerWaalsContact C-N 3.31Å; S155-K157 PolarHBondContact O-N 3.1Å; S155-E158 PolarHBondContact O-N 3.5Å; S155-Y159 WeakPolarHBondContact O-CB 3.1Å; S155-Y159 PolarHBondContact O-N 3.25Å; S155-G181 PolarHBondContact OG-O 3.06Å
156	E	92.3	Very high	90.5	Very high	78 Å²	78	37.8 Å²	37.8	36%	0.364	18%	0.177	S	C	.	.	H	α-helix	trans	-62.2	-37.6	170.7	-79.5	-178.5	-150.4	0	0	112.7	C152 W154 R160 L179	C152-E156 WeakPolarHBondContact O-CB 3.44Å; C152-E156 VanDerWaalsContact O-CG 3.29Å; C152-E156 WeakPolarHBondContact O-CG 3.48Å; C152-E156 PolarHBondContact O-N 3.43Å; W154-E156 VanDerWaalsContact C-N 3.32Å; W154-E156 PolarHBondContact O-N 2.91Å; E156-R160 WeakPolarHBondContact O-CB 3.45Å; E156-R160 VanDerWaalsContact O-CG 3.26Å; E156-R160 WeakPolarHBondContact O-CG 3.32Å; E156-R160 PolarHBondContact O-N 3.43Å; E156-R160 VanDerWaalsContact O-N 3.12Å; E156-R160 IonicContact OE2-CZ 2.95Å; E156-R160 IonicContact OE2-NH2 3.81Å; E156-R160 PolarHBondContact OE2-NH2 3.33Å; E156-L179 VanDerWaalsContact CA-CD2 3.47Å; E156-L179 HydrophobicContact CB-CD2 4.13Å; E156-L179 HydrophobicContact CG-CD2 3.64Å
157	K	90.9	Very high	91.3	Very high	5 Å²	5	42 Å²	42	2%	0.022	19%	0.193	C	C	.	.	H	α-helix	trans	-63.4	-51.5	177.2	-176.2	-175.2	175.7	-159.4	0	110.4	Y131 R137 M138 K153 W154 S155 R160 N161 S258 Q259 A260	Y131-K157 PolarHBondContact O-NZ 3.3Å; R137-K157 PolarHBondContact NH2-O 3.24Å; M138-K157 HydrophobicContact CE-CD 3.64Å; M138-K157 HydrophobicContact SD-CD 4.22Å; K153-K157 WeakPolarHBondContact O-CB 3.47Å; K153-K157 PolarHBondContact O-N 2.89Å; W154-K157 WeakPolarHBondContact O-CA 3.35Å; W154-K157 VanDerWaalsContact O-CB 3.31Å; W154-K157 WeakPolarHBondContact O-CB 3.31Å; W154-K157 PolarHBondContact O-N 3.36Å; S155-K157 VanDerWaalsContact C-N 3.31Å; S155-K157 PolarHBondContact O-N 3.1Å; K157-R160 PolarHBondContact O-N 3Å; K157-N161 WeakPolarHBondContact O-CB 3.42Å; K157-N161 PolarHBondContact O-N 3.19Å; K157-N161 PolarHBondContact O-OD1 3.09Å; K157-S258 VanDerWaalsContact CD-O 3.32Å; K157-S258 WeakPolarHBondContact CD-O 3.42Å; K157-S258 WeakPolarHBondContact CE-O 3.4Å; K157-S258 PolarHBondContact NZ-O 2.97Å; K157-Q259 PolarHBondContact NZ-O 2.8Å; K157-A260 WeakPolarHBondContact CE-O 3.49Å; K157-A260 PolarHBondContact NZ-O 3.27Å
158	E	94.1	Very high	91.9	Very high	3 Å²	3	41 Å²	41	1%	0.014	19%	0.186	C	C	.	.	H	α-helix	trans	-60.5	-47.8	178.4	-172.5	168	168.7	0	0	111.9	K116 Y118 W154 S155 R160 N161 L162 L184 V257 S258	K116-E158 WeakPolarHBondContact CE-OE2 3.07Å; K116-E158 IonicContact NZ-OE1 3.26Å; K116-E158 PolarHBondContact NZ-OE1 3.45Å; K116-E158 IonicContact NZ-OE2 3.14Å; K116-E158 PolarHBondContact NZ-OE2 2.81Å; Y118-E158 WeakPolarHBondContact CE1-OE2 3.21Å; Y118-E158 VanDerWaalsContact CZ-OE2 3.26Å; Y118-E158 WeakPolarHBondContact OH-CB 3.08Å; Y118-E158 PolarHBondContact OH-OE2 2.91Å; W154-E158 PolarHBondContact O-N 2.71Å; S155-E158 PolarHBondContact O-N 3.5Å; E158-R160 VanDerWaalsContact C-N 3.31Å; E158-R160 PolarHBondContact O-N 3.17Å; E158-N161 PolarHBondContact O-N 3.03Å; E158-N161 VanDerWaalsContact O-N 3.08Å; E158-L162 HydrophobicContact CG-CD1 4.14Å; E158-L162 HydrophobicContact CG-CG 4.34Å; E158-L162 PolarHBondContact O-N 3.48Å; E158-L184 HydrophobicContact CB-CD2 4.48Å; E158-L184 HydrophobicContact CG-CD2 4.08Å; E158-V257 HydrophobicContact CG-CG2 4.14Å; E158-S258 VanDerWaalsContact OE2-CB 3.32Å; E158-S258 WeakPolarHBondContact OE2-CB 3.44Å
159	Y	95.9	Very high	92.4	Very high	61 Å²	61	43 Å²	43	24%	0.239	22%	0.215	C	C	.	.	H	α-helix	trans	-54.1	-46.8	177.4	178.3	-98.3	0	0	0	112.2	S155 L163 P176 L179 L184	S155-Y159 WeakPolarHBondContact O-CB 3.1Å; S155-Y159 PolarHBondContact O-N 3.25Å; Y159-L163 HydrophobicContact CD1-CD1 3.8Å; Y159-L163 HydrophobicContact CE1-CD1 3.32Å; Y159-L163 HydrophobicContact CE1-CG 4.21Å; Y159-L163 WeakPolarHBondContact O-CG 3.18Å; Y159-L163 PolarHBondContact O-N 3.36Å; Y159-P176 HydrophobicContact CD2-CB 3.61Å; Y159-P176 HydrophobicContact CD2-CG 4.42Å; Y159-P176 HydrophobicContact CE2-CB 3.77Å; Y159-P176 HydrophobicContact CE2-CG 4.42Å; Y159-L179 HydrophobicContact CD1-CB 4.48Å; Y159-L179 HydrophobicContact CD2-CB 3.74Å; Y159-L179 HydrophobicContact CE2-CB 4.18Å; Y159-L179 HydrophobicContact CG-CB 3.91Å; Y159-L179 HydrophobicContact CG-CD2 4.15Å; Y159-L184 HydrophobicContact CD2-CD1 3.57Å; Y159-L184 HydrophobicContact CE2-CD1 4.5Å; Y159-L184 HydrophobicContact CG-CD1 4.36Å
160	R	94.6	Very high	92.8	Very high	109 Å²	109	40.2 Å²	40.2	41%	0.411	21%	0.205	S	C	.	.	H	α-helix	trans	-69.1	-35	178.3	-71.2	-179	-150.7	-179.5	8.5	112.6	E156 K157 E158 L163 R164	E156-R160 WeakPolarHBondContact O-CB 3.45Å; E156-R160 VanDerWaalsContact O-CG 3.26Å; E156-R160 WeakPolarHBondContact O-CG 3.32Å; E156-R160 PolarHBondContact O-N 3.43Å; E156-R160 VanDerWaalsContact O-N 3.12Å; E156-R160 IonicContact OE2-CZ 2.95Å; E156-R160 IonicContact OE2-NH2 3.81Å; E156-R160 PolarHBondContact OE2-NH2 3.33Å; K157-R160 PolarHBondContact O-N 3Å; E158-R160 VanDerWaalsContact C-N 3.31Å; E158-R160 PolarHBondContact O-N 3.17Å; R160-L163 PolarHBondContact O-N 2.98Å; R160-R164 WeakPolarHBondContact O-CG 3.31Å; R160-R164 PolarHBondContact O-N 2.72Å
161	N	95.6	Very high	93.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68.4	-47	177.7	-70.6	-5.2	0	0	0	110.7	R137 K157 E158 L163 R164 I165 L235 V257 A260	R137-N161 PolarHBondContact NH1-OD1 3.26Å; R137-N161 PolarHBondContact NH2-OD1 2.86Å; K157-N161 WeakPolarHBondContact O-CB 3.42Å; K157-N161 PolarHBondContact O-N 3.19Å; K157-N161 PolarHBondContact O-OD1 3.09Å; E158-N161 PolarHBondContact O-N 3.03Å; E158-N161 VanDerWaalsContact O-N 3.08Å; N161-L163 VanDerWaalsContact C-N 3.28Å; N161-L163 PolarHBondContact O-N 3.03Å; N161-R164 PolarHBondContact O-N 3.05Å; N161-R164 VanDerWaalsContact O-N 3.14Å; N161-I165 WeakPolarHBondContact O-CG1 3.29Å; N161-I165 PolarHBondContact O-N 3.38Å; N161-L235 HydrophobicContact CB-CD1 4.06Å; N161-V257 HydrophobicContact CB-CB 4.24Å; N161-V257 HydrophobicContact CB-CG2 3.77Å; N161-V257 PolarHBondContact ND2-O 2.78Å; N161-A260 PolarHBondContact ND2-O 3.13Å
162	L	97.2	Very high	93.8	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-58.5	-39.7	172.9	-73.5	175.6	0	0	0	111.7	E158 I165 N166 A173 P176 L184 M186 V257	E158-L162 HydrophobicContact CG-CD1 4.14Å; E158-L162 HydrophobicContact CG-CG 4.34Å; E158-L162 PolarHBondContact O-N 3.48Å; L162-I165 PolarHBondContact O-N 3.24Å; L162-N166 WeakPolarHBondContact O-CB 3.32Å; L162-N166 PolarHBondContact O-N 2.93Å; L162-N166 PolarHBondContact O-ND2 3.29Å; L162-A173 HydrophobicContact CD2-CB 4.4Å; L162-P176 HydrophobicContact CB-CB 4.05Å; L162-P176 HydrophobicContact CB-CG 3.63Å; L162-P176 HydrophobicContact CD1-CB 4.23Å; L162-L184 HydrophobicContact CD1-CD2 4.22Å; L162-M186 HydrophobicContact CD1-SD 4.35Å; L162-V257 HydrophobicContact CB-CG2 4.48Å; L162-V257 HydrophobicContact CD2-CG2 3.55Å; L162-V257 HydrophobicContact CG-CG2 3.57Å
163	L	96.5	Very high	94.1	Very high	57 Å²	57	40.2 Å²	40.2	30%	0.298	21%	0.207	S	C	.	.	H	α-helix	trans	-60.1	-46.9	174.1	-80.1	174.5	0	0	0	112	Y159 R160 N161 I165 N166 Q167 P176	Y159-L163 HydrophobicContact CD1-CD1 3.8Å; Y159-L163 HydrophobicContact CE1-CD1 3.32Å; Y159-L163 HydrophobicContact CE1-CG 4.21Å; Y159-L163 WeakPolarHBondContact O-CG 3.18Å; Y159-L163 PolarHBondContact O-N 3.36Å; R160-L163 PolarHBondContact O-N 2.98Å; N161-L163 VanDerWaalsContact C-N 3.28Å; N161-L163 PolarHBondContact O-N 3.03Å; L163-I165 VanDerWaalsContact C-N 3.33Å; L163-I165 PolarHBondContact O-N 3.29Å; L163-N166 PolarHBondContact O-N 3.14Å; L163-Q167 WeakPolarHBondContact O-CB 3.44Å; L163-Q167 WeakPolarHBondContact O-CG 3.24Å; L163-Q167 PolarHBondContact O-N 3.06Å; L163-P176 HydrophobicContact CB-CG 4.44Å; L163-P176 HydrophobicContact CD2-CG 3.77Å; L163-P176 HydrophobicContact CG-CG 3.71Å
164	R	95.4	Very high	94.6	Very high	76 Å²	76	38.4 Å²	38.4	29%	0.287	20%	0.2	S	C	.	.	H	α-helix	trans	-61.2	-41.7	177.6	-74.5	-177.5	-177	173.9	1.2	111.8	R160 N161 Q167 S168 L235 E262	R160-R164 WeakPolarHBondContact O-CG 3.31Å; R160-R164 PolarHBondContact O-N 2.72Å; N161-R164 PolarHBondContact O-N 3.05Å; N161-R164 VanDerWaalsContact O-N 3.14Å; R164-Q167 WeakPolarHBondContact O-CB 3.42Å; R164-Q167 PolarHBondContact O-N 2.98Å; R164-S168 PolarHBondContact O-N 3.41Å; R164-L235 HydrophobicContact CB-CD1 4.28Å; R164-E262 IonicContact CZ-OE1 2.76Å; R164-E262 IonicContact NH1-OE1 2.78Å; R164-E262 PolarHBondContact NH1-OE1 3.23Å; R164-E262 IonicContact NH2-OE1 3.92Å; R164-E262 PolarHBondContact NH2-OE1 2.97Å
165	I	97.1	Very high	95.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.1	-49.4	178.6	-67.3	168.7	0	0	0	110.5	N161 L162 L163 Q167 S168 I171 A173 L229 L235 V257	N161-I165 WeakPolarHBondContact O-CG1 3.29Å; N161-I165 PolarHBondContact O-N 3.38Å; L162-I165 PolarHBondContact O-N 3.24Å; L163-I165 VanDerWaalsContact C-N 3.33Å; L163-I165 PolarHBondContact O-N 3.29Å; I165-Q167 VanDerWaalsContact C-N 3.27Å; I165-Q167 PolarHBondContact O-N 3.05Å; I165-S168 VanDerWaalsContact O-CB 3.3Å; I165-S168 WeakPolarHBondContact O-CB 3.26Å; I165-S168 PolarHBondContact O-N 2.97Å; I165-S168 PolarHBondContact O-OG 3.08Å; I165-I171 HydrophobicContact CG2-CB 3.76Å; I165-I171 HydrophobicContact CG2-CD1 4.22Å; I165-I171 HydrophobicContact CG2-CG2 3.76Å; I165-A173 HydrophobicContact CG2-CB 3.66Å; I165-L229 HydrophobicContact CD1-CD1 3.73Å; I165-L229 HydrophobicContact CG1-CD1 3.65Å; I165-L235 HydrophobicContact CG1-CD1 4.36Å; I165-V257 HydrophobicContact CD1-CB 4.18Å; I165-V257 HydrophobicContact CD1-CG1 3.62Å; I165-V257 HydrophobicContact CD1-CG2 4.15Å
166	N	96.9	Very high	95.3	Very high	50 Å²	50	44 Å²	44	27%	0.267	23%	0.225	S	C	.	.	H	α-helix	trans	-62.9	-33.4	177.6	-82.1	-96.6	0	0	0	112.4	L162 L163 S168 G169 P174 K175	L162-N166 WeakPolarHBondContact O-CB 3.32Å; L162-N166 PolarHBondContact O-N 2.93Å; L162-N166 PolarHBondContact O-ND2 3.29Å; L163-N166 PolarHBondContact O-N 3.14Å; N166-S168 PolarHBondContact O-N 3.19Å; N166-G169 PolarHBondContact O-N 3.23Å; N166-P174 PolarHBondContact ND2-O 2.9Å; N166-P174 VanDerWaalsContact ND2-O 3.14Å; N166-K175 WeakPolarHBondContact OD1-CA 3.22Å; N166-K175 WeakPolarHBondContact OD1-CB 3.09Å
167	Q	95.5	Very high	95.5	Very high	152 Å²	152	43 Å²	43	71%	0.71	22%	0.222	S	C	*	.	H	α-helix	trans	-64.3	-24.3	174.4	-78.1	169.8	-9.9	0	0	113.2	L163 R164 I165 G169	L163-Q167 WeakPolarHBondContact O-CB 3.44Å; L163-Q167 WeakPolarHBondContact O-CG 3.24Å; L163-Q167 PolarHBondContact O-N 3.06Å; R164-Q167 WeakPolarHBondContact O-CB 3.42Å; R164-Q167 PolarHBondContact O-N 2.98Å; I165-Q167 VanDerWaalsContact C-N 3.27Å; I165-Q167 PolarHBondContact O-N 3.05Å; Q167-G169 VanDerWaalsContact C-N 3.27Å; Q167-G169 PolarHBondContact O-N 3.1Å
168	S	93.5	Very high	95.7	Very high	22 Å²	22	49.8 Å²	49.8	15%	0.154	25%	0.247	C	C	.	.	H	α-helix	trans	-68.3	-27.7	175.5	77.5	0	0	0	0	112.9	R164 I165 N166 L170	R164-S168 PolarHBondContact O-N 3.41Å; I165-S168 VanDerWaalsContact O-CB 3.3Å; I165-S168 WeakPolarHBondContact O-CB 3.26Å; I165-S168 PolarHBondContact O-N 2.97Å; I165-S168 PolarHBondContact O-OG 3.08Å; N166-S168 PolarHBondContact O-N 3.19Å; S168-L170 PolarHBondContact O-N 3.49Å; S168-L170 VanDerWaalsContact O-N 3.17Å; S168-L170 PolarHBondContact OG-N 2.98Å
169	G	93.7	Very high	95.8	Very high	69 Å²	69	51.7 Å²	51.7	71%	0.711	26%	0.257	S	S	*	.	S	Bend	trans	68.3	1	-178.4	0	0	0	0	0	115.7	N166 Q167	N166-G169 PolarHBondContact O-N 3.23Å; Q167-G169 VanDerWaalsContact C-N 3.27Å; Q167-G169 PolarHBondContact O-N 3.1Å
170	L	93.4	Very high	95.7	Very high	64 Å²	64	55.1 Å²	55.1	34%	0.335	27%	0.273	S	S	.	.	S	Bend	trans	-107.2	-39.6	-173.3	-68.3	172.2	0	0	0	112.6	S168 T228 K232 P308 D309	S168-L170 PolarHBondContact O-N 3.49Å; S168-L170 VanDerWaalsContact O-N 3.17Å; S168-L170 PolarHBondContact OG-N 2.98Å; L170-T228 HydrophobicContact CB-CG2 3.88Å; L170-T228 HydrophobicContact CD1-CG2 3.77Å; L170-T228 HydrophobicContact CG-CG2 4.48Å; L170-K232 HydrophobicContact CD1-CD 3.77Å; L170-P308 HydrophobicContact CD1-CB 4.43Å; L170-D309 HydrophobicContact CD1-CB 4.21Å
171	I	95.8	Very high	95.5	Very high	10 Å²	10	51.2 Å²	51.2	5%	0.051	27%	0.267	C	S	.	.	S	Bend	trans	-86.9	131.8	-177.6	-57.4	171.9	0	0	0	109.8	I165 A173 D225 T228 L229 M254	I165-I171 HydrophobicContact CG2-CB 3.76Å; I165-I171 HydrophobicContact CG2-CD1 4.22Å; I165-I171 HydrophobicContact CG2-CG2 3.76Å; I171-A173 PolarHBondContact O-N 3Å; I171-D225 WeakPolarHBondContact CD1-O 3.35Å; I171-D225 HydrophobicContact CG1-CB 4.23Å; I171-D225 HydrophobicContact CG2-CB 4.43Å; I171-T228 HydrophobicContact CD1-CG2 3.82Å; I171-T228 HydrophobicContact CG1-CG2 3.74Å; I171-L229 HydrophobicContact CD1-CB 3.93Å; I171-L229 HydrophobicContact CD1-CD1 4.18Å; I171-M254 HydrophobicContact CG2-CB 4.33Å
172	S	96.5	Very high	95.4	Very high	29 Å²	29	51.2 Å²	51.2	20%	0.203	27%	0.267	C	S	.	.			trans	-78.8	109.9	172.6	-60.6	0	0	0	0	110	V252 W253 M254	S172-V252 WeakPolarHBondContact CB-O 3.42Å; S172-W253 CarbonylContact O-C 3.56Å; S172-W253 WeakPolarHBondContact O-CA 3.37Å; S172-M254 PolarHBondContact O-N 2.85Å
173	A	96.8	Very high	95.2	Very high	5 Å²	5	51.1 Å²	51.1	4%	0.041	27%	0.267	C	S	.	.			trans	-146.4	154	178.4	0	0	0	0	0	110.6	L162 I165 I171 K175	L162-A173 HydrophobicContact CD2-CB 4.4Å; I165-A173 HydrophobicContact CG2-CB 3.66Å; I171-A173 PolarHBondContact O-N 3Å; A173-K175 PolarHBondContact O-N 2.83Å
174	P	96.9	Very high	95.2	Very high	8 Å²	8	48.4 Å²	48.4	5%	0.052	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-55.6	129.8	175.6	-22.7	30.9	0	0	0	111.7	N166 P176 M186 V189 M254 I255	N166-P174 PolarHBondContact ND2-O 2.9Å; N166-P174 VanDerWaalsContact ND2-O 3.14Å; P174-P176 WeakPolarHBondContact O-CD 3.41Å; P174-M186 HydrophobicContact CB-CB 4.19Å; P174-M186 HydrophobicContact CB-CG 4.14Å; P174-M186 HydrophobicContact CB-SD 3.93Å; P174-M186 HydrophobicContact CG-SD 4.49Å; P174-V189 HydrophobicContact CB-CG2 4.4Å; P174-V189 HydrophobicContact CG-CG2 3.85Å; P174-M254 VanDerWaalsContact CD-O 3.31Å; P174-M254 WeakPolarHBondContact CD-O 3.34Å; P174-I255 HydrophobicContact CG-CG2 3.85Å
175	K	97	Very high	95.3	Very high	118 Å²	118	44.9 Å²	44.9	51%	0.513	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-78.4	121.5	177.3	-176.7	177.9	179.8	177.7	0	109.5	N166 A173 L177 M186 T187	N166-K175 WeakPolarHBondContact OD1-CA 3.22Å; N166-K175 WeakPolarHBondContact OD1-CB 3.09Å; A173-K175 PolarHBondContact O-N 2.83Å; K175-L177 HydrophobicContact CG-CD2 4.5Å; K175-M186 CarbonylContact O-C 3.57Å; K175-M186 WeakPolarHBondContact O-CA 3.35Å; K175-M186 WeakPolarHBondContact O-CB 3.43Å; K175-T187 HydrophobicContact CB-CG2 3.77Å; K175-T187 PolarHBondContact N-OG1 2.71Å; K175-T187 PolarHBondContact O-N 3.01Å
176	P	96.9	Very high	95.3	Very high	6 Å²	6	45.6 Å²	45.6	4%	0.039	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	131	179.1	33.8	-34.1	0	0	0	109.6	Y159 L162 L163 P174 L184	Y159-P176 HydrophobicContact CD2-CB 3.61Å; Y159-P176 HydrophobicContact CD2-CG 4.42Å; Y159-P176 HydrophobicContact CE2-CB 3.77Å; Y159-P176 HydrophobicContact CE2-CG 4.42Å; L162-P176 HydrophobicContact CB-CB 4.05Å; L162-P176 HydrophobicContact CB-CG 3.63Å; L162-P176 HydrophobicContact CD1-CB 4.23Å; L163-P176 HydrophobicContact CB-CG 4.44Å; L163-P176 HydrophobicContact CD2-CG 3.77Å; L163-P176 HydrophobicContact CG-CG 3.71Å; P174-P176 WeakPolarHBondContact O-CD 3.41Å; P176-L184 HydrophobicContact CB-CD1 4.33Å
177	L	95.5	Very high	95.3	Very high	57 Å²	57	45 Å²	45	30%	0.298	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	-51	-173.9	-60.5	175.6	0	0	0	112.1	F113 K175 L185	F113-L177 HydrophobicContact CD1-CD1 3.3Å; F113-L177 HydrophobicContact CE1-CD1 3.28Å; F113-L177 HydrophobicContact CG-CD1 4.33Å; F113-L177 HydrophobicContact CZ-CD1 4.29Å; K175-L177 HydrophobicContact CG-CD2 4.5Å; L177-L185 HydrophobicContact CB-CD2 4.15Å; L177-L185 HydrophobicContact CB-CG 4.22Å; L177-L185 HydrophobicContact CD1-CD2 4.32Å; L177-L185 HydrophobicContact CD1-CG 4.24Å; L177-L185 PolarHBondContact N-O 2.9Å
178	R	95.1	Very high	95.3	Very high	147 Å²	147	39 Å²	39	56%	0.555	21%	0.213	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-146.4	139.2	-177.3	-70.7	-80.7	-177.2	145.7	-1.4	109.6	M81 L185	M81-R178 HydrophobicContact CE-CB 4.34Å; R178-L185 HydrophobicContact CB-CB 4.24Å; R178-L185 HydrophobicContact CB-CD2 4.33Å; R178-L185 PolarHBondContact N-O 3.03Å; R178-L185 PolarHBondContact O-N 3.16Å
179	L	95.6	Very high	95.4	Very high	44 Å²	44	38.5 Å²	38.5	23%	0.23	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	130.3	169	176.5	72.2	0	0	0	109.6	E156 Y159 L184	E156-L179 VanDerWaalsContact CA-CD2 3.47Å; E156-L179 HydrophobicContact CB-CD2 4.13Å; E156-L179 HydrophobicContact CG-CD2 3.64Å; Y159-L179 HydrophobicContact CD1-CB 4.48Å; Y159-L179 HydrophobicContact CD2-CB 3.74Å; Y159-L179 HydrophobicContact CE2-CB 4.18Å; Y159-L179 HydrophobicContact CG-CB 3.91Å; Y159-L179 HydrophobicContact CG-CD2 4.15Å; L179-L184 HydrophobicContact CB-CD1 4.43Å; L179-L184 HydrophobicContact CD1-CB 3.99Å; L179-L184 HydrophobicContact CD1-CD1 4.34Å
180	K	94.1	Very high	95.4	Very high	132 Å²	132	36 Å²	36	57%	0.574	18%	0.184	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-137.4	107.9	170.7	-170.6	69.1	172.3	-175.5	0	110.3	I77 M81 V182 V183	I77-K180 HydrophobicContact CG1-CG 4.34Å; I77-K180 HydrophobicContact CG2-CB 3.74Å; I77-K180 HydrophobicContact CG2-CG 3.71Å; M81-K180 HydrophobicContact CE-CB 3.58Å; K180-V182 PolarHBondContact O-N 3.38Å; K180-V182 VanDerWaalsContact O-N 3.11Å; K180-V183 PolarHBondContact N-O 2.87Å; K180-V183 PolarHBondContact O-N 3.38Å; K180-V183 VanDerWaalsContact O-N 3.09Å
181	G	91.3	Very high	95.3	Very high	27 Å²	27	38 Å²	38	28%	0.278	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	-114.6	-178.2	0	0	0	0	0	110.8	S155	S155-G181 PolarHBondContact OG-O 3.06Å
182	V	92.3	Very high	94.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	15.2	-179.6	-54.4	0	0	0	0	112.9	S74 Y118 T120 W148 V151 K180	S74-V182 VanDerWaalsContact OG-CG2 3.3Å; S74-V182 WeakPolarHBondContact OG-CG2 3.41Å; Y118-V182 VanDerWaalsContact CD2-O 3.29Å; Y118-V182 WeakPolarHBondContact CD2-O 3.29Å; Y118-V182 PolarHBondContact N-O 3.13Å; T120-V182 HydrophobicContact CG2-CB 4.26Å; T120-V182 HydrophobicContact CG2-CG1 3.79Å; T120-V182 HydrophobicContact CG2-CG2 4.03Å; W148-V182 HydrophobicContact CD2-CG1 4.41Å; W148-V182 HydrophobicContact CE3-CG1 4.46Å; W148-V182 HydrophobicContact CH2-CB 4.49Å; W148-V182 HydrophobicContact CH2-CG1 4.18Å; W148-V182 HydrophobicContact CH2-CG2 3.56Å; W148-V182 HydrophobicContact CZ2-CG1 4.12Å; W148-V182 HydrophobicContact CZ2-CG2 4.2Å; W148-V182 HydrophobicContact CZ3-CG1 4.35Å; W148-V182 HydrophobicContact CZ3-CG2 3.85Å; V151-V182 HydrophobicContact CB-CG1 4.11Å; V151-V182 HydrophobicContact CG1-CB 4.12Å; V151-V182 HydrophobicContact CG1-CG1 3.63Å; K180-V182 PolarHBondContact O-N 3.38Å; K180-V182 VanDerWaalsContact O-N 3.11Å
183	V	94.5	Very high	94.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	116.3	178.9	-178.3	0	0	0	0	108.8	I77 L78 M81 I115 V117 K180	I77-V183 HydrophobicContact CB-CG2 4.18Å; I77-V183 HydrophobicContact CG2-CB 3.91Å; I77-V183 HydrophobicContact CG2-CG1 4.48Å; I77-V183 HydrophobicContact CG2-CG2 3.8Å; L78-V183 HydrophobicContact CD2-CG1 3.63Å; L78-V183 HydrophobicContact CD2-CG2 4.43Å; M81-V183 HydrophobicContact CE-CG1 4.45Å; M81-V183 HydrophobicContact SD-CG1 3.96Å; I115-V183 HydrophobicContact CG2-CG1 3.51Å; V117-V183 HydrophobicContact CG1-CG2 4.44Å; V117-V183 HydrophobicContact CG2-CG2 4.4Å; K180-V183 PolarHBondContact N-O 2.87Å; K180-V183 PolarHBondContact O-N 3.38Å; K180-V183 VanDerWaalsContact O-N 3.09Å
184	L	96.4	Very high	94	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	118.2	178.2	171	61	0	0	0	109.6	I115 K116 Y118 E158 Y159 L162 P176 L179	I115-L184 CarbonylContact C-O 3.48Å; I115-L184 WeakPolarHBondContact CA-O 3.38Å; K116-L184 HydrophobicContact CB-CB 4.32Å; K116-L184 PolarHBondContact N-O 3Å; K116-L184 PolarHBondContact O-N 3.4Å; Y118-L184 HydrophobicContact CE2-CB 4.2Å; E158-L184 HydrophobicContact CB-CD2 4.48Å; E158-L184 HydrophobicContact CG-CD2 4.08Å; Y159-L184 HydrophobicContact CD2-CD1 3.57Å; Y159-L184 HydrophobicContact CE2-CD1 4.5Å; Y159-L184 HydrophobicContact CG-CD1 4.36Å; L162-L184 HydrophobicContact CD1-CD2 4.22Å; P176-L184 HydrophobicContact CB-CD1 4.33Å; L179-L184 HydrophobicContact CB-CD1 4.43Å; L179-L184 HydrophobicContact CD1-CB 3.99Å; L179-L184 HydrophobicContact CD1-CD1 4.34Å
185	L	96.4	Very high	93.8	Very high	3 Å²	3	52 Å²	52	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	130.5	171.9	179.3	72.6	0	0	0	109.6	I86 V105 F113 I115 L177 R178	I86-L185 HydrophobicContact CG2-CD2 3.34Å; V105-L185 HydrophobicContact CG2-CD1 4.06Å; F113-L185 HydrophobicContact CB-CD1 3.79Å; F113-L185 HydrophobicContact CG-CD1 4.4Å; I115-L185 HydrophobicContact CD1-CD1 4.2Å; I115-L185 HydrophobicContact CG1-CD1 3.58Å; L177-L185 HydrophobicContact CB-CD2 4.15Å; L177-L185 HydrophobicContact CB-CG 4.22Å; L177-L185 HydrophobicContact CD1-CD2 4.32Å; L177-L185 HydrophobicContact CD1-CG 4.24Å; L177-L185 PolarHBondContact N-O 2.9Å; R178-L185 HydrophobicContact CB-CB 4.24Å; R178-L185 HydrophobicContact CB-CD2 4.33Å; R178-L185 PolarHBondContact N-O 3.03Å; R178-L185 PolarHBondContact O-N 3.16Å
186	M	97	Very high	93.7	Very high	14 Å²	14	46.9 Å²	46.9	7%	0.069	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	168.1	179.5	60.8	-165.9	165.5	0	0	111.3	A114 K116 L162 P174 K175	A114-M186 HydrophobicContact CB-CE 4.09Å; A114-M186 HydrophobicContact CB-CG 4.03Å; A114-M186 PolarHBondContact N-O 2.83Å; A114-M186 PolarHBondContact O-N 3.23Å; K116-M186 HydrophobicContact CB-CE 3.83Å; K116-M186 HydrophobicContact CD-CE 4.42Å; L162-M186 HydrophobicContact CD1-SD 4.35Å; P174-M186 HydrophobicContact CB-CB 4.19Å; P174-M186 HydrophobicContact CB-CG 4.14Å; P174-M186 HydrophobicContact CB-SD 3.93Å; P174-M186 HydrophobicContact CG-SD 4.49Å; K175-M186 CarbonylContact O-C 3.57Å; K175-M186 WeakPolarHBondContact O-CA 3.35Å; K175-M186 WeakPolarHBondContact O-CB 3.43Å
187	T	96.5	Very high	93.5	Very high	38 Å²	38	48.9 Å²	48.9	23%	0.233	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	142.8	173.4	55.4	0	0	0	0	111.1	K175	K175-T187 HydrophobicContact CB-CG2 3.77Å; K175-T187 PolarHBondContact N-OG1 2.71Å; K175-T187 PolarHBondContact O-N 3.01Å
188	F	95.9	Very high	93.4	Very high	26 Å²	26	49.8 Å²	49.8	11%	0.114	26%	0.262	C	S	.	.			trans	-74.8	140.4	172.6	-175.3	-113	0	0	0	110.3	I94 H104 D112 A114 G193 I194 P195	I94-F188 HydrophobicContact CD1-CD2 3.93Å; I94-F188 HydrophobicContact CD1-CE2 3.52Å; I94-F188 HydrophobicContact CG1-CE2 4.22Å; H104-F188 AromaticContact CD2-CD2 3.95Å; H104-F188 AromaticContact CD2-CE2 3.9Å; D112-F188 HydrophobicContact CB-CB 3.81Å; D112-F188 HydrophobicContact CB-CD1 3.77Å; D112-F188 HydrophobicContact CB-CG 4.01Å; D112-F188 WeakPolarHBondContact O-CB 3.44Å; A114-F188 HydrophobicContact CB-CD2 4.33Å; F188-G193 WeakPolarHBondContact CZ-O 3.48Å; F188-I194 WeakPolarHBondContact CE1-O 3.22Å; F188-P195 HydrophobicContact CE2-CB 4.18Å; F188-P195 HydrophobicContact CZ-CB 4.09Å
189	V	95.5	Very high	93.3	Very high	11 Å²	11	42.8 Å²	42.8	7%	0.067	24%	0.236	C	C	.	.			trans	-112.2	103.1	173.7	-177.7	0	0	0	0	107	P174 A196 L246 L248 W253	P174-V189 HydrophobicContact CB-CG2 4.4Å; P174-V189 HydrophobicContact CG-CG2 3.85Å; V189-A196 HydrophobicContact CG1-CB 3.95Å; V189-A196 PolarHBondContact O-N 3.3Å; V189-L246 HydrophobicContact CB-CD1 4.08Å; V189-L246 HydrophobicContact CG1-CD1 4.06Å; V189-L248 HydrophobicContact CG1-CD2 4.06Å; V189-W253 HydrophobicContact CB-CE3 4.5Å; V189-W253 HydrophobicContact CG1-CB 4.05Å; V189-W253 HydrophobicContact CG1-CD2 3.68Å; V189-W253 HydrophobicContact CG1-CE3 4.03Å; V189-W253 HydrophobicContact CG1-CG 3.7Å; V189-W253 HydrophobicContact CG2-CD2 4.14Å; V189-W253 HydrophobicContact CG2-CE3 3.59Å; V189-W253 HydrophobicContact CG2-CZ3 3.94Å
190	G	93.3	Very high	93.1	Very high	18 Å²	18	43.7 Å²	43.7	19%	0.186	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.4	-175.3	-171.5	0	0	0	0	0	111.2	I194	G190-I194 CarbonylContact C-O 3.56Å; G190-I194 WeakPolarHBondContact CA-O 3.46Å
191	K	91.5	Very high	92.9	Very high	104 Å²	104	41 Å²	41	45%	0.452	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	136.6	179.2	-73.7	178.1	170.5	-178.6	0	109.9	G193 I194 L248 D249	K191-G193 VanDerWaalsContact C-N 3.25Å; K191-G193 PolarHBondContact O-N 3.32Å; K191-G193 VanDerWaalsContact O-N 3.16Å; K191-I194 PolarHBondContact N-O 2.94Å; K191-I194 WeakPolarHBondContact O-CA 3.03Å; K191-I194 WeakPolarHBondContact O-CB 3.4Å; K191-I194 PolarHBondContact O-N 2.82Å; K191-L248 HydrophobicContact CD-CD1 4.26Å; K191-L248 HydrophobicContact CG-CD1 4.14Å; K191-D249 VanDerWaalsContact CE-CG 3.49Å; K191-D249 WeakPolarHBondContact CE-OD1 3.37Å; K191-D249 WeakPolarHBondContact CE-OD2 3.23Å; K191-D249 IonicContact NZ-OD1 3.9Å; K191-D249 PolarHBondContact NZ-OD1 3.28Å; K191-D249 IonicContact NZ-OD2 2.71Å; K191-D249 PolarHBondContact NZ-OD2 2.85Å
192	D	87.7	Confident	92.7	Very high	151 Å²	151	40 Å²	40	81%	0.807	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	39.8	173.6	-53.4	-47.3	0	0	0	114.2	I194	D192-I194 PolarHBondContact O-N 3.38Å
193	G	84.8	Confident	91.8	Very high	22 Å²	22	41.8 Å²	41.8	23%	0.227	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	-4.3	-176.8	0	0	0	0	0	115.7	F188 K191	F188-G193 WeakPolarHBondContact CZ-O 3.48Å; K191-G193 VanDerWaalsContact C-N 3.25Å; K191-G193 PolarHBondContact O-N 3.32Å; K191-G193 VanDerWaalsContact O-N 3.16Å
194	I	90.3	Very high	90.2	Very high	120 Å²	120	49 Å²	49	62%	0.615	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	122.4	175.5	-56.8	174.1	0	0	0	109.1	F188 G190 K191 D192	F188-I194 WeakPolarHBondContact CE1-O 3.22Å; G190-I194 CarbonylContact C-O 3.56Å; G190-I194 WeakPolarHBondContact CA-O 3.46Å; K191-I194 PolarHBondContact N-O 2.94Å; K191-I194 WeakPolarHBondContact O-CA 3.03Å; K191-I194 WeakPolarHBondContact O-CB 3.4Å; K191-I194 PolarHBondContact O-N 2.82Å; D192-I194 PolarHBondContact O-N 3.38Å
195	P	92.8	Very high	88.5	Confident	54 Å²	54	54.5 Å²	54.5	35%	0.351	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	145.2	-179.3	30.5	-37.6	0	0	0	110.7	I94 F188	I94-P195 HydrophobicContact CG2-CB 3.69Å; I94-P195 HydrophobicContact CG2-CG 3.9Å; F188-P195 HydrophobicContact CE2-CB 4.18Å; F188-P195 HydrophobicContact CZ-CB 4.09Å
196	A	93.7	Very high	86.2	Confident	11 Å²	11	62 Å²	62	9%	0.091	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-59.8	136.4	172.4	0	0	0	0	0	110.6	V189 L246 L248	V189-A196 HydrophobicContact CG1-CB 3.95Å; V189-A196 PolarHBondContact O-N 3.3Å; A196-L246 HydrophobicContact CB-CB 4.05Å; A196-L246 HydrophobicContact CB-CD1 4.37Å; A196-L248 HydrophobicContact CB-CB 4.06Å; A196-L248 HydrophobicContact CB-CD1 4.45Å
197	P	93.4	Very high	83.9	Confident	48 Å²	48	66.5 Å²	66.5	31%	0.312	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-65.1	152.6	177.8	28	-35.4	0	0	0	111.1	V202 L246 Y247	P197-V202 HydrophobicContact CB-CG2 4.17Å; P197-V202 HydrophobicContact CG-CG2 3.9Å; P197-L246 CarbonylContact O-C 3.59Å; P197-L246 WeakPolarHBondContact O-CA 3.46Å; P197-Y247 WeakPolarHBondContact CD-O 3.39Å; P197-Y247 PolarHBondContact O-N 3.39Å
198	K	93.7	Very high	81.8	Confident	76 Å²	76	72.1 Å²	72.1	33%	0.33	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-70.5	149.3	170.1	-64.1	172.5	-176.8	174.8	0	109.4	K200 D201 V202 L245 L246	K198-K200 PolarHBondContact O-N 3.01Å; K198-K200 VanDerWaalsContact O-N 3.16Å; K198-D201 PolarHBondContact O-N 3.43Å; K198-V202 PolarHBondContact O-N 3.48Å; K198-L245 CarbonylContact C-O 3.55Å; K198-L245 WeakPolarHBondContact CA-O 3.26Å; K198-L246 HydrophobicContact CB-CD2 4.44Å; K198-L246 HydrophobicContact CG-CD2 3.79Å
199	L	92.7	Very high	79.6	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-58.9	-33.2	-178.4	-166	62.6	0	0	0	112.1	D201 V202 C203 W215 L218 E242 L245 Y247 F282 F283	L199-D201 VanDerWaalsContact C-N 3.3Å; L199-D201 PolarHBondContact O-N 2.88Å; L199-V202 PolarHBondContact O-N 3.02Å; L199-C203 PolarHBondContact O-SG 2.91Å; L199-C203 VanDerWaalsContact O-SG 3.4Å; L199-W215 HydrophobicContact CD1-CH2 4.46Å; L199-W215 HydrophobicContact CD1-CZ3 3.88Å; L199-W215 HydrophobicContact CG-CZ3 4.21Å; L199-L218 HydrophobicContact CD1-CD1 4.21Å; L199-E242 PolarHBondContact N-O 2.98Å; L199-L245 HydrophobicContact CB-CB 3.98Å; L199-L245 HydrophobicContact CD2-CB 4.18Å; L199-L245 HydrophobicContact CD2-CD1 3.9Å; L199-L245 PolarHBondContact N-O 2.91Å; L199-Y247 HydrophobicContact CD1-CD2 4.49Å; L199-F282 HydrophobicContact CB-CZ 4.47Å; L199-F282 HydrophobicContact CD2-CD1 4.24Å; L199-F282 HydrophobicContact CD2-CE1 3.47Å; L199-F282 VanDerWaalsContact CD2-CE1 3.47Å; L199-F282 HydrophobicContact CD2-CZ 4.06Å; L199-F282 HydrophobicContact CG-CE1 3.67Å; L199-F282 HydrophobicContact CG-CZ 3.73Å; L199-F283 HydrophobicContact CD2-CZ 4.1Å
200	K	91.3	Very high	77.5	Confident	63 Å²	63	83.7 Å²	83.7	27%	0.274	44%	0.442	S	S	.	.	H	α-helix	trans	-52.9	-44.9	169.8	179.2	178.9	172.2	-176.7	0	113.6	K198 C203 F204 E242 Y243	K198-K200 PolarHBondContact O-N 3.01Å; K198-K200 VanDerWaalsContact O-N 3.16Å; K200-C203 WeakPolarHBondContact O-CB 3.44Å; K200-F204 HydrophobicContact CG-CE2 4.43Å; K200-F204 WeakPolarHBondContact O-CD2 3.45Å; K200-E242 HydrophobicContact CB-CB 4.25Å; K200-E242 HydrophobicContact CB-CG 3.7Å; K200-E242 HydrophobicContact CG-CG 4.26Å; K200-E242 PolarHBondContact N-O 3.14Å; K200-Y243 HydrophobicContact CD-CD1 3.85Å; K200-Y243 HydrophobicContact CD-CE1 3.22Å; K200-Y243 HydrophobicContact CD-CE2 4.27Å; K200-Y243 VanDerWaalsContact CD-CZ 3.45Å; K200-Y243 WeakPolarHBondContact CE-OH 3.42Å; K200-Y243 PolarHBondContact NZ-OH 2.86Å
201	D	90.1	Very high	76.1	Confident	74 Å²	74	89.1 Å²	89.1	40%	0.396	47%	0.466	S	S	.	.	H	α-helix	trans	-82.1	-22.8	-169	-57.6	-34.2	0	0	0	111	K198 L199 C203 F204	K198-D201 PolarHBondContact O-N 3.43Å; L199-D201 VanDerWaalsContact C-N 3.3Å; L199-D201 PolarHBondContact O-N 2.88Å; D201-C203 VanDerWaalsContact C-N 3.26Å; D201-C203 PolarHBondContact O-N 3.06Å; D201-F204 PolarHBondContact O-N 3.24Å
202	V	86.9	Confident	75.4	Confident	8 Å²	8	89.5 Å²	89.5	5%	0.048	48%	0.478	C	S	.	.	H	α-helix	trans	-63.5	-33.3	172.5	-176.2	0	0	0	0	111.4	P197 K198 L199 F204 Q205 P213 Y247	P197-V202 HydrophobicContact CB-CG2 4.17Å; P197-V202 HydrophobicContact CG-CG2 3.9Å; K198-V202 PolarHBondContact O-N 3.48Å; L199-V202 PolarHBondContact O-N 3.02Å; V202-F204 PolarHBondContact O-N 2.85Å; V202-Q205 PolarHBondContact O-N 3.28Å; V202-P213 HydrophobicContact CG1-CB 4.5Å; V202-P213 HydrophobicContact CG1-CG 3.85Å; V202-Y247 HydrophobicContact CG1-CD1 4.28Å; V202-Y247 HydrophobicContact CG2-CD1 3.93Å; V202-Y247 HydrophobicContact CG2-CG 4.06Å
203	C	72.5	Confident	75.2	Confident	37 Å²	37	83.2 Å²	83.2	25%	0.25	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.1	179.3	-55.7	0	0	0	0	113.9	L199 K200 D201 W215 F282 Q286	L199-C203 PolarHBondContact O-SG 2.91Å; L199-C203 VanDerWaalsContact O-SG 3.4Å; K200-C203 WeakPolarHBondContact O-CB 3.44Å; D201-C203 VanDerWaalsContact C-N 3.26Å; D201-C203 PolarHBondContact O-N 3.06Å; C203-W215 HydrophobicContact CB-CH2 4.47Å; C203-W215 WeakPolarHBondContact SG-CH2 3.49Å; C203-F282 VanDerWaalsContact SG-CE2 3.59Å; C203-F282 WeakPolarHBondContact SG-CZ 3.38Å; C203-Q286 VanDerWaalsContact SG-CD 3.5Å; C203-Q286 PolarHBondContact SG-NE2 2.92Å
204	F	62.5	Low	75.5	Confident	150 Å²	150	86.7 Å²	86.7	66%	0.658	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-3	-176.9	-65.7	-75.3	0	0	0	113.3	K200 D201 V202 E206	K200-F204 HydrophobicContact CG-CE2 4.43Å; K200-F204 WeakPolarHBondContact O-CD2 3.45Å; D201-F204 PolarHBondContact O-N 3.24Å; V202-F204 PolarHBondContact O-N 2.85Å; F204-E206 PolarHBondContact O-N 3.38Å
205	Q	59.3	Low	75.6	Confident	116 Å²	116	83 Å²	83	54%	0.542	44%	0.437	S	S	.	.	S	Bend	trans	-77	85.3	174	-65.7	-174.5	-21.3	0	0	107.6	V202 S207	V202-Q205 PolarHBondContact O-N 3.28Å; Q205-S207 PolarHBondContact O-N 3.12Å
206	E	48.4	Very low	75.7	Confident	162 Å²	162	83 Å²	83	76%	0.757	44%	0.442	S	S	*	.			trans	-49.7	127.3	178	-70	177	162.1	0	0	110.8	F204 D208	F204-E206 PolarHBondContact O-N 3.38Å; E206-D208 PolarHBondContact O-N 2.9Å
207	S	49.4	Very low	75.7	Confident	108 Å²	108	85.1 Å²	85.1	76%	0.755	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	29.1	-20.6	148.4	13	0	0	0	0	123.6	Q205	Q205-S207 PolarHBondContact O-N 3.12Å
208	D	51.7	Low	75.8	Confident	156 Å²	156	82.9 Å²	82.9	83%	0.834	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-9.4	-176.8	-72	-23.3	0	0	0	113.3	E206	E206-D208 PolarHBondContact O-N 2.9Å
209	C	49.6	Very low	75.9	Confident	73 Å²	73	79.4 Å²	79.4	49%	0.493	43%	0.426	S	S	.	.	S	Bend	trans	-81.5	121.8	170.5	-61.8	0	0	0	0	109.8	D211	C209-D211 PolarHBondContact O-N 3.19Å
210	K	52.7	Low	76.1	Confident	206 Å²	206	81.7 Å²	81.7	90%	0.896	44%	0.436	S	S	*	.	S	Bend	trans	-56.4	-8.9	-177.7	-75.8	-179.5	175.7	177.8	0	115.8
211	D	63.8	Low	76.3	Confident	132 Å²	132	80.3 Å²	80.3	71%	0.706	43%	0.431	S	S	*	.			trans	-117.6	68.8	-174.3	-58.7	-41.5	0	0	0	110.2	C209 P213	C209-D211 PolarHBondContact O-N 3.19Å; D211-P213 WeakPolarHBondContact O-CD 3.34Å
212	T	75.7	Confident	76.7	Confident	113 Å²	113	76.9 Å²	76.9	69%	0.693	41%	0.412	S	S	*	.			trans	-63.2	123.3	168.3	52.8	0	0	0	0	108.6	D214	T212-D214 PolarHBondContact O-N 3.32Å
213	P	84.1	Confident	77.1	Confident	18 Å²	18	76.5 Å²	76.5	12%	0.117	41%	0.41	C	S	.	.			trans	-62.6	134.4	179.6	26.6	-35.9	0	0	0	110.3	V202 D211 W215 L218 Y247	V202-P213 HydrophobicContact CG1-CB 4.5Å; V202-P213 HydrophobicContact CG1-CG 3.85Å; D211-P213 WeakPolarHBondContact O-CD 3.34Å; P213-W215 VanDerWaalsContact C-N 3.34Å; P213-W215 HydrophobicContact CG-CD2 4.18Å; P213-W215 HydrophobicContact CG-CH2 3.98Å; P213-W215 HydrophobicContact CG-CZ2 3.48Å; P213-W215 VanDerWaalsContact CG-CZ2 3.48Å; P213-W215 PolarHBondContact O-N 3.43Å; P213-L218 HydrophobicContact CB-CD1 3.75Å; P213-Y247 HydrophobicContact CB-CE2 4.17Å
214	D	91.2	Very high	78.3	Confident	95 Å²	95	75.5 Å²	75.5	51%	0.508	40%	0.401	S	S	.	.			trans	-73.4	91.5	170.1	173	12.6	0	0	0	109.4	T212 A216 S217 L218	T212-D214 PolarHBondContact O-N 3.32Å; D214-A216 PolarHBondContact O-N 3.27Å; D214-A216 PolarHBondContact OD1-N 3.18Å; D214-S217 VanDerWaalsContact CB-OG 3.31Å; D214-S217 WeakPolarHBondContact CB-OG 3.45Å; D214-S217 PolarHBondContact O-N 2.81Å; D214-S217 PolarHBondContact O-OG 2.82Å; D214-S217 PolarHBondContact OD1-N 3.4Å; D214-S217 WeakPolarHBondContact OD2-CB 3.47Å; D214-S217 PolarHBondContact OD2-OG 3.22Å; D214-L218 WeakPolarHBondContact O-CG 3.33Å; D214-L218 PolarHBondContact O-N 3.09Å
215	W	93.1	Very high	79.9	Confident	43 Å²	43	68.6 Å²	68.6	16%	0.163	37%	0.371	C	S	.	.	H	α-helix	trans	-59	-29.4	-176.7	-64.1	111.8	0	0	0	113.4	L199 C203 P213 L218 Y219 F282 F283 Q286 V288	L199-W215 HydrophobicContact CD1-CH2 4.46Å; L199-W215 HydrophobicContact CD1-CZ3 3.88Å; L199-W215 HydrophobicContact CG-CZ3 4.21Å; C203-W215 HydrophobicContact CB-CH2 4.47Å; C203-W215 WeakPolarHBondContact SG-CH2 3.49Å; P213-W215 VanDerWaalsContact C-N 3.34Å; P213-W215 HydrophobicContact CG-CD2 4.18Å; P213-W215 HydrophobicContact CG-CH2 3.98Å; P213-W215 HydrophobicContact CG-CZ2 3.48Å; P213-W215 VanDerWaalsContact CG-CZ2 3.48Å; P213-W215 PolarHBondContact O-N 3.43Å; W215-L218 HydrophobicContact CE3-CD1 4.15Å; W215-L218 HydrophobicContact CZ3-CD1 4.39Å; W215-Y219 WeakPolarHBondContact O-CB 3.43Å; W215-Y219 PolarHBondContact O-N 3.09Å; W215-F282 HydrophobicContact CH2-CZ 4.28Å; W215-F282 AromaticContact CZ3-CE1 3.91Å; W215-F282 HydrophobicContact CZ3-CE1 3.91Å; W215-F282 AromaticContact CZ3-CZ 3.88Å; W215-F282 HydrophobicContact CZ3-CZ 3.88Å; W215-F283 HydrophobicContact CE3-CD1 4.43Å; W215-F283 HydrophobicContact CE3-CE1 4.19Å; W215-Q286 HydrophobicContact CB-CB 4.31Å; W215-Q286 HydrophobicContact CD2-CB 3.72Å; W215-Q286 HydrophobicContact CD2-CG 3.8Å; W215-Q286 HydrophobicContact CE3-CB 4.13Å; W215-Q286 HydrophobicContact CE3-CG 3.79Å; W215-Q286 HydrophobicContact CG-CB 3.8Å; W215-Q286 HydrophobicContact CG-CG 4.42Å; W215-Q286 HydrophobicContact CH2-CG 4.17Å; W215-Q286 HydrophobicContact CZ2-CG 4.15Å; W215-Q286 HydrophobicContact CZ3-CG 3.98Å; W215-V288 HydrophobicContact CB-CG2 3.41Å; W215-V288 VanDerWaalsContact CB-CG2 3.41Å
216	A	93.2	Very high	81.7	Confident	55 Å²	55	63.3 Å²	63.3	46%	0.455	35%	0.347	S	S	.	.	H	α-helix	trans	-71.1	-44.1	179.1	0	0	0	0	0	111.3	D214 Y219 F220	D214-A216 PolarHBondContact O-N 3.27Å; D214-A216 PolarHBondContact OD1-N 3.18Å; A216-Y219 PolarHBondContact O-N 3.05Å; A216-F220 PolarHBondContact O-N 3.23Å
217	S	94.1	Very high	84	Confident	54 Å²	54	55.7 Å²	55.7	38%	0.378	31%	0.311	S	S	.	.	H	α-helix	trans	-69.1	-34.6	174.9	61.2	0	0	0	0	112.6	D214 F220 Q221	D214-S217 VanDerWaalsContact CB-OG 3.31Å; D214-S217 WeakPolarHBondContact CB-OG 3.45Å; D214-S217 PolarHBondContact O-N 2.81Å; D214-S217 PolarHBondContact O-OG 2.82Å; D214-S217 PolarHBondContact OD1-N 3.4Å; D214-S217 WeakPolarHBondContact OD2-CB 3.47Å; D214-S217 PolarHBondContact OD2-OG 3.22Å; S217-F220 WeakPolarHBondContact O-CB 3.34Å; S217-F220 PolarHBondContact O-N 3.03Å; S217-Q221 WeakPolarHBondContact O-CB 3.29Å; S217-Q221 PolarHBondContact O-N 2.9Å
218	L	95.3	Very high	86.2	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-65.5	-40.7	173.1	-64	177.6	0	0	0	111.9	L199 P213 D214 W215 Q221 V222 Y247 V252 F283	L199-L218 HydrophobicContact CD1-CD1 4.21Å; P213-L218 HydrophobicContact CB-CD1 3.75Å; D214-L218 WeakPolarHBondContact O-CG 3.33Å; D214-L218 PolarHBondContact O-N 3.09Å; W215-L218 HydrophobicContact CE3-CD1 4.15Å; W215-L218 HydrophobicContact CZ3-CD1 4.39Å; L218-Q221 PolarHBondContact O-N 3.46Å; L218-V222 WeakPolarHBondContact O-CG2 3.31Å; L218-V222 PolarHBondContact O-N 3.05Å; L218-Y247 HydrophobicContact CD1-CD2 4.09Å; L218-Y247 HydrophobicContact CD1-CE2 3.94Å; L218-Y247 HydrophobicContact CD2-CD2 4.14Å; L218-Y247 HydrophobicContact CD2-CE2 3.95Å; L218-V252 HydrophobicContact CB-CG2 4.19Å; L218-V252 HydrophobicContact CD2-CG2 3.63Å; L218-V252 HydrophobicContact CG-CG2 4.37Å; L218-F283 HydrophobicContact CB-CE1 3.94Å; L218-F283 HydrophobicContact CB-CZ 4.28Å
219	Y	96.6	Very high	88.4	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-61.3	-47.1	174.1	-179.2	-118.4	0	0	0	111.1	W215 A216 Q221 V222 I223 I279 N280 F283 V288 T290 L291 L321	W215-Y219 WeakPolarHBondContact O-CB 3.43Å; W215-Y219 PolarHBondContact O-N 3.09Å; A216-Y219 PolarHBondContact O-N 3.05Å; Y219-Q221 VanDerWaalsContact C-N 3.3Å; Y219-Q221 PolarHBondContact O-N 3.45Å; Y219-V222 PolarHBondContact O-N 3.29Å; Y219-I223 HydrophobicContact CD1-CD1 3.95Å; Y219-I223 HydrophobicContact CD2-CG2 3.93Å; Y219-I223 HydrophobicContact CE1-CD1 3.7Å; Y219-I223 HydrophobicContact CE1-CG2 4.36Å; Y219-I223 HydrophobicContact CE2-CG2 3.5Å; Y219-I223 VanDerWaalsContact O-CG1 3.31Å; Y219-I223 WeakPolarHBondContact O-CG1 3.27Å; Y219-I223 PolarHBondContact O-N 3.04Å; Y219-I279 HydrophobicContact CD2-CG2 4.4Å; Y219-I279 HydrophobicContact CE2-CG2 4.17Å; Y219-N280 WeakPolarHBondContact CE2-OD1 3.5Å; Y219-N280 PolarHBondContact OH-OD1 3.06Å; Y219-F283 HydrophobicContact CD2-CB 3.79Å; Y219-F283 HydrophobicContact CD2-CD1 4.19Å; Y219-F283 AromaticContact CD2-CD2 3.48Å; Y219-F283 HydrophobicContact CD2-CD2 3.48Å; Y219-F283 VanDerWaalsContact CD2-CD2 3.48Å; Y219-F283 HydrophobicContact CD2-CE2 4.04Å; Y219-F283 AromaticContact CD2-CG 3.55Å; Y219-F283 HydrophobicContact CD2-CG 3.55Å; Y219-F283 HydrophobicContact CE2-CB 4.34Å; Y219-F283 HydrophobicContact CE2-CD2 4.23Å; Y219-F283 HydrophobicContact CE2-CG 4.44Å; Y219-F283 HydrophobicContact CG-CB 4.35Å; Y219-F283 HydrophobicContact CG-CD1 4.36Å; Y219-F283 HydrophobicContact CG-CD2 4.39Å; Y219-F283 HydrophobicContact CG-CG 4.12Å; Y219-V288 HydrophobicContact CD1-CG1 4.05Å; Y219-V288 HydrophobicContact CG-CG1 4.18Å; Y219-T290 HydrophobicContact CD2-CG2 4.29Å; Y219-T290 HydrophobicContact CE1-CG2 4.17Å; Y219-T290 HydrophobicContact CE2-CG2 3.8Å; Y219-T290 WeakPolarHBondContact OH-CB 3.29Å; Y219-L291 PolarHBondContact OH-N 3.37Å; Y219-L321 HydrophobicContact CD1-CD2 3.87Å; Y219-L321 HydrophobicContact CE1-CD2 3.57Å
220	F	96.5	Very high	90.6	Very high	48 Å²	48	40 Å²	40	21%	0.211	21%	0.214	C	C	.	.	H	α-helix	trans	-54.6	-46.5	174.5	177.2	-82	0	0	0	111.6	A216 S217 I223 H224 K314 L317 M318 L321	A216-F220 PolarHBondContact O-N 3.23Å; S217-F220 WeakPolarHBondContact O-CB 3.34Å; S217-F220 PolarHBondContact O-N 3.03Å; F220-I223 WeakPolarHBondContact O-CG1 3.19Å; F220-H224 VanDerWaalsContact O-CB 3.29Å; F220-H224 WeakPolarHBondContact O-CB 3.49Å; F220-H224 PolarHBondContact O-N 3.42Å; F220-H224 VanDerWaalsContact O-N 3.12Å; F220-K314 HydrophobicContact CZ-CB 4.05Å; F220-K314 HydrophobicContact CZ-CG 4.12Å; F220-L317 HydrophobicContact CD2-CD2 3.69Å; F220-L317 HydrophobicContact CD2-CG 3.98Å; F220-L317 HydrophobicContact CE2-CB 4.09Å; F220-L317 HydrophobicContact CE2-CD2 3.53Å; F220-L317 HydrophobicContact CE2-CG 3.79Å; F220-L317 HydrophobicContact CG-CD2 4.27Å; F220-L317 HydrophobicContact CZ-CD2 3.99Å; F220-M318 HydrophobicContact CE2-CG 3.95Å; F220-L321 HydrophobicContact CB-CD1 4.3Å; F220-L321 HydrophobicContact CD2-CD1 3.64Å; F220-L321 HydrophobicContact CG-CD1 4.46Å
221	Q	96.2	Very high	92.6	Very high	35 Å²	35	31.5 Å²	31.5	16%	0.164	18%	0.177	C	C	.	.	H	α-helix	trans	-61.8	-49.3	178.6	-170.7	-167	-12.3	0	0	111	S217 L218 Y219 I223 H224 D225 V252	S217-Q221 WeakPolarHBondContact O-CB 3.29Å; S217-Q221 PolarHBondContact O-N 2.9Å; L218-Q221 PolarHBondContact O-N 3.46Å; Y219-Q221 VanDerWaalsContact C-N 3.3Å; Y219-Q221 PolarHBondContact O-N 3.45Å; Q221-I223 PolarHBondContact O-N 3.3Å; Q221-H224 PolarHBondContact O-N 2.71Å; Q221-D225 WeakPolarHBondContact O-CB 3.36Å; Q221-D225 PolarHBondContact O-N 3.08Å; Q221-V252 PolarHBondContact NE2-O 3.35Å
222	V	97.2	Very high	94	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.006	16%	0.158	C	C	.	.	H	α-helix	trans	-63.7	-45	-175.4	171.3	0	0	0	0	111.7	L218 Y219 H224 D225 I226 L245 V252 I279 F283	L218-V222 WeakPolarHBondContact O-CG2 3.31Å; L218-V222 PolarHBondContact O-N 3.05Å; Y219-V222 PolarHBondContact O-N 3.29Å; V222-H224 VanDerWaalsContact C-N 3.32Å; V222-H224 PolarHBondContact O-N 2.86Å; V222-D225 PolarHBondContact O-N 3.41Å; V222-I226 HydrophobicContact CG1-CD1 4.01Å; V222-I226 HydrophobicContact CG1-CG1 4.46Å; V222-I226 VanDerWaalsContact O-CG1 3.26Å; V222-I226 WeakPolarHBondContact O-CG1 3.38Å; V222-I226 PolarHBondContact O-N 3.08Å; V222-L245 HydrophobicContact CG1-CD1 4.31Å; V222-L245 HydrophobicContact CG2-CD1 4.01Å; V222-V252 HydrophobicContact CG2-CB 4.09Å; V222-V252 HydrophobicContact CG2-CG1 3.94Å; V222-V252 HydrophobicContact CG2-CG2 3.86Å; V222-I279 HydrophobicContact CG1-CD1 3.98Å; V222-I279 HydrophobicContact CG1-CG1 4.13Å; V222-I279 HydrophobicContact CG1-CG2 3.82Å; V222-F283 HydrophobicContact CB-CE2 4.22Å; V222-F283 HydrophobicContact CB-CZ 4.4Å; V222-F283 HydrophobicContact CG1-CE2 4.35Å; V222-F283 HydrophobicContact CG2-CE2 4.17Å; V222-F283 HydrophobicContact CG2-CZ 4Å
223	I	96.8	Very high	94.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-70.2	-29.6	179.8	67.7	-165.8	0	0	0	112.3	Y219 F220 Q221 R227 L291 L296 L317 L321	Y219-I223 HydrophobicContact CD1-CD1 3.95Å; Y219-I223 HydrophobicContact CD2-CG2 3.93Å; Y219-I223 HydrophobicContact CE1-CD1 3.7Å; Y219-I223 HydrophobicContact CE1-CG2 4.36Å; Y219-I223 HydrophobicContact CE2-CG2 3.5Å; Y219-I223 VanDerWaalsContact O-CG1 3.31Å; Y219-I223 WeakPolarHBondContact O-CG1 3.27Å; Y219-I223 PolarHBondContact O-N 3.04Å; F220-I223 WeakPolarHBondContact O-CG1 3.19Å; Q221-I223 PolarHBondContact O-N 3.3Å; I223-R227 PolarHBondContact O-N 3.33Å; I223-L291 HydrophobicContact CD1-CD1 4.49Å; I223-L296 HydrophobicContact CB-CD1 3.68Å; I223-L296 HydrophobicContact CG2-CD1 3.56Å; I223-L296 HydrophobicContact CG2-CD2 4.19Å; I223-L317 HydrophobicContact CD1-CD1 3.7Å; I223-L317 HydrophobicContact CD1-CD2 4.09Å; I223-L317 HydrophobicContact CD1-CG 4.31Å; I223-L317 HydrophobicContact CG1-CD1 4.11Å; I223-L317 HydrophobicContact CG1-CD2 3.83Å; I223-L321 HydrophobicContact CD1-CD1 4.38Å; I223-L321 HydrophobicContact CD1-CD2 4.04Å
224	H	96.2	Very high	95.4	Very high	16 Å²	16	28.3 Å²	28.3	7%	0.074	14%	0.143	C	C	.	.	H	α-helix	trans	-67.6	-42.3	169.5	-177.5	-84.9	0	0	0	111.6	F220 Q221 V222 R227 T228 P308 L317	F220-H224 VanDerWaalsContact O-CB 3.29Å; F220-H224 WeakPolarHBondContact O-CB 3.49Å; F220-H224 PolarHBondContact O-N 3.42Å; F220-H224 VanDerWaalsContact O-N 3.12Å; Q221-H224 PolarHBondContact O-N 2.71Å; V222-H224 VanDerWaalsContact C-N 3.32Å; V222-H224 PolarHBondContact O-N 2.86Å; H224-R227 PolarHBondContact O-N 2.98Å; H224-T228 WeakPolarHBondContact O-CB 3.23Å; H224-T228 PolarHBondContact O-N 3.48Å; H224-T228 PolarHBondContact O-OG1 3.45Å; H224-P308 PolarHBondContact CE1-O 2.85Å; H224-P308 VanDerWaalsContact CE1-O 3.3Å; H224-P308 PolarHBondContact NE2-O 2.68Å; H224-L317 HydrophobicContact CB-CD2 4.27Å
225	D	96.9	Very high	95.6	Very high	5 Å²	5	23.9 Å²	23.9	3%	0.027	12%	0.119	C	C	.	.	H	α-helix	trans	-63.7	-40.8	176.3	-77.2	-22.1	0	0	0	111.7	I171 Q221 V222 T228 L229 M254	I171-D225 WeakPolarHBondContact CD1-O 3.35Å; I171-D225 HydrophobicContact CG1-CB 4.23Å; I171-D225 HydrophobicContact CG2-CB 4.43Å; Q221-D225 WeakPolarHBondContact O-CB 3.36Å; Q221-D225 PolarHBondContact O-N 3.08Å; V222-D225 PolarHBondContact O-N 3.41Å; D225-T228 PolarHBondContact O-N 3Å; D225-L229 VanDerWaalsContact O-CB 3.32Å; D225-L229 WeakPolarHBondContact O-CB 3.49Å; D225-L229 PolarHBondContact O-N 3.04Å; D225-M254 HydrophobicContact CB-CE 4.26Å
226	I	97.2	Very high	95.7	Very high	5 Å²	5	21.9 Å²	21.9	3%	0.026	11%	0.112	C	C	.	.	H	α-helix	trans	-61.4	-45.2	174.8	-64.8	165.4	0	0	0	110.6	V222 T228 L229 F230 L240 L272 I279 V300	V222-I226 HydrophobicContact CG1-CD1 4.01Å; V222-I226 HydrophobicContact CG1-CG1 4.46Å; V222-I226 VanDerWaalsContact O-CG1 3.26Å; V222-I226 WeakPolarHBondContact O-CG1 3.38Å; V222-I226 PolarHBondContact O-N 3.08Å; I226-T228 VanDerWaalsContact C-N 3.33Å; I226-T228 PolarHBondContact O-N 3.38Å; I226-L229 PolarHBondContact O-N 2.98Å; I226-F230 PolarHBondContact O-N 3.38Å; I226-L240 HydrophobicContact CD1-CD2 3.6Å; I226-L240 HydrophobicContact CG1-CD2 3.5Å; I226-L240 VanDerWaalsContact CG1-CD2 3.5Å; I226-L272 HydrophobicContact CG2-CD1 3.81Å; I226-I279 HydrophobicContact CD1-CG1 4.17Å; I226-I279 HydrophobicContact CD1-CG2 4.49Å; I226-V300 HydrophobicContact CB-CG2 4.24Å; I226-V300 HydrophobicContact CG2-CB 4.46Å; I226-V300 HydrophobicContact CG2-CG1 4.02Å; I226-V300 HydrophobicContact CG2-CG2 3.57Å
227	R	96.4	Very high	95.8	Very high	3 Å²	3	19.3 Å²	19.3	1%	0.011	9%	0.091	C	C	.	.	H	α-helix	trans	-61.7	-43.4	175.7	-176.9	178.1	166.3	71.5	4	111.2	I223 H224 L229 F230 Q231 W299 V300 N302 L305 P306 P308	I223-R227 PolarHBondContact O-N 3.33Å; H224-R227 PolarHBondContact O-N 2.98Å; R227-L229 VanDerWaalsContact C-N 3.34Å; R227-L229 PolarHBondContact O-N 3.18Å; R227-F230 PolarHBondContact O-N 3.26Å; R227-Q231 HydrophobicContact CG-CG 4.08Å; R227-Q231 WeakPolarHBondContact O-CB 3.32Å; R227-Q231 WeakPolarHBondContact O-CG 3.49Å; R227-Q231 PolarHBondContact O-N 2.86Å; R227-W299 WeakPolarHBondContact CD-O 3.11Å; R227-W299 PolarHBondContact NH1-O 2.82Å; R227-V300 HydrophobicContact CB-CG2 4.42Å; R227-N302 PolarHBondContact NH1-O 2.91Å; R227-L305 VanDerWaalsContact NH2-CB 3.29Å; R227-L305 PolarHBondContact NH2-O 2.95Å; R227-L305 VanDerWaalsContact NH2-O 3.12Å; R227-P306 PolarHBondContact NH2-O 3.07Å; R227-P308 HydrophobicContact CG-CG 4.17Å
228	T	96.4	Very high	95.8	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.7	-41.2	177	-61.5	0	0	0	0	112	L170 I171 H224 D225 I226 F230 K232 C233 P308	L170-T228 HydrophobicContact CB-CG2 3.88Å; L170-T228 HydrophobicContact CD1-CG2 3.77Å; L170-T228 HydrophobicContact CG-CG2 4.48Å; I171-T228 HydrophobicContact CD1-CG2 3.82Å; I171-T228 HydrophobicContact CG1-CG2 3.74Å; H224-T228 WeakPolarHBondContact O-CB 3.23Å; H224-T228 PolarHBondContact O-N 3.48Å; H224-T228 PolarHBondContact O-OG1 3.45Å; D225-T228 PolarHBondContact O-N 3Å; I226-T228 VanDerWaalsContact C-N 3.33Å; I226-T228 PolarHBondContact O-N 3.38Å; T228-F230 VanDerWaalsContact C-N 3.33Å; T228-F230 PolarHBondContact O-N 3.01Å; T228-K232 HydrophobicContact CG2-CB 4.33Å; T228-K232 HydrophobicContact CG2-CD 4.23Å; T228-K232 WeakPolarHBondContact O-CB 3.46Å; T228-K232 PolarHBondContact O-N 2.79Å; T228-C233 PolarHBondContact O-N 3.17Å; T228-P308 VanDerWaalsContact OG1-CB 3.23Å; T228-P308 WeakPolarHBondContact OG1-CB 3.32Å
229	L	96.9	Very high	95.7	Very high	4 Å²	4	19.9 Å²	19.9	2%	0.021	9%	0.091	C	C	.	.	H	α-helix	trans	-61.4	-44	177.7	-171.1	68	0	0	0	110.6	I165 I171 D225 I226 R227 C233 R234 L235 H237 M254	I165-L229 HydrophobicContact CD1-CD1 3.73Å; I165-L229 HydrophobicContact CG1-CD1 3.65Å; I171-L229 HydrophobicContact CD1-CB 3.93Å; I171-L229 HydrophobicContact CD1-CD1 4.18Å; D225-L229 VanDerWaalsContact O-CB 3.32Å; D225-L229 WeakPolarHBondContact O-CB 3.49Å; D225-L229 PolarHBondContact O-N 3.04Å; I226-L229 PolarHBondContact O-N 2.98Å; R227-L229 VanDerWaalsContact C-N 3.34Å; R227-L229 PolarHBondContact O-N 3.18Å; L229-C233 HydrophobicContact CD1-CB 4.12Å; L229-C233 CarbonylContact O-C 3.54Å; L229-C233 WeakPolarHBondContact O-CA 3.22Å; L229-C233 VanDerWaalsContact O-CB 3.26Å; L229-C233 WeakPolarHBondContact O-CB 3.3Å; L229-C233 PolarHBondContact O-N 3.27Å; L229-R234 PolarHBondContact O-N 2.93Å; L229-R234 VanDerWaalsContact O-N 3.09Å; L229-L235 CarbonylContact C-O 3.28Å; L229-L235 VanDerWaalsContact C-O 3.28Å; L229-L235 HydrophobicContact CD1-CB 3.91Å; L229-L235 HydrophobicContact CD1-CD1 4.42Å; L229-L235 HydrophobicContact CG-CB 4.04Å; L229-L235 PolarHBondContact O-N 3.02Å; L229-L235 VanDerWaalsContact O-O 3.11Å; L229-H237 HydrophobicContact CD2-CB 3.98Å; L229-M254 HydrophobicContact CD2-SD 4.03Å
230	F	95.9	Very high	95.7	Very high	3 Å²	3	19.9 Å²	19.9	1%	0.013	9%	0.09	C	C	.	.	H	α-helix	trans	-72.1	-50.7	179.6	-169.9	-93.1	0	0	0	113.2	I226 R227 T228 R234 L235 V236 H263 L269 L272 V300 V301	I226-F230 PolarHBondContact O-N 3.38Å; R227-F230 PolarHBondContact O-N 3.26Å; T228-F230 VanDerWaalsContact C-N 3.33Å; T228-F230 PolarHBondContact O-N 3.01Å; F230-R234 WeakPolarHBondContact O-CA 3.16Å; F230-R234 PolarHBondContact O-N 2.94Å; F230-L235 WeakPolarHBondContact CA-O 3.48Å; F230-L235 PolarHBondContact N-O 2.96Å; F230-V236 HydrophobicContact CD2-CG2 3.74Å; F230-V236 HydrophobicContact CE2-CG2 4.01Å; F230-H263 HydrophobicContact CD2-CB 4.34Å; F230-H263 HydrophobicContact CE2-CB 3.93Å; F230-H263 HydrophobicContact CZ-CB 4.28Å; F230-L269 HydrophobicContact CE2-CD2 4.42Å; F230-L269 HydrophobicContact CZ-CD2 4.41Å; F230-L272 HydrophobicContact CD2-CD2 3.9Å; F230-L272 HydrophobicContact CE2-CD2 3.99Å; F230-V300 HydrophobicContact CB-CG1 3.57Å; F230-V300 HydrophobicContact CD1-CG1 4.3Å; F230-V300 HydrophobicContact CD2-CG1 4.41Å; F230-V300 HydrophobicContact CG-CG1 3.85Å; F230-V301 HydrophobicContact CE1-CB 4.13Å; F230-V301 HydrophobicContact CE1-CG1 3.71Å; F230-V301 HydrophobicContact CE1-CG2 4.15Å; F230-V301 HydrophobicContact CE2-CG2 4.41Å; F230-V301 HydrophobicContact CZ-CB 4.38Å; F230-V301 HydrophobicContact CZ-CG1 3.79Å; F230-V301 HydrophobicContact CZ-CG2 4.04Å
231	Q	94.3	Very high	95.6	Very high	27 Å²	27	18.2 Å²	18.2	13%	0.126	9%	0.085	C	C	.	.	H	α-helix	trans	-80.2	-45.3	-171	-65.3	-64	-10	0	0	113	R227 R234 V300 V301 P308	R227-Q231 HydrophobicContact CG-CG 4.08Å; R227-Q231 WeakPolarHBondContact O-CB 3.32Å; R227-Q231 WeakPolarHBondContact O-CG 3.49Å; R227-Q231 PolarHBondContact O-N 2.86Å; Q231-R234 WeakPolarHBondContact O-CD 3.25Å; Q231-R234 PolarHBondContact O-NE 3.49Å; Q231-R234 PolarHBondContact O-NH1 3.48Å; Q231-V300 PolarHBondContact NE2-O 3.33Å; Q231-V301 VanDerWaalsContact NE2-C 3.28Å; Q231-V301 PolarHBondContact NE2-O 3.03Å; Q231-P308 HydrophobicContact CB-CG 3.98Å; Q231-P308 HydrophobicContact CG-CG 4.49Å
232	K	93.9	Very high	95.5	Very high	73 Å²	73	18.2 Å²	18.2	32%	0.317	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-48.8	-176.9	-73.2	-172.8	161.4	-150.3	0	112.5	L170 T228 R234 P308 D309	L170-K232 HydrophobicContact CD1-CD 3.77Å; T228-K232 HydrophobicContact CG2-CB 4.33Å; T228-K232 HydrophobicContact CG2-CD 4.23Å; T228-K232 WeakPolarHBondContact O-CB 3.46Å; T228-K232 PolarHBondContact O-N 2.79Å; K232-R234 VanDerWaalsContact C-N 3.28Å; K232-R234 PolarHBondContact O-N 2.99Å; K232-P308 HydrophobicContact CG-CG 4.32Å; K232-D309 WeakPolarHBondContact CE-OD1 3.41Å; K232-D309 WeakPolarHBondContact CE-OD2 3.26Å; K232-D309 IonicContact NZ-OD1 3.79Å; K232-D309 PolarHBondContact NZ-OD1 2.76Å; K232-D309 IonicContact NZ-OD2 3.08Å; K232-D309 PolarHBondContact NZ-OD2 3.26Å
233	C	94.9	Very high	95.4	Very high	8 Å²	8	23 Å²	23	5%	0.054	10%	0.104	C	C	.	.	S	Bend	trans	-79.4	-15.5	-176.8	-51.5	0	0	0	0	112.7	T228 L229 L235	T228-C233 PolarHBondContact O-N 3.17Å; L229-C233 HydrophobicContact CD1-CB 4.12Å; L229-C233 CarbonylContact O-C 3.54Å; L229-C233 WeakPolarHBondContact O-CA 3.22Å; L229-C233 VanDerWaalsContact O-CB 3.26Å; L229-C233 WeakPolarHBondContact O-CB 3.3Å; L229-C233 PolarHBondContact O-N 3.27Å; C233-L235 HydrophobicContact CB-CB 4.43Å; C233-L235 HydrophobicContact CB-CD1 4.3Å; C233-L235 HydrophobicContact CB-CG 4.42Å; C233-L235 PolarHBondContact O-N 3.35Å
234	R	94.5	Very high	95.3	Very high	116 Å²	116	23.9 Å²	23.9	44%	0.438	11%	0.108	S	C	.	.			trans	57.8	35.9	-175.6	-54.6	-54.8	-162.2	174.7	-3.3	112.6	L229 F230 Q231 K232 H263	L229-R234 PolarHBondContact O-N 2.93Å; L229-R234 VanDerWaalsContact O-N 3.09Å; F230-R234 WeakPolarHBondContact O-CA 3.16Å; F230-R234 PolarHBondContact O-N 2.94Å; Q231-R234 WeakPolarHBondContact O-CD 3.25Å; Q231-R234 PolarHBondContact O-NE 3.49Å; Q231-R234 PolarHBondContact O-NH1 3.48Å; K232-R234 VanDerWaalsContact C-N 3.28Å; K232-R234 PolarHBondContact O-N 2.99Å; R234-H263 WeakPolarHBondContact CD-NE2 3.47Å; R234-H263 PolarHBondContact O-N 3.23Å
235	L	95.2	Very high	95.3	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	153.9	-177.2	-69.3	173.1	0	0	0	111.1	N161 R164 I165 L229 F230 C233 V261 E262	N161-L235 HydrophobicContact CB-CD1 4.06Å; R164-L235 HydrophobicContact CB-CD1 4.28Å; I165-L235 HydrophobicContact CG1-CD1 4.36Å; L229-L235 CarbonylContact C-O 3.28Å; L229-L235 VanDerWaalsContact C-O 3.28Å; L229-L235 HydrophobicContact CD1-CB 3.91Å; L229-L235 HydrophobicContact CD1-CD1 4.42Å; L229-L235 HydrophobicContact CG-CB 4.04Å; L229-L235 PolarHBondContact O-N 3.02Å; L229-L235 VanDerWaalsContact O-O 3.11Å; F230-L235 WeakPolarHBondContact CA-O 3.48Å; F230-L235 PolarHBondContact N-O 2.96Å; C233-L235 HydrophobicContact CB-CB 4.43Å; C233-L235 HydrophobicContact CB-CD1 4.3Å; C233-L235 HydrophobicContact CB-CG 4.42Å; C233-L235 PolarHBondContact O-N 3.35Å; L235-V261 CarbonylContact C-O 3.56Å; L235-V261 WeakPolarHBondContact CA-O 3.37Å; L235-E262 HydrophobicContact CD2-CG 4.41Å
236	V	95.5	Very high	95.2	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.012	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	134.8	165.1	174.9	0	0	0	0	106.8	F230 A260 V261 A268 L272	F230-V236 HydrophobicContact CD2-CG2 3.74Å; F230-V236 HydrophobicContact CE2-CG2 4.01Å; V236-A260 CarbonylContact O-C 3.4Å; V236-A260 WeakPolarHBondContact O-CA 2.84Å; V236-A260 VanDerWaalsContact O-CB 3.29Å; V236-A260 WeakPolarHBondContact O-CB 3.31Å; V236-V261 HydrophobicContact CB-CG2 3.99Å; V236-V261 PolarHBondContact N-O 3.3Å; V236-V261 PolarHBondContact O-N 3.39Å; V236-A268 HydrophobicContact CG2-CB 4.18Å; V236-L272 HydrophobicContact CG1-CB 3.86Å; V236-L272 HydrophobicContact CG2-CB 4.25Å
237	H	95.4	Very high	95.1	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.005	12%	0.115	C	C	.	.			trans	-66.4	-40.2	-174.6	-165.1	-70.6	0	0	0	112.5	L229 D239 L240 I255 D256 A260 D275	L229-H237 HydrophobicContact CD2-CB 3.98Å; H237-D239 PolarHBondContact O-N 3.28Å; H237-L240 HydrophobicContact CB-CB 3.93Å; H237-L240 PolarHBondContact ND1-N 3.01Å; H237-I255 PolarHBondContact NE2-O 2.8Å; H237-I255 VanDerWaalsContact NE2-O 3.09Å; H237-D256 PolarHBondContact CE1-O 3.24Å; H237-A260 VanDerWaalsContact O-CA 3.22Å; H237-A260 WeakPolarHBondContact O-CA 3.41Å; H237-A260 PolarHBondContact O-N 2.85Å; H237-D275 PolarHBondContact N-OD2 3.04Å
238	A	93.8	Very high	95	Very high	7 Å²	7	26.8 Å²	26.8	6%	0.058	12%	0.121	C	C	.	.	S	Bend	trans	67.5	4.7	177.7	0	0	0	0	0	117.1	Y131 Y271 D275	Y131-A238 HydrophobicContact CD1-CB 4.42Å; Y131-A238 HydrophobicContact CE1-CB 4.31Å; A238-Y271 HydrophobicContact CB-CD1 3.88Å; A238-Y271 HydrophobicContact CB-CD2 3.86Å; A238-Y271 HydrophobicContact CB-CG 3.51Å; A238-D275 PolarHBondContact N-OD1 3.12Å; A238-D275 PolarHBondContact N-OD2 3.22Å
239	D	93.8	Very high	94.7	Very high	61 Å²	61	31.7 Å²	31.7	33%	0.326	15%	0.148	S	C	.	.	S	Bend	trans	-156.8	34.7	174.2	-164.9	34.8	0	0	0	109.7	H237 S241 N244 D275	H237-D239 PolarHBondContact O-N 3.28Å; D239-S241 PolarHBondContact O-N 2.93Å; D239-N244 PolarHBondContact O-ND2 2.85Å; D239-N244 PolarHBondContact OD2-ND2 2.79Å; D239-D275 PolarHBondContact N-OD1 3.37Å; D239-D275 VanDerWaalsContact N-OD1 3.1Å
240	L	96.2	Very high	94.3	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.165	C	C	.	.			trans	-75.8	126.5	-177.8	-167.1	64.5	0	0	0	109.6	I226 H237 L245 M254 D275 N278 I279	I226-L240 HydrophobicContact CD1-CD2 3.6Å; I226-L240 HydrophobicContact CG1-CD2 3.5Å; I226-L240 VanDerWaalsContact CG1-CD2 3.5Å; H237-L240 HydrophobicContact CB-CB 3.93Å; H237-L240 PolarHBondContact ND1-N 3.01Å; L240-L245 HydrophobicContact CD1-CD2 3.85Å; L240-L245 HydrophobicContact CD1-CG 4.32Å; L240-M254 HydrophobicContact CD1-CE 4.09Å; L240-M254 HydrophobicContact CD1-CG 4.37Å; L240-M254 HydrophobicContact CD2-CE 4.46Å; L240-D275 HydrophobicContact CB-CB 3.76Å; L240-D275 PolarHBondContact N-OD1 3.04Å; L240-N278 WeakPolarHBondContact O-CB 2.99Å; L240-N278 PolarHBondContact O-ND2 3.45Å; L240-I279 HydrophobicContact CD2-CD1 4.26Å; L240-I279 HydrophobicContact CD2-CG1 3.92Å; L240-I279 HydrophobicContact CG-CD1 4.05Å; L240-I279 HydrophobicContact CG-CG1 4.1Å
241	S	95.2	Very high	94.2	Very high	13 Å²	13	38.8 Å²	38.8	9%	0.091	19%	0.189	C	C	.	.	S	Bend	trans	-161.2	173	178.7	62	0	0	0	0	109.6	D239 Y243 N244	D239-S241 PolarHBondContact O-N 2.93Å; S241-Y243 PolarHBondContact O-N 2.66Å; S241-N244 PolarHBondContact O-N 3.4Å
242	E	94.1	Very high	94.3	Very high	36 Å²	36	37.5 Å²	37.5	17%	0.168	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-16.5	176.1	69.2	-86.4	-157.6	0	0	114.4	L199 K200 F282	L199-E242 PolarHBondContact N-O 2.98Å; K200-E242 HydrophobicContact CB-CB 4.25Å; K200-E242 HydrophobicContact CB-CG 3.7Å; K200-E242 HydrophobicContact CG-CG 4.26Å; K200-E242 PolarHBondContact N-O 3.14Å; E242-F282 HydrophobicContact CB-CB 4.5Å; E242-F282 HydrophobicContact CB-CD1 4.16Å; E242-F282 HydrophobicContact CB-CD2 3.35Å; E242-F282 HydrophobicContact CB-CE1 4.25Å; E242-F282 HydrophobicContact CB-CE2 3.44Å; E242-F282 VanDerWaalsContact CB-CE2 3.44Å; E242-F282 HydrophobicContact CB-CG 3.73Å; E242-F282 HydrophobicContact CB-CZ 3.91Å; E242-F282 HydrophobicContact CG-CD2 3.62Å; E242-F282 HydrophobicContact CG-CE2 3.83Å; E242-F282 HydrophobicContact CG-CG 4.35Å
243	Y	93.8	Very high	94.5	Very high	101 Å²	101	37 Å²	37	40%	0.396	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-25.9	177	-63.4	-91.5	0	0	0	113.3	K200 S241	K200-Y243 HydrophobicContact CD-CD1 3.85Å; K200-Y243 HydrophobicContact CD-CE1 3.22Å; K200-Y243 HydrophobicContact CD-CE2 4.27Å; K200-Y243 VanDerWaalsContact CD-CZ 3.45Å; K200-Y243 WeakPolarHBondContact CE-OH 3.42Å; K200-Y243 PolarHBondContact NZ-OH 2.86Å; S241-Y243 PolarHBondContact O-N 2.66Å
244	N	95.2	Very high	94.6	Very high	18 Å²	18	36.6 Å²	36.6	10%	0.096	18%	0.177	C	C	.	.	S	Bend	trans	-106.8	14.3	-175.6	-66.2	-25.9	0	0	0	112.2	D239 S241 I255	D239-N244 PolarHBondContact O-ND2 2.85Å; D239-N244 PolarHBondContact OD2-ND2 2.79Å; S241-N244 PolarHBondContact O-N 3.4Å; N244-I255 WeakPolarHBondContact O-CG1 3.32Å; N244-I255 PolarHBondContact O-N 2.81Å
245	L	96.2	Very high	94.7	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127	173.8	-66.1	-179.6	0	0	0	108.4	K198 L199 V222 L240 V252 W253 M254 I279	K198-L245 CarbonylContact C-O 3.55Å; K198-L245 WeakPolarHBondContact CA-O 3.26Å; L199-L245 HydrophobicContact CB-CB 3.98Å; L199-L245 HydrophobicContact CD2-CB 4.18Å; L199-L245 HydrophobicContact CD2-CD1 3.9Å; L199-L245 PolarHBondContact N-O 2.91Å; V222-L245 HydrophobicContact CG1-CD1 4.31Å; V222-L245 HydrophobicContact CG2-CD1 4.01Å; L240-L245 HydrophobicContact CD1-CD2 3.85Å; L240-L245 HydrophobicContact CD1-CG 4.32Å; L245-V252 HydrophobicContact CB-CG1 3.79Å; L245-V252 HydrophobicContact CD1-CG1 4.05Å; L245-V252 HydrophobicContact CD2-CG1 3.61Å; L245-V252 HydrophobicContact CG-CG1 4Å; L245-W253 WeakPolarHBondContact CA-O 3.34Å; L245-M254 HydrophobicContact CD2-CB 4.38Å; L245-M254 HydrophobicContact CD2-CG 4.48Å; L245-I279 HydrophobicContact CD1-CD1 3.84Å
246	L	95.4	Very high	94.6	Very high	20 Å²	20	34.6 Å²	34.6	11%	0.105	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	149.6	171.7	-54.5	-179.5	0	0	0	109.9	V189 A196 P197 K198 V252 W253 I255	V189-L246 HydrophobicContact CB-CD1 4.08Å; V189-L246 HydrophobicContact CG1-CD1 4.06Å; A196-L246 HydrophobicContact CB-CB 4.05Å; A196-L246 HydrophobicContact CB-CD1 4.37Å; P197-L246 CarbonylContact O-C 3.59Å; P197-L246 WeakPolarHBondContact O-CA 3.46Å; K198-L246 HydrophobicContact CB-CD2 4.44Å; K198-L246 HydrophobicContact CG-CD2 3.79Å; L246-V252 CarbonylContact O-C 3.54Å; L246-V252 WeakPolarHBondContact O-CA 3.49Å; L246-W253 HydrophobicContact CB-CB 4.2Å; L246-W253 PolarHBondContact N-O 2.87Å; L246-W253 PolarHBondContact O-N 3.46Å; L246-I255 HydrophobicContact CD1-CD1 4.11Å; L246-I255 HydrophobicContact CD1-CG2 3.82Å; L246-I255 HydrophobicContact CD2-CD1 3.8Å; L246-I255 HydrophobicContact CG-CD1 3.81Å; L246-I255 HydrophobicContact CG-CG1 4.22Å; L246-I255 HydrophobicContact CG-CG2 4.04Å
247	Y	94.9	Very high	94.5	Very high	41 Å²	41	34.5 Å²	34.5	16%	0.161	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	123.4	177.1	176.9	-103.5	0	0	0	110.4	P197 L199 V202 P213 L218	P197-Y247 WeakPolarHBondContact CD-O 3.39Å; P197-Y247 PolarHBondContact O-N 3.39Å; L199-Y247 HydrophobicContact CD1-CD2 4.49Å; V202-Y247 HydrophobicContact CG1-CD1 4.28Å; V202-Y247 HydrophobicContact CG2-CD1 3.93Å; V202-Y247 HydrophobicContact CG2-CG 4.06Å; P213-Y247 HydrophobicContact CB-CE2 4.17Å; L218-Y247 HydrophobicContact CD1-CD2 4.09Å; L218-Y247 HydrophobicContact CD1-CE2 3.94Å; L218-Y247 HydrophobicContact CD2-CD2 4.14Å; L218-Y247 HydrophobicContact CD2-CE2 3.95Å
248	L	93.2	Very high	94.2	Very high	28 Å²	28	34.4 Å²	34.4	15%	0.147	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	125.3	177.5	-177.1	65.5	0	0	0	109.7	V189 K191 A196 G250 K251	V189-L248 HydrophobicContact CG1-CD2 4.06Å; K191-L248 HydrophobicContact CD-CD1 4.26Å; K191-L248 HydrophobicContact CG-CD1 4.14Å; A196-L248 HydrophobicContact CB-CB 4.06Å; A196-L248 HydrophobicContact CB-CD1 4.45Å; L248-G250 PolarHBondContact O-N 3.37Å; L248-K251 PolarHBondContact N-O 3.4Å; L248-K251 PolarHBondContact O-N 2.98Å
249	D	89.6	Confident	94	Very high	104 Å²	104	34.7 Å²	34.7	56%	0.556	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	46.9	173.3	-61	-16.2	0	0	0	114.2	K191 K251	K191-D249 VanDerWaalsContact CE-CG 3.49Å; K191-D249 WeakPolarHBondContact CE-OD1 3.37Å; K191-D249 WeakPolarHBondContact CE-OD2 3.23Å; K191-D249 IonicContact NZ-OD1 3.9Å; K191-D249 PolarHBondContact NZ-OD1 3.28Å; K191-D249 IonicContact NZ-OD2 2.71Å; K191-D249 PolarHBondContact NZ-OD2 2.85Å; D249-K251 PolarHBondContact O-N 3.43Å
250	G	90.1	Very high	94	Very high	37 Å²	37	31.9 Å²	31.9	38%	0.381	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	9.7	-179.1	0	0	0	0	0	114.3	L248	L248-G250 PolarHBondContact O-N 3.37Å
251	K	93.6	Very high	93.8	Very high	119 Å²	119	31.9 Å²	31.9	52%	0.517	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	145.8	-180	-65.1	-178.8	-177.5	176.6	0	112	L248 D249	L248-K251 PolarHBondContact N-O 3.4Å; L248-K251 PolarHBondContact O-N 2.98Å; D249-K251 PolarHBondContact O-N 3.43Å
252	V	96	Very high	93.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	136.1	169.9	-176.6	0	0	0	0	110.5	S172 L218 Q221 V222 L245 L246	S172-V252 WeakPolarHBondContact CB-O 3.42Å; L218-V252 HydrophobicContact CB-CG2 4.19Å; L218-V252 HydrophobicContact CD2-CG2 3.63Å; L218-V252 HydrophobicContact CG-CG2 4.37Å; Q221-V252 PolarHBondContact NE2-O 3.35Å; V222-V252 HydrophobicContact CG2-CB 4.09Å; V222-V252 HydrophobicContact CG2-CG1 3.94Å; V222-V252 HydrophobicContact CG2-CG2 3.86Å; L245-V252 HydrophobicContact CB-CG1 3.79Å; L245-V252 HydrophobicContact CD1-CG1 4.05Å; L245-V252 HydrophobicContact CD2-CG1 3.61Å; L245-V252 HydrophobicContact CG-CG1 4Å; L246-V252 CarbonylContact O-C 3.54Å; L246-V252 WeakPolarHBondContact O-CA 3.49Å
253	W	97.2	Very high	93.3	Very high	61 Å²	61	31.7 Å²	31.7	23%	0.231	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126	172.7	-71.7	71.4	0	0	0	110.5	S172 V189 L245 L246	S172-W253 CarbonylContact O-C 3.56Å; S172-W253 WeakPolarHBondContact O-CA 3.37Å; V189-W253 HydrophobicContact CB-CE3 4.5Å; V189-W253 HydrophobicContact CG1-CB 4.05Å; V189-W253 HydrophobicContact CG1-CD2 3.68Å; V189-W253 HydrophobicContact CG1-CE3 4.03Å; V189-W253 HydrophobicContact CG1-CG 3.7Å; V189-W253 HydrophobicContact CG2-CD2 4.14Å; V189-W253 HydrophobicContact CG2-CE3 3.59Å; V189-W253 HydrophobicContact CG2-CZ3 3.94Å; L245-W253 WeakPolarHBondContact CA-O 3.34Å; L246-W253 HydrophobicContact CB-CB 4.2Å; L246-W253 PolarHBondContact N-O 2.87Å; L246-W253 PolarHBondContact O-N 3.46Å
254	M	97.4	Very high	92.9	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	127.1	179.9	-171.6	178.2	-68.9	0	0	110.8	I171 S172 P174 D225 L229 L240 L245	I171-M254 HydrophobicContact CG2-CB 4.33Å; S172-M254 PolarHBondContact O-N 2.85Å; P174-M254 VanDerWaalsContact CD-O 3.31Å; P174-M254 WeakPolarHBondContact CD-O 3.34Å; D225-M254 HydrophobicContact CB-CE 4.26Å; L229-M254 HydrophobicContact CD2-SD 4.03Å; L240-M254 HydrophobicContact CD1-CE 4.09Å; L240-M254 HydrophobicContact CD1-CG 4.37Å; L240-M254 HydrophobicContact CD2-CE 4.46Å; L245-M254 HydrophobicContact CD2-CB 4.38Å; L245-M254 HydrophobicContact CD2-CG 4.48Å
255	I	96	Very high	92.5	Very high	32 Å²	32	32.7 Å²	32.7	16%	0.164	16%	0.164	C	C	.	.			trans	-127.8	167.1	-179.3	61.9	161.5	0	0	0	111.7	P174 H237 N244 L246	P174-I255 HydrophobicContact CG-CG2 3.85Å; H237-I255 PolarHBondContact NE2-O 2.8Å; H237-I255 VanDerWaalsContact NE2-O 3.09Å; N244-I255 WeakPolarHBondContact O-CG1 3.32Å; N244-I255 PolarHBondContact O-N 2.81Å; L246-I255 HydrophobicContact CD1-CD1 4.11Å; L246-I255 HydrophobicContact CD1-CG2 3.82Å; L246-I255 HydrophobicContact CD2-CD1 3.8Å; L246-I255 HydrophobicContact CG-CD1 3.81Å; L246-I255 HydrophobicContact CG-CG1 4.22Å; L246-I255 HydrophobicContact CG-CG2 4.04Å
256	D	93.5	Very high	91.9	Very high	42 Å²	42	37.7 Å²	37.7	23%	0.225	20%	0.197	C	C	.	.			trans	61.6	52.9	175.8	-153.1	6.2	0	0	0	116.6	K116 H237 S258	K116-D256 IonicContact NZ-OD1 2.66Å; K116-D256 PolarHBondContact NZ-OD1 2.76Å; H237-D256 PolarHBondContact CE1-O 3.24Å; D256-S258 PolarHBondContact O-N 3.05Å; D256-S258 VanDerWaalsContact O-N 3.09Å; D256-S258 PolarHBondContact OD1-OG 2.45Å
257	V	94.1	Very high	91.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	27	176.7	-59.7	0	0	0	0	113.5	E158 N161 L162 I165 A260	E158-V257 HydrophobicContact CG-CG2 4.14Å; N161-V257 HydrophobicContact CB-CB 4.24Å; N161-V257 HydrophobicContact CB-CG2 3.77Å; N161-V257 PolarHBondContact ND2-O 2.78Å; L162-V257 HydrophobicContact CB-CG2 4.48Å; L162-V257 HydrophobicContact CD2-CG2 3.55Å; L162-V257 HydrophobicContact CG-CG2 3.57Å; I165-V257 HydrophobicContact CD1-CB 4.18Å; I165-V257 HydrophobicContact CD1-CG1 3.62Å; I165-V257 HydrophobicContact CD1-CG2 4.15Å; V257-A260 HydrophobicContact CB-CB 4.13Å
258	S	89.6	Confident	91.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-39.8	177.7	59.8	0	0	0	0	111.8	K157 E158 D256	K157-S258 VanDerWaalsContact CD-O 3.32Å; K157-S258 WeakPolarHBondContact CD-O 3.42Å; K157-S258 WeakPolarHBondContact CE-O 3.4Å; K157-S258 PolarHBondContact NZ-O 2.97Å; E158-S258 VanDerWaalsContact OE2-CB 3.32Å; E158-S258 WeakPolarHBondContact OE2-CB 3.44Å; D256-S258 PolarHBondContact O-N 3.05Å; D256-S258 VanDerWaalsContact O-N 3.09Å; D256-S258 PolarHBondContact OD1-OG 2.45Å
259	Q	89.1	Confident	91.1	Very high	13 Å²	13	36.6 Å²	36.6	6%	0.061	19%	0.192	C	C	.	.	S	Bend	trans	-84.8	-17.1	-178.9	-60.5	-173.6	15.5	0	0	112.8	Y131 K157 V261	Y131-Q259 HydrophobicContact CD1-CB 4.08Å; Y131-Q259 HydrophobicContact CE1-CB 4.31Å; Y131-Q259 HydrophobicContact CG-CB 4.29Å; Y131-Q259 PolarHBondContact OH-OE1 2.88Å; K157-Q259 PolarHBondContact NZ-O 2.8Å; Q259-V261 WeakPolarHBondContact O-CG1 3.38Å; Q259-V261 PolarHBondContact O-N 3.26Å
260	A	93.2	Very high	91.1	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.008	19%	0.19	C	C	.	.			trans	-50.3	131.5	-176.4	0	0	0	0	0	113.2	K157 N161 V236 H237 V257	K157-A260 WeakPolarHBondContact CE-O 3.49Å; K157-A260 PolarHBondContact NZ-O 3.27Å; N161-A260 PolarHBondContact ND2-O 3.13Å; V236-A260 CarbonylContact O-C 3.4Å; V236-A260 WeakPolarHBondContact O-CA 2.84Å; V236-A260 VanDerWaalsContact O-CB 3.29Å; V236-A260 WeakPolarHBondContact O-CB 3.31Å; H237-A260 VanDerWaalsContact O-CA 3.22Å; H237-A260 WeakPolarHBondContact O-CA 3.41Å; H237-A260 PolarHBondContact O-N 2.85Å; V257-A260 HydrophobicContact CB-CB 4.13Å
261	V	92.3	Very high	91.3	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.012	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	155.3	-175.3	-59.3	0	0	0	0	110.8	L235 V236 Q259 A268 Y271	L235-V261 CarbonylContact C-O 3.56Å; L235-V261 WeakPolarHBondContact CA-O 3.37Å; V236-V261 HydrophobicContact CB-CG2 3.99Å; V236-V261 PolarHBondContact N-O 3.3Å; V236-V261 PolarHBondContact O-N 3.39Å; Q259-V261 WeakPolarHBondContact O-CG1 3.38Å; Q259-V261 PolarHBondContact O-N 3.26Å; V261-A268 HydrophobicContact CG2-CB 4.23Å; V261-Y271 HydrophobicContact CG1-CD2 4.27Å; V261-Y271 HydrophobicContact CG1-CE2 4.19Å; V261-Y271 HydrophobicContact CG2-CD2 3.88Å
262	E	91	Very high	91.3	Very high	26 Å²	26	30.8 Å²	30.8	12%	0.121	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	145.4	171.8	-61.2	-168.3	143.4	0	0	110.6	R137 R164 L235 E264 S265	R137-E262 WeakPolarHBondContact CD-OE1 3.36Å; R137-E262 IonicContact NH1-OE1 2.88Å; R164-E262 IonicContact CZ-OE1 2.76Å; R164-E262 IonicContact NH1-OE1 2.78Å; R164-E262 PolarHBondContact NH1-OE1 3.23Å; R164-E262 IonicContact NH2-OE1 3.92Å; R164-E262 PolarHBondContact NH2-OE1 2.97Å; L235-E262 HydrophobicContact CD2-CG 4.41Å; E262-E264 PolarHBondContact O-N 3.12Å; E262-S265 VanDerWaalsContact O-CB 3.22Å; E262-S265 WeakPolarHBondContact O-CB 3.44Å; E262-S265 PolarHBondContact O-N 3.08Å
263	H	88.4	Confident	91.2	Very high	19 Å²	19	31.7 Å²	31.7	9%	0.088	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-11.6	-179.2	73.6	-27.4	0	0	0	115.2	F230 R234 R347	F230-H263 HydrophobicContact CD2-CB 4.34Å; F230-H263 HydrophobicContact CE2-CB 3.93Å; F230-H263 HydrophobicContact CZ-CB 4.28Å; R234-H263 WeakPolarHBondContact CD-NE2 3.47Å; R234-H263 PolarHBondContact O-N 3.23Å; H263-R347 PolarHBondContact O-NE 3.44Å
264	E	85.6	Confident	91.1	Very high	136 Å²	136	31.4 Å²	31.4	64%	0.636	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-12.4	176	-81.1	169.1	-151.8	0	0	112.4	E262	E262-E264 PolarHBondContact O-N 3.12Å
265	S	85.3	Confident	91	Very high	4 Å²	4	31.5 Å²	31.5	3%	0.028	16%	0.161	C	C	.	.	S	Bend	trans	-61	139.6	178.6	-179.3	0	0	0	0	110.4	E262 Q267 A268	E262-S265 VanDerWaalsContact O-CB 3.22Å; E262-S265 WeakPolarHBondContact O-CB 3.44Å; E262-S265 PolarHBondContact O-N 3.08Å; S265-Q267 PolarHBondContact O-N 3.37Å; S265-A268 VanDerWaalsContact O-CB 3.24Å; S265-A268 WeakPolarHBondContact O-CB 3.27Å; S265-A268 PolarHBondContact O-N 3.06Å
266	P	84.1	Confident	91	Very high	106 Å²	106	30 Å²	30	69%	0.688	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-29.9	178.5	-26.5	34.4	0	0	0	113.9
267	Q	85.3	Confident	91.1	Very high	61 Å²	61	28.7 Å²	28.7	29%	0.285	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-0.8	-178	-63.1	-176.6	-38.2	0	0	113.5	K130 S265 L269 E270 Y271	K130-Q267 PolarHBondContact O-OE1 2.8Å; S265-Q267 PolarHBondContact O-N 3.37Å; Q267-L269 VanDerWaalsContact C-N 3.3Å; Q267-L269 PolarHBondContact O-N 3.16Å; Q267-E270 PolarHBondContact O-N 3.44Å; Q267-E270 VanDerWaalsContact O-N 3.15Å; Q267-Y271 HydrophobicContact CB-CD2 3.89Å; Q267-Y271 HydrophobicContact CB-CE2 3.46Å; Q267-Y271 VanDerWaalsContact CB-CE2 3.46Å; Q267-Y271 WeakPolarHBondContact O-CD2 3.17Å; Q267-Y271 PolarHBondContact O-N 2.81Å; Q267-Y271 VanDerWaalsContact O-N 3.09Å; Q267-Y271 PolarHBondContact OE1-OH 2.99Å
268	A	89.9	Confident	91.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-56.9	-41.4	-172.6	0	0	0	0	0	113	V236 V261 S265 L272	V236-A268 HydrophobicContact CG2-CB 4.18Å; V261-A268 HydrophobicContact CG2-CB 4.23Å; S265-A268 VanDerWaalsContact O-CB 3.24Å; S265-A268 WeakPolarHBondContact O-CB 3.27Å; S265-A268 PolarHBondContact O-N 3.06Å; A268-L272 WeakPolarHBondContact O-CB 3.5Å; A268-L272 PolarHBondContact O-N 3.25Å
269	L	91.3	Very high	91.5	Very high	5 Å²	5	30.8 Å²	30.8	3%	0.026	16%	0.158	C	C	.	.	H	α-helix	trans	-73.5	-30.5	-178.6	-60.1	176.6	0	0	0	113.2	F230 Q267 R273 F297 V301 I345 R347 I377	F230-L269 HydrophobicContact CE2-CD2 4.42Å; F230-L269 HydrophobicContact CZ-CD2 4.41Å; Q267-L269 VanDerWaalsContact C-N 3.3Å; Q267-L269 PolarHBondContact O-N 3.16Å; L269-R273 WeakPolarHBondContact O-CG 3.49Å; L269-R273 PolarHBondContact O-N 3.36Å; L269-F297 HydrophobicContact CB-CE2 4.42Å; L269-F297 HydrophobicContact CB-CZ 4.28Å; L269-F297 HydrophobicContact CD2-CE2 4.32Å; L269-F297 HydrophobicContact CD2-CZ 3.98Å; L269-V301 HydrophobicContact CD2-CG2 4.37Å; L269-I345 HydrophobicContact CD1-CG2 4.36Å; L269-R347 HydrophobicContact CD1-CB 3.82Å; L269-R347 HydrophobicContact CD1-CG 4.34Å; L269-R347 HydrophobicContact CG-CB 4.42Å; L269-I377 HydrophobicContact CD1-CD1 3.43Å; L269-I377 VanDerWaalsContact CD1-CD1 3.43Å; L269-I377 HydrophobicContact CD2-CD1 4.17Å; L269-I377 HydrophobicContact CG-CD1 4.42Å
270	E	90.9	Very high	91.8	Very high	109 Å²	109	30.2 Å²	30.2	51%	0.509	16%	0.155	S	C	.	.	H	α-helix	trans	-68.3	-45.1	175.3	-172.9	-177	171.9	0	0	110.5	Q267 R273 T274	Q267-E270 PolarHBondContact O-N 3.44Å; Q267-E270 VanDerWaalsContact O-N 3.15Å; E270-R273 PolarHBondContact O-N 2.97Å; E270-T274 PolarHBondContact O-N 3.33Å; E270-T274 VanDerWaalsContact O-N 3.11Å; E270-T274 PolarHBondContact O-OG1 2.97Å
271	Y	93.1	Very high	91.8	Very high	25 Å²	25	33.1 Å²	33.1	10%	0.098	17%	0.17	C	C	.	.	H	α-helix	trans	-60.9	-44.7	172.7	-70.7	-43.5	0	0	0	111.9	Y131 A238 V261 Q267 R273 T274 D275	Y131-Y271 HydrophobicContact CD1-CE1 4.34Å; Y131-Y271 HydrophobicContact CD1-CE2 4.41Å; Y131-Y271 HydrophobicContact CE1-CD1 4.5Å; Y131-Y271 AromaticContact CE1-CE1 3.82Å; Y131-Y271 HydrophobicContact CE1-CE1 3.82Å; Y131-Y271 AromaticContact CE1-CZ 3.94Å; A238-Y271 HydrophobicContact CB-CD1 3.88Å; A238-Y271 HydrophobicContact CB-CD2 3.86Å; A238-Y271 HydrophobicContact CB-CG 3.51Å; V261-Y271 HydrophobicContact CG1-CD2 4.27Å; V261-Y271 HydrophobicContact CG1-CE2 4.19Å; V261-Y271 HydrophobicContact CG2-CD2 3.88Å; Q267-Y271 HydrophobicContact CB-CD2 3.89Å; Q267-Y271 HydrophobicContact CB-CE2 3.46Å; Q267-Y271 VanDerWaalsContact CB-CE2 3.46Å; Q267-Y271 WeakPolarHBondContact O-CD2 3.17Å; Q267-Y271 PolarHBondContact O-N 2.81Å; Q267-Y271 VanDerWaalsContact O-N 3.09Å; Q267-Y271 PolarHBondContact OE1-OH 2.99Å; Y271-R273 VanDerWaalsContact C-N 3.34Å; Y271-R273 PolarHBondContact O-N 3.09Å; Y271-T274 WeakPolarHBondContact O-CB 3.06Å; Y271-T274 PolarHBondContact O-N 3.48Å; Y271-T274 VanDerWaalsContact O-N 3.13Å; Y271-D275 VanDerWaalsContact O-CG 3.31Å; Y271-D275 PolarHBondContact O-N 2.86Å
272	L	94.9	Very high	92	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.016	17%	0.171	C	C	.	.	H	α-helix	trans	-61	-42	178.5	178.5	61.3	0	0	0	112.2	I226 F230 V236 A268 T274 D275 C276 F297 V300 V301	I226-L272 HydrophobicContact CG2-CD1 3.81Å; F230-L272 HydrophobicContact CD2-CD2 3.9Å; F230-L272 HydrophobicContact CE2-CD2 3.99Å; V236-L272 HydrophobicContact CG1-CB 3.86Å; V236-L272 HydrophobicContact CG2-CB 4.25Å; A268-L272 WeakPolarHBondContact O-CB 3.5Å; A268-L272 PolarHBondContact O-N 3.25Å; L272-T274 VanDerWaalsContact C-N 3.3Å; L272-T274 PolarHBondContact O-N 3.17Å; L272-D275 WeakPolarHBondContact O-CB 3.31Å; L272-D275 PolarHBondContact O-N 2.81Å; L272-C276 WeakPolarHBondContact O-CB 3.39Å; L272-C276 PolarHBondContact O-N 2.84Å; L272-C276 PolarHBondContact O-SG 2.94Å; L272-F297 HydrophobicContact CB-CE2 4.42Å; L272-F297 HydrophobicContact CD2-CD2 4.04Å; L272-F297 HydrophobicContact CD2-CE2 3.86Å; L272-F297 HydrophobicContact CG-CD2 4.15Å; L272-F297 HydrophobicContact CG-CE2 4.18Å; L272-V300 HydrophobicContact CD1-CG1 3.95Å; L272-V300 HydrophobicContact CD2-CB 4.44Å; L272-V300 HydrophobicContact CD2-CG1 3.74Å; L272-V300 HydrophobicContact CG-CG1 4.43Å; L272-V301 HydrophobicContact CD2-CG2 3.42Å; L272-V301 VanDerWaalsContact CD2-CG2 3.42Å
273	R	93.5	Very high	92.1	Very high	19 Å²	19	32.1 Å²	32.1	7%	0.072	17%	0.165	C	C	.	.	H	α-helix	trans	-63.2	-38.9	175.6	-75.2	-175.7	-62.9	160.2	-3.2	112.3	L269 E270 Y271 H277 F297 F340 R341 V343	L269-R273 WeakPolarHBondContact O-CG 3.49Å; L269-R273 PolarHBondContact O-N 3.36Å; E270-R273 PolarHBondContact O-N 2.97Å; Y271-R273 VanDerWaalsContact C-N 3.34Å; Y271-R273 PolarHBondContact O-N 3.09Å; R273-H277 VanDerWaalsContact O-CB 3.24Å; R273-H277 WeakPolarHBondContact O-CB 3.49Å; R273-H277 PolarHBondContact O-N 3.22Å; R273-F297 HydrophobicContact CG-CD2 3.41Å; R273-F297 VanDerWaalsContact CG-CD2 3.41Å; R273-F297 HydrophobicContact CG-CE2 3.49Å; R273-F297 VanDerWaalsContact CG-CE2 3.49Å; R273-F297 HydrophobicContact CG-CG 4.22Å; R273-F297 HydrophobicContact CG-CZ 4.34Å; R273-F340 HydrophobicContact CG-CE1 4.02Å; R273-F340 PolarHBondContact NH1-O 3.15Å; R273-R341 PolarHBondContact NH1-O 3.25Å; R273-R341 VanDerWaalsContact NH1-O 3.15Å; R273-V343 PolarHBondContact NH1-O 3.39Å; R273-V343 PolarHBondContact NH2-O 3.46Å
274	T	93.8	Very high	92.3	Very high	55 Å²	55	32.9 Å²	32.9	34%	0.337	17%	0.167	S	C	.	.	H	α-helix	trans	-64.3	-45.5	176.3	-54.4	0	0	0	0	110.8	E270 Y271 L272 H277 N278	E270-T274 PolarHBondContact O-N 3.33Å; E270-T274 VanDerWaalsContact O-N 3.11Å; E270-T274 PolarHBondContact O-OG1 2.97Å; Y271-T274 WeakPolarHBondContact O-CB 3.06Å; Y271-T274 PolarHBondContact O-N 3.48Å; Y271-T274 VanDerWaalsContact O-N 3.13Å; L272-T274 VanDerWaalsContact C-N 3.3Å; L272-T274 PolarHBondContact O-N 3.17Å; T274-H277 PolarHBondContact O-N 3.38Å; T274-N278 PolarHBondContact O-N 3.41Å; T274-N278 PolarHBondContact O-ND2 3.1Å; T274-N278 PolarHBondContact O-OD1 3.49Å
275	D	96.7	Very high	92.6	Very high	3 Å²	3	33.8 Å²	33.8	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-57.3	-51.6	175.2	-69.7	-15.6	0	0	0	111.2	H237 A238 D239 L240 Y271 L272 H277 N278 I279	H237-D275 PolarHBondContact N-OD2 3.04Å; A238-D275 PolarHBondContact N-OD1 3.12Å; A238-D275 PolarHBondContact N-OD2 3.22Å; D239-D275 PolarHBondContact N-OD1 3.37Å; D239-D275 VanDerWaalsContact N-OD1 3.1Å; L240-D275 HydrophobicContact CB-CB 3.76Å; L240-D275 PolarHBondContact N-OD1 3.04Å; Y271-D275 VanDerWaalsContact O-CG 3.31Å; Y271-D275 PolarHBondContact O-N 2.86Å; L272-D275 WeakPolarHBondContact O-CB 3.31Å; L272-D275 PolarHBondContact O-N 2.81Å; D275-H277 VanDerWaalsContact C-N 3.33Å; D275-H277 PolarHBondContact O-N 3.13Å; D275-N278 PolarHBondContact O-N 3.06Å; D275-I279 WeakPolarHBondContact O-CG1 3.49Å; D275-I279 PolarHBondContact O-N 3.14Å; D275-I279 VanDerWaalsContact O-N 3.08Å
276	C	96.3	Very high	92.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.3	-41	178.7	-68.4	0	0	0	0	112.3	L272 N280 L293 L296	L272-C276 WeakPolarHBondContact O-CB 3.39Å; L272-C276 PolarHBondContact O-N 2.84Å; L272-C276 PolarHBondContact O-SG 2.94Å; C276-N280 WeakPolarHBondContact O-CB 3.17Å; C276-N280 PolarHBondContact O-N 3.34Å; C276-L293 HydrophobicContact CB-CD1 3.59Å; C276-L296 HydrophobicContact CB-CD2 3.66Å; C276-L296 HydrophobicContact CB-CG 3.99Å
277	H	95.1	Very high	93	Very high	16 Å²	16	34 Å²	34	7%	0.074	18%	0.176	C	C	.	.	H	α-helix	trans	-65.2	-45.7	178.4	177.4	72.1	0	0	0	112.1	R273 T274 D275 I279 N280 I281 L293 R341	R273-H277 VanDerWaalsContact O-CB 3.24Å; R273-H277 WeakPolarHBondContact O-CB 3.49Å; R273-H277 PolarHBondContact O-N 3.22Å; T274-H277 PolarHBondContact O-N 3.38Å; D275-H277 VanDerWaalsContact C-N 3.33Å; D275-H277 PolarHBondContact O-N 3.13Å; H277-I279 VanDerWaalsContact C-N 3.33Å; H277-I279 PolarHBondContact O-N 2.9Å; H277-N280 PolarHBondContact O-N 3.43Å; H277-I281 WeakPolarHBondContact CE1-CD1 3.45Å; H277-I281 WeakPolarHBondContact NE2-CD1 3.33Å; H277-I281 WeakPolarHBondContact O-CG1 3.15Å; H277-I281 PolarHBondContact O-N 3.46Å; H277-L293 HydrophobicContact CB-CD1 3.89Å; H277-L293 HydrophobicContact CB-CD2 4.19Å; H277-R341 PolarHBondContact NE2-NH1 3.1Å
278	N	95.9	Very high	93.4	Very high	44 Å²	44	31.8 Å²	31.8	24%	0.235	17%	0.167	C	C	.	.	H	α-helix	trans	-60.1	-44.8	178	-67.8	-16	0	0	0	111.3	L240 T274 D275 I281 F282	L240-N278 WeakPolarHBondContact O-CB 2.99Å; L240-N278 PolarHBondContact O-ND2 3.45Å; T274-N278 PolarHBondContact O-N 3.41Å; T274-N278 PolarHBondContact O-ND2 3.1Å; T274-N278 PolarHBondContact O-OD1 3.49Å; D275-N278 PolarHBondContact O-N 3.06Å; N278-I281 PolarHBondContact O-N 3.47Å; N278-F282 WeakPolarHBondContact O-CB 3.4Å; N278-F282 PolarHBondContact O-N 3.28Å
279	I	96.5	Very high	93.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.7	-49.2	177.2	-69.8	-54.5	0	0	0	111.1	Y219 V222 I226 L240 L245 D275 H277 I281 F282 F283	Y219-I279 HydrophobicContact CD2-CG2 4.4Å; Y219-I279 HydrophobicContact CE2-CG2 4.17Å; V222-I279 HydrophobicContact CG1-CD1 3.98Å; V222-I279 HydrophobicContact CG1-CG1 4.13Å; V222-I279 HydrophobicContact CG1-CG2 3.82Å; I226-I279 HydrophobicContact CD1-CG1 4.17Å; I226-I279 HydrophobicContact CD1-CG2 4.49Å; L240-I279 HydrophobicContact CD2-CD1 4.26Å; L240-I279 HydrophobicContact CD2-CG1 3.92Å; L240-I279 HydrophobicContact CG-CD1 4.05Å; L240-I279 HydrophobicContact CG-CG1 4.1Å; L245-I279 HydrophobicContact CD1-CD1 3.84Å; D275-I279 WeakPolarHBondContact O-CG1 3.49Å; D275-I279 PolarHBondContact O-N 3.14Å; D275-I279 VanDerWaalsContact O-N 3.08Å; H277-I279 VanDerWaalsContact C-N 3.33Å; H277-I279 PolarHBondContact O-N 2.9Å; I279-I281 PolarHBondContact O-N 3.45Å; I279-F282 PolarHBondContact O-N 3.28Å; I279-F283 HydrophobicContact CG2-CD2 3.74Å; I279-F283 HydrophobicContact CG2-CE2 3.88Å; I279-F283 VanDerWaalsContact O-CD2 3.3Å; I279-F283 WeakPolarHBondContact O-CD2 3.18Å; I279-F283 PolarHBondContact O-N 2.84Å
280	N	95.1	Very high	93.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59	-46.1	177.6	-82.2	-3.5	0	0	0	111.9	Y219 C276 H277 F282 F283 R284 L291 L296	Y219-N280 WeakPolarHBondContact CE2-OD1 3.5Å; Y219-N280 PolarHBondContact OH-OD1 3.06Å; C276-N280 WeakPolarHBondContact O-CB 3.17Å; C276-N280 PolarHBondContact O-N 3.34Å; H277-N280 PolarHBondContact O-N 3.43Å; N280-F282 VanDerWaalsContact C-N 3.31Å; N280-F282 PolarHBondContact O-N 3.06Å; N280-F283 PolarHBondContact O-N 2.88Å; N280-R284 WeakPolarHBondContact O-CB 3.47Å; N280-R284 WeakPolarHBondContact O-CG 3.5Å; N280-R284 PolarHBondContact O-N 2.92Å; N280-L291 PolarHBondContact ND2-O 3.4Å; N280-L296 VanDerWaalsContact OD1-CD2 3.29Å; N280-L296 WeakPolarHBondContact OD1-CD2 3.37Å
281	I	93.8	Very high	93.7	Very high	62 Å²	62	28.2 Å²	28.2	32%	0.318	15%	0.154	S	C	.	.	H	α-helix	trans	-57.3	-45.8	176.6	-74.8	177.2	0	0	0	111.2	H277 N278 I279 K285	H277-I281 WeakPolarHBondContact CE1-CD1 3.45Å; H277-I281 WeakPolarHBondContact NE2-CD1 3.33Å; H277-I281 WeakPolarHBondContact O-CG1 3.15Å; H277-I281 PolarHBondContact O-N 3.46Å; N278-I281 PolarHBondContact O-N 3.47Å; I279-I281 PolarHBondContact O-N 3.45Å; I281-K285 HydrophobicContact CG2-CD 4.34Å; I281-K285 WeakPolarHBondContact O-CG 3.3Å; I281-K285 PolarHBondContact O-N 3.18Å
282	F	94.6	Very high	93.7	Very high	8 Å²	8	27.5 Å²	27.5	4%	0.035	15%	0.152	C	C	.	.	H	α-helix	trans	-62.3	-50.3	-178.4	173.6	-101.3	0	0	0	111.7	L199 C203 W215 E242 N278 I279 N280 K285 Q286	L199-F282 HydrophobicContact CB-CZ 4.47Å; L199-F282 HydrophobicContact CD2-CD1 4.24Å; L199-F282 HydrophobicContact CD2-CE1 3.47Å; L199-F282 VanDerWaalsContact CD2-CE1 3.47Å; L199-F282 HydrophobicContact CD2-CZ 4.06Å; L199-F282 HydrophobicContact CG-CE1 3.67Å; L199-F282 HydrophobicContact CG-CZ 3.73Å; C203-F282 VanDerWaalsContact SG-CE2 3.59Å; C203-F282 WeakPolarHBondContact SG-CZ 3.38Å; W215-F282 HydrophobicContact CH2-CZ 4.28Å; W215-F282 AromaticContact CZ3-CE1 3.91Å; W215-F282 HydrophobicContact CZ3-CE1 3.91Å; W215-F282 AromaticContact CZ3-CZ 3.88Å; W215-F282 HydrophobicContact CZ3-CZ 3.88Å; E242-F282 HydrophobicContact CB-CB 4.5Å; E242-F282 HydrophobicContact CB-CD1 4.16Å; E242-F282 HydrophobicContact CB-CD2 3.35Å; E242-F282 HydrophobicContact CB-CE1 4.25Å; E242-F282 HydrophobicContact CB-CE2 3.44Å; E242-F282 VanDerWaalsContact CB-CE2 3.44Å; E242-F282 HydrophobicContact CB-CG 3.73Å; E242-F282 HydrophobicContact CB-CZ 3.91Å; E242-F282 HydrophobicContact CG-CD2 3.62Å; E242-F282 HydrophobicContact CG-CE2 3.83Å; E242-F282 HydrophobicContact CG-CG 4.35Å; N278-F282 WeakPolarHBondContact O-CB 3.4Å; N278-F282 PolarHBondContact O-N 3.28Å; I279-F282 PolarHBondContact O-N 3.28Å; N280-F282 VanDerWaalsContact C-N 3.31Å; N280-F282 PolarHBondContact O-N 3.06Å; F282-K285 WeakPolarHBondContact O-CB 3.39Å; F282-K285 PolarHBondContact O-N 3.21Å; F282-Q286 HydrophobicContact CE1-CG 4.4Å; F282-Q286 HydrophobicContact CZ-CG 4.31Å; F282-Q286 PolarHBondContact O-N 3.33Å
283	F	94.5	Very high	93.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-71.2	-31.4	-178	-78	-78.8	0	0	0	113.2	L199 W215 L218 Y219 V222 I279 N280 K285 Q286 G287 V288 T290	L199-F283 HydrophobicContact CD2-CZ 4.1Å; W215-F283 HydrophobicContact CE3-CD1 4.43Å; W215-F283 HydrophobicContact CE3-CE1 4.19Å; L218-F283 HydrophobicContact CB-CE1 3.94Å; L218-F283 HydrophobicContact CB-CZ 4.28Å; Y219-F283 HydrophobicContact CD2-CB 3.79Å; Y219-F283 HydrophobicContact CD2-CD1 4.19Å; Y219-F283 AromaticContact CD2-CD2 3.48Å; Y219-F283 HydrophobicContact CD2-CD2 3.48Å; Y219-F283 VanDerWaalsContact CD2-CD2 3.48Å; Y219-F283 HydrophobicContact CD2-CE2 4.04Å; Y219-F283 AromaticContact CD2-CG 3.55Å; Y219-F283 HydrophobicContact CD2-CG 3.55Å; Y219-F283 HydrophobicContact CE2-CB 4.34Å; Y219-F283 HydrophobicContact CE2-CD2 4.23Å; Y219-F283 HydrophobicContact CE2-CG 4.44Å; Y219-F283 HydrophobicContact CG-CB 4.35Å; Y219-F283 HydrophobicContact CG-CD1 4.36Å; Y219-F283 HydrophobicContact CG-CD2 4.39Å; Y219-F283 HydrophobicContact CG-CG 4.12Å; V222-F283 HydrophobicContact CB-CE2 4.22Å; V222-F283 HydrophobicContact CB-CZ 4.4Å; V222-F283 HydrophobicContact CG1-CE2 4.35Å; V222-F283 HydrophobicContact CG2-CE2 4.17Å; V222-F283 HydrophobicContact CG2-CZ 4Å; I279-F283 HydrophobicContact CG2-CD2 3.74Å; I279-F283 HydrophobicContact CG2-CE2 3.88Å; I279-F283 VanDerWaalsContact O-CD2 3.3Å; I279-F283 WeakPolarHBondContact O-CD2 3.18Å; I279-F283 PolarHBondContact O-N 2.84Å; N280-F283 PolarHBondContact O-N 2.88Å; F283-K285 VanDerWaalsContact C-N 3.3Å; F283-K285 PolarHBondContact O-N 2.85Å; F283-Q286 PolarHBondContact O-N 3.16Å; F283-Q286 VanDerWaalsContact O-N 3.08Å; F283-G287 PolarHBondContact O-N 3Å; F283-V288 HydrophobicContact CB-CB 4.26Å; F283-V288 HydrophobicContact CD1-CG2 4.32Å; F283-V288 WeakPolarHBondContact O-CB 3.4Å; F283-V288 PolarHBondContact O-N 2.85Å; F283-V288 VanDerWaalsContact O-N 3.13Å; F283-T290 HydrophobicContact CB-CG2 3.79Å
284	R	92.6	Very high	93.5	Very high	34 Å²	34	30.1 Å²	30.1	13%	0.128	16%	0.162	C	C	.	.	H	α-helix	trans	-59.7	-40.8	170.6	-75.7	179.9	-170.3	166.6	9.1	112	N280 Q286 G287 T290 L291 L329 I333 D337	N280-R284 WeakPolarHBondContact O-CB 3.47Å; N280-R284 WeakPolarHBondContact O-CG 3.5Å; N280-R284 PolarHBondContact O-N 2.92Å; R284-Q286 PolarHBondContact O-N 2.57Å; R284-G287 PolarHBondContact O-N 2.99Å; R284-T290 HydrophobicContact CG-CG2 3.77Å; R284-T290 VanDerWaalsContact CG-OG1 3.29Å; R284-T290 WeakPolarHBondContact CG-OG1 3.45Å; R284-T290 PolarHBondContact NE-OG1 2.83Å; R284-L291 PolarHBondContact NH2-O 3.11Å; R284-L329 HydrophobicContact CG-CD2 3.8Å; R284-I333 VanDerWaalsContact NH2-CG2 3.33Å; R284-D337 IonicContact CZ-OD2 3.14Å; R284-D337 IonicContact NH1-OD2 2.73Å; R284-D337 PolarHBondContact NH1-OD2 3.39Å; R284-D337 IonicContact NH2-OD2 2.69Å; R284-D337 PolarHBondContact NH2-OD2 3.38Å
285	K	91.4	Very high	93.5	Very high	155 Å²	155	29.8 Å²	29.8	67%	0.674	16%	0.157	S	C	*	.	H	α-helix	trans	-63.2	-24.8	175.8	-71.8	173.6	179.2	179.8	0	113.1	I281 F282 F283 G287	I281-K285 HydrophobicContact CG2-CD 4.34Å; I281-K285 WeakPolarHBondContact O-CG 3.3Å; I281-K285 PolarHBondContact O-N 3.18Å; F282-K285 WeakPolarHBondContact O-CB 3.39Å; F282-K285 PolarHBondContact O-N 3.21Å; F283-K285 VanDerWaalsContact C-N 3.3Å; F283-K285 PolarHBondContact O-N 2.85Å; K285-G287 VanDerWaalsContact C-N 3.28Å
286	Q	90.3	Very high	93.4	Very high	55 Å²	55	29.7 Å²	29.7	26%	0.257	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	4.3	174.3	-51.6	-49.5	-43	0	0	113.1	C203 W215 F282 F283 R284	C203-Q286 VanDerWaalsContact SG-CD 3.5Å; C203-Q286 PolarHBondContact SG-NE2 2.92Å; W215-Q286 HydrophobicContact CB-CB 4.31Å; W215-Q286 HydrophobicContact CD2-CB 3.72Å; W215-Q286 HydrophobicContact CD2-CG 3.8Å; W215-Q286 HydrophobicContact CE3-CB 4.13Å; W215-Q286 HydrophobicContact CE3-CG 3.79Å; W215-Q286 HydrophobicContact CG-CB 3.8Å; W215-Q286 HydrophobicContact CG-CG 4.42Å; W215-Q286 HydrophobicContact CH2-CG 4.17Å; W215-Q286 HydrophobicContact CZ2-CG 4.15Å; W215-Q286 HydrophobicContact CZ3-CG 3.98Å; F282-Q286 HydrophobicContact CE1-CG 4.4Å; F282-Q286 HydrophobicContact CZ-CG 4.31Å; F282-Q286 PolarHBondContact O-N 3.33Å; F283-Q286 PolarHBondContact O-N 3.16Å; F283-Q286 VanDerWaalsContact O-N 3.08Å; R284-Q286 PolarHBondContact O-N 2.57Å
287	G	88.5	Confident	93.3	Very high	59 Å²	59	29.8 Å²	29.8	61%	0.608	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	84	13.5	179.1	0	0	0	0	0	115	F283 R284 K285	F283-G287 PolarHBondContact O-N 3Å; R284-G287 PolarHBondContact O-N 2.99Å; K285-G287 VanDerWaalsContact C-N 3.28Å
288	V	91.8	Very high	93.1	Very high	16 Å²	16	31.8 Å²	31.8	10%	0.097	17%	0.166	C	C	.	.			trans	-83	131.2	177.6	-176.3	0	0	0	0	110.6	W215 Y219 F283 T290	W215-V288 HydrophobicContact CB-CG2 3.41Å; W215-V288 VanDerWaalsContact CB-CG2 3.41Å; Y219-V288 HydrophobicContact CD1-CG1 4.05Å; Y219-V288 HydrophobicContact CG-CG1 4.18Å; F283-V288 HydrophobicContact CB-CB 4.26Å; F283-V288 HydrophobicContact CD1-CG2 4.32Å; F283-V288 WeakPolarHBondContact O-CB 3.4Å; F283-V288 PolarHBondContact O-N 2.85Å; F283-V288 VanDerWaalsContact O-N 3.13Å; V288-T290 PolarHBondContact O-N 2.81Å
289	S	92.3	Very high	93.1	Very high	36 Å²	36	29.9 Å²	29.9	25%	0.252	16%	0.155	S	C	.	.			trans	-70.4	88.1	168.7	-62.7	0	0	0	0	110.6
290	T	93.5	Very high	93	Very high	3 Å²	3	29.9 Å²	29.9	2%	0.018	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-78.1	159.2	-179	61.7	0	0	0	0	112.8	Y219 F283 R284 V288	Y219-T290 HydrophobicContact CD2-CG2 4.29Å; Y219-T290 HydrophobicContact CE1-CG2 4.17Å; Y219-T290 HydrophobicContact CE2-CG2 3.8Å; Y219-T290 WeakPolarHBondContact OH-CB 3.29Å; F283-T290 HydrophobicContact CB-CG2 3.79Å; R284-T290 HydrophobicContact CG-CG2 3.77Å; R284-T290 VanDerWaalsContact CG-OG1 3.29Å; R284-T290 WeakPolarHBondContact CG-OG1 3.45Å; R284-T290 PolarHBondContact NE-OG1 2.83Å; V288-T290 PolarHBondContact O-N 2.81Å
291	L	93.7	Very high	92.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-58.9	158.9	165.1	-57.9	-178.8	0	0	0	111.4	Y219 I223 N280 R284 E295 L296 L317 L320 L321 A324	Y219-L291 PolarHBondContact OH-N 3.37Å; I223-L291 HydrophobicContact CD1-CD1 4.49Å; N280-L291 PolarHBondContact ND2-O 3.4Å; R284-L291 PolarHBondContact NH2-O 3.11Å; L291-E295 WeakPolarHBondContact CA-OE2 3.47Å; L291-E295 HydrophobicContact CB-CB 3.99Å; L291-L296 HydrophobicContact CB-CB 4.18Å; L291-L296 HydrophobicContact CD1-CB 4.35Å; L291-L296 HydrophobicContact CD1-CD1 4.43Å; L291-L317 HydrophobicContact CD1-CD1 4.47Å; L291-L320 HydrophobicContact CD2-CB 3.96Å; L291-L320 WeakPolarHBondContact CD2-O 3.39Å; L291-L321 HydrophobicContact CD2-CD2 4.07Å; L291-L321 HydrophobicContact CG-CD2 4.14Å; L291-A324 HydrophobicContact CD2-CB 3.84Å
292	T	93.5	Very high	92.6	Very high	9 Å²	9	28.3 Å²	28.3	6%	0.055	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-64.6	159	164.3	67.3	0	0	0	0	109.7	R294 E295 L296 R327 I333	T292-R294 PolarHBondContact O-N 3.31Å; T292-E295 PolarHBondContact N-OE2 3.41Å; T292-E295 PolarHBondContact O-N 2.8Å; T292-E295 WeakPolarHBondContact OG1-CB 3.3Å; T292-E295 WeakPolarHBondContact OG1-CG 3.35Å; T292-E295 PolarHBondContact OG1-N 3.3Å; T292-L296 WeakPolarHBondContact O-CB 3.4Å; T292-L296 PolarHBondContact O-N 3.12Å; T292-R327 VanDerWaalsContact CG2-NH1 3.3Å; T292-I333 HydrophobicContact CG2-CG2 4.16Å
293	L	93.5	Very high	92.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.6	-36.2	175.2	-179.3	58.8	0	0	0	111.2	C276 H277 F297 D337 F340 R341	C276-L293 HydrophobicContact CB-CD1 3.59Å; H277-L293 HydrophobicContact CB-CD1 3.89Å; H277-L293 HydrophobicContact CB-CD2 4.19Å; L293-F297 WeakPolarHBondContact O-CB 3.45Å; L293-F297 PolarHBondContact O-N 3.35Å; L293-D337 HydrophobicContact CB-CB 4.01Å; L293-D337 WeakPolarHBondContact CB-OD1 3.42Å; L293-D337 PolarHBondContact N-OD1 3Å; L293-F340 HydrophobicContact CB-CD1 4.39Å; L293-F340 HydrophobicContact CD2-CD1 3.85Å; L293-F340 HydrophobicContact CG-CD1 3.74Å; L293-F340 HydrophobicContact CG-CE1 4.27Å; L293-R341 HydrophobicContact CD2-CB 4.44Å
294	R	91	Very high	91.8	Very high	77 Å²	77	33 Å²	33	29%	0.291	18%	0.178	S	C	.	.	H	α-helix	trans	-64.8	-54.4	175.4	179.4	-176	178.5	142.8	10.9	111.5	T292 L296 F297 E298 F340 S370	T292-R294 PolarHBondContact O-N 3.31Å; R294-L296 VanDerWaalsContact C-N 3.32Å; R294-L296 PolarHBondContact O-N 3.1Å; R294-F297 PolarHBondContact O-N 3.15Å; R294-E298 HydrophobicContact CG-CG 4.37Å; R294-E298 WeakPolarHBondContact CG-OE1 3.33Å; R294-E298 IonicContact CZ-OE1 3.49Å; R294-E298 IonicContact NE-OE1 2.84Å; R294-E298 PolarHBondContact NE-OE1 3.13Å; R294-E298 IonicContact NH2-OE1 3.25Å; R294-E298 PolarHBondContact NH2-OE1 2.74Å; R294-E298 WeakPolarHBondContact O-CB 3.41Å; R294-E298 WeakPolarHBondContact O-CG 3.37Å; R294-E298 PolarHBondContact O-N 3.32Å; R294-F340 HydrophobicContact CB-CD2 4.44Å; R294-F340 HydrophobicContact CB-CG 4.5Å; R294-F340 HydrophobicContact CG-CE2 4.43Å; R294-S370 VanDerWaalsContact CZ-O 3.27Å; R294-S370 PolarHBondContact NH1-O 3.49Å; R294-S370 PolarHBondContact NH2-O 2.81Å
295	E	92.6	Very high	91.6	Very high	49 Å²	49	32 Å²	32	23%	0.229	18%	0.175	C	C	.	.	H	α-helix	trans	-56.6	-46	179.1	-75.5	162.9	-172.3	0	0	111.2	L291 T292 E298 W299 R327	L291-E295 WeakPolarHBondContact CA-OE2 3.47Å; L291-E295 HydrophobicContact CB-CB 3.99Å; T292-E295 PolarHBondContact N-OE2 3.41Å; T292-E295 PolarHBondContact O-N 2.8Å; T292-E295 WeakPolarHBondContact OG1-CB 3.3Å; T292-E295 WeakPolarHBondContact OG1-CG 3.35Å; T292-E295 PolarHBondContact OG1-N 3.3Å; E295-E298 PolarHBondContact O-N 3.13Å; E295-W299 WeakPolarHBondContact O-CB 3.09Å; E295-W299 PolarHBondContact O-N 3.09Å; E295-R327 VanDerWaalsContact CD-NH2 3.31Å; E295-R327 IonicContact OE1-CZ 3.75Å; E295-R327 IonicContact OE1-NE 3.97Å; E295-R327 IonicContact OE1-NH2 3.06Å; E295-R327 PolarHBondContact OE1-NH2 2.98Å; E295-R327 IonicContact OE2-CZ 3.9Å; E295-R327 IonicContact OE2-NH2 2.74Å; E295-R327 PolarHBondContact OE2-NH2 3.39Å
296	L	95	Very high	91.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.3	-42.3	178	177.8	55.8	0	0	0	111.7	I223 C276 N280 L291 T292 R294 W299 V300	I223-L296 HydrophobicContact CB-CD1 3.68Å; I223-L296 HydrophobicContact CG2-CD1 3.56Å; I223-L296 HydrophobicContact CG2-CD2 4.19Å; C276-L296 HydrophobicContact CB-CD2 3.66Å; C276-L296 HydrophobicContact CB-CG 3.99Å; N280-L296 VanDerWaalsContact OD1-CD2 3.29Å; N280-L296 WeakPolarHBondContact OD1-CD2 3.37Å; L291-L296 HydrophobicContact CB-CB 4.18Å; L291-L296 HydrophobicContact CD1-CB 4.35Å; L291-L296 HydrophobicContact CD1-CD1 4.43Å; T292-L296 WeakPolarHBondContact O-CB 3.4Å; T292-L296 PolarHBondContact O-N 3.12Å; R294-L296 VanDerWaalsContact C-N 3.32Å; R294-L296 PolarHBondContact O-N 3.1Å; L296-W299 PolarHBondContact O-N 3.14Å; L296-V300 HydrophobicContact CD1-CG2 4.25Å; L296-V300 VanDerWaalsContact O-CG2 3.26Å; L296-V300 WeakPolarHBondContact O-CG2 3.38Å; L296-V300 PolarHBondContact O-N 3.36Å
297	F	93.9	Very high	91.7	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.009	16%	0.158	C	C	.	.	H	α-helix	trans	-64.7	-45	177.3	-179.2	-93.7	0	0	0	112	L269 L272 R273 L293 R294 V300 V301 F340 I345 I377	L269-F297 HydrophobicContact CB-CE2 4.42Å; L269-F297 HydrophobicContact CB-CZ 4.28Å; L269-F297 HydrophobicContact CD2-CE2 4.32Å; L269-F297 HydrophobicContact CD2-CZ 3.98Å; L272-F297 HydrophobicContact CB-CE2 4.42Å; L272-F297 HydrophobicContact CD2-CD2 4.04Å; L272-F297 HydrophobicContact CD2-CE2 3.86Å; L272-F297 HydrophobicContact CG-CD2 4.15Å; L272-F297 HydrophobicContact CG-CE2 4.18Å; R273-F297 HydrophobicContact CG-CD2 3.41Å; R273-F297 VanDerWaalsContact CG-CD2 3.41Å; R273-F297 HydrophobicContact CG-CE2 3.49Å; R273-F297 VanDerWaalsContact CG-CE2 3.49Å; R273-F297 HydrophobicContact CG-CG 4.22Å; R273-F297 HydrophobicContact CG-CZ 4.34Å; L293-F297 WeakPolarHBondContact O-CB 3.45Å; L293-F297 PolarHBondContact O-N 3.35Å; R294-F297 PolarHBondContact O-N 3.15Å; F297-V300 PolarHBondContact O-N 2.92Å; F297-V301 HydrophobicContact CD1-CG2 4.45Å; F297-V301 HydrophobicContact CD2-CG2 4.35Å; F297-V301 HydrophobicContact CE1-CG2 4.16Å; F297-V301 HydrophobicContact CE2-CG2 4.04Å; F297-V301 HydrophobicContact CZ-CG2 3.96Å; F297-V301 WeakPolarHBondContact O-CG2 3.48Å; F297-V301 PolarHBondContact O-N 3.01Å; F297-F340 HydrophobicContact CB-CE1 3.94Å; F297-F340 HydrophobicContact CB-CZ 4.21Å; F297-F340 HydrophobicContact CD1-CE1 4.21Å; F297-F340 AromaticContact CD1-CZ 3.74Å; F297-F340 HydrophobicContact CD1-CZ 3.74Å; F297-F340 HydrophobicContact CE1-CZ 4.28Å; F297-F340 HydrophobicContact CG-CE1 4.01Å; F297-F340 HydrophobicContact CG-CZ 4.02Å; F297-I345 HydrophobicContact CE1-CD1 3.91Å; F297-I345 HydrophobicContact CZ-CD1 4.03Å; F297-I377 HydrophobicContact CE1-CD1 4.07Å; F297-I377 HydrophobicContact CE1-CG1 4.25Å; F297-I377 HydrophobicContact CZ-CD1 4.09Å
298	E	92.1	Very high	91.7	Very high	59 Å²	59	22.8 Å²	22.8	28%	0.276	13%	0.13	S	C	.	.	H	α-helix	trans	-63.6	-43.9	176.1	-71.3	-178.8	-174.5	0	0	111	R294 E295 V300 V301 N302 A376	R294-E298 HydrophobicContact CG-CG 4.37Å; R294-E298 WeakPolarHBondContact CG-OE1 3.33Å; R294-E298 IonicContact CZ-OE1 3.49Å; R294-E298 IonicContact NE-OE1 2.84Å; R294-E298 PolarHBondContact NE-OE1 3.13Å; R294-E298 IonicContact NH2-OE1 3.25Å; R294-E298 PolarHBondContact NH2-OE1 2.74Å; R294-E298 WeakPolarHBondContact O-CB 3.41Å; R294-E298 WeakPolarHBondContact O-CG 3.37Å; R294-E298 PolarHBondContact O-N 3.32Å; E295-E298 PolarHBondContact O-N 3.13Å; E298-V300 VanDerWaalsContact C-N 3.27Å; E298-V300 PolarHBondContact O-N 3.42Å; E298-V301 PolarHBondContact O-N 2.94Å; E298-N302 WeakPolarHBondContact O-CB 3.49Å; E298-N302 PolarHBondContact O-N 2.89Å; E298-A376 HydrophobicContact CB-CB 4.45Å; E298-A376 HydrophobicContact CG-CB 3.85Å
299	W	94.1	Very high	91.7	Very high	4 Å²	4	26.7 Å²	26.7	2%	0.015	15%	0.15	C	C	.	.	H	α-helix	trans	-53.4	-43.3	172.7	166.7	-108.9	0	0	0	112.1	R227 E295 L296 L305 S313 C316 L317 L320	R227-W299 WeakPolarHBondContact CD-O 3.11Å; R227-W299 PolarHBondContact NH1-O 2.82Å; E295-W299 WeakPolarHBondContact O-CB 3.09Å; E295-W299 PolarHBondContact O-N 3.09Å; L296-W299 PolarHBondContact O-N 3.14Å; W299-L305 HydrophobicContact CD2-CD1 4.5Å; W299-L305 HydrophobicContact CE3-CD1 3.57Å; W299-L305 HydrophobicContact CZ3-CD1 3.86Å; W299-S313 VanDerWaalsContact CH2-O 3.24Å; W299-S313 WeakPolarHBondContact CH2-O 3.36Å; W299-S313 WeakPolarHBondContact CH2-OG 3.29Å; W299-C316 HydrophobicContact CZ3-CB 4.16Å; W299-L317 HydrophobicContact CD2-CD1 4.08Å; W299-L317 HydrophobicContact CG-CD1 4.46Å; W299-L317 HydrophobicContact CH2-CB 3.76Å; W299-L317 HydrophobicContact CZ2-CB 3.73Å; W299-L317 HydrophobicContact CZ2-CD1 4.11Å; W299-L317 HydrophobicContact CZ2-CD2 4Å; W299-L317 HydrophobicContact CZ2-CG 4.16Å; W299-L317 HydrophobicContact CZ3-CB 4.3Å; W299-L320 HydrophobicContact CB-CD1 4.45Å; W299-L320 HydrophobicContact CD2-CD1 4.33Å; W299-L320 HydrophobicContact CE3-CD1 3.73Å; W299-L320 HydrophobicContact CZ3-CD1 4.45Å
300	V	94.9	Very high	91.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-72.3	-47.8	-178.7	170.7	0	0	0	0	111.7	I226 R227 F230 Q231 L272 L296 F297 E298	I226-V300 HydrophobicContact CB-CG2 4.24Å; I226-V300 HydrophobicContact CG2-CB 4.46Å; I226-V300 HydrophobicContact CG2-CG1 4.02Å; I226-V300 HydrophobicContact CG2-CG2 3.57Å; R227-V300 HydrophobicContact CB-CG2 4.42Å; F230-V300 HydrophobicContact CB-CG1 3.57Å; F230-V300 HydrophobicContact CD1-CG1 4.3Å; F230-V300 HydrophobicContact CD2-CG1 4.41Å; F230-V300 HydrophobicContact CG-CG1 3.85Å; Q231-V300 PolarHBondContact NE2-O 3.33Å; L272-V300 HydrophobicContact CD1-CG1 3.95Å; L272-V300 HydrophobicContact CD2-CB 4.44Å; L272-V300 HydrophobicContact CD2-CG1 3.74Å; L272-V300 HydrophobicContact CG-CG1 4.43Å; L296-V300 HydrophobicContact CD1-CG2 4.25Å; L296-V300 VanDerWaalsContact O-CG2 3.26Å; L296-V300 WeakPolarHBondContact O-CG2 3.38Å; L296-V300 PolarHBondContact O-N 3.36Å; F297-V300 PolarHBondContact O-N 2.92Å; E298-V300 VanDerWaalsContact C-N 3.27Å; E298-V300 PolarHBondContact O-N 3.42Å
301	V	92.2	Very high	91.6	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.024	18%	0.18	C	C	.	.	H	α-helix	trans	-86.4	-28.5	-167.2	-172.7	0	0	0	0	112.8	F230 Q231 L269 L272 F297 E298 P303 I377	F230-V301 HydrophobicContact CE1-CB 4.13Å; F230-V301 HydrophobicContact CE1-CG1 3.71Å; F230-V301 HydrophobicContact CE1-CG2 4.15Å; F230-V301 HydrophobicContact CE2-CG2 4.41Å; F230-V301 HydrophobicContact CZ-CB 4.38Å; F230-V301 HydrophobicContact CZ-CG1 3.79Å; F230-V301 HydrophobicContact CZ-CG2 4.04Å; Q231-V301 VanDerWaalsContact NE2-C 3.28Å; Q231-V301 PolarHBondContact NE2-O 3.03Å; L269-V301 HydrophobicContact CD2-CG2 4.37Å; L272-V301 HydrophobicContact CD2-CG2 3.42Å; L272-V301 VanDerWaalsContact CD2-CG2 3.42Å; F297-V301 HydrophobicContact CD1-CG2 4.45Å; F297-V301 HydrophobicContact CD2-CG2 4.35Å; F297-V301 HydrophobicContact CE1-CG2 4.16Å; F297-V301 HydrophobicContact CE2-CG2 4.04Å; F297-V301 HydrophobicContact CZ-CG2 3.96Å; F297-V301 WeakPolarHBondContact O-CG2 3.48Å; F297-V301 PolarHBondContact O-N 3.01Å; E298-V301 PolarHBondContact O-N 2.94Å; V301-P303 VanDerWaalsContact O-CD 3.23Å; V301-P303 WeakPolarHBondContact O-CD 3.44Å; V301-P303 VanDerWaalsContact O-N 3.13Å; V301-I377 HydrophobicContact CG1-CB 3.99Å; V301-I377 HydrophobicContact CG1-CG1 3.79Å; V301-I377 HydrophobicContact CG1-CG2 3.86Å
302	N	89.2	Confident	91.5	Very high	25 Å²	25	32.9 Å²	32.9	13%	0.134	19%	0.192	C	C	.	.			trans	-62.6	115	-171.6	-174	-3.7	0	0	0	111.9	R227 E298 T304 L305	R227-N302 PolarHBondContact NH1-O 2.91Å; E298-N302 WeakPolarHBondContact O-CB 3.49Å; E298-N302 PolarHBondContact O-N 2.89Å; N302-T304 VanDerWaalsContact C-N 3.3Å; N302-T304 PolarHBondContact ND2-OG1 2.63Å; N302-T304 WeakPolarHBondContact OD1-CB 3.26Å; N302-T304 PolarHBondContact OD1-N 3.17Å; N302-T304 PolarHBondContact OD1-OG1 3.44Å; N302-L305 HydrophobicContact CB-CD1 3.96Å; N302-L305 HydrophobicContact CB-CG 4.12Å
303	P	86	Confident	91.5	Very high	71 Å²	71	32.5 Å²	32.5	46%	0.461	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-10.2	-178.7	33.6	-35.8	0	0	0	113.5	V301	V301-P303 VanDerWaalsContact O-CD 3.23Å; V301-P303 WeakPolarHBondContact O-CD 3.44Å; V301-P303 VanDerWaalsContact O-N 3.13Å
304	T	85.9	Confident	91.4	Very high	35 Å²	35	37.6 Å²	37.6	22%	0.215	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-16.6	-177.6	70.8	0	0	0	0	112.5	N302 I388	N302-T304 VanDerWaalsContact C-N 3.3Å; N302-T304 PolarHBondContact ND2-OG1 2.63Å; N302-T304 WeakPolarHBondContact OD1-CB 3.26Å; N302-T304 PolarHBondContact OD1-N 3.17Å; N302-T304 PolarHBondContact OD1-OG1 3.44Å; T304-I388 HydrophobicContact CG2-CB 4.03Å
305	L	89.4	Confident	91.5	Very high	13 Å²	13	39.7 Å²	39.7	7%	0.068	23%	0.225	C	C	.	.	S	Bend	trans	-71.7	150.9	172.8	-65.3	176.5	0	0	0	110.7	R227 W299 N302 P391 I393	R227-L305 VanDerWaalsContact NH2-CB 3.29Å; R227-L305 PolarHBondContact NH2-O 2.95Å; R227-L305 VanDerWaalsContact NH2-O 3.12Å; W299-L305 HydrophobicContact CD2-CD1 4.5Å; W299-L305 HydrophobicContact CE3-CD1 3.57Å; W299-L305 HydrophobicContact CZ3-CD1 3.86Å; N302-L305 HydrophobicContact CB-CD1 3.96Å; N302-L305 HydrophobicContact CB-CG 4.12Å; L305-P391 HydrophobicContact CD2-CB 3.96Å; L305-I393 HydrophobicContact CD2-CD1 4.25Å
306	P	91	Very high	91.5	Very high	22 Å²	22	37.9 Å²	37.9	14%	0.143	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-50.9	147.3	177.4	-26.2	33.8	0	0	0	112.8	R227 D310 S313	R227-P306 PolarHBondContact NH2-O 3.07Å; P306-D310 HydrophobicContact CB-CB 4.26Å; P306-S313 PolarHBondContact O-OG 2.87Å
307	A	91	Very high	91.4	Very high	50 Å²	50	37.9 Å²	37.9	41%	0.413	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-60.9	148.5	-179.4	0	0	0	0	0	110.6	D309 D310 S313	A307-D309 WeakPolarHBondContact CB-OD1 3.45Å; A307-D309 PolarHBondContact O-N 2.88Å; A307-D310 WeakPolarHBondContact O-CB 3Å; A307-D310 PolarHBondContact O-N 3.39Å; A307-S313 VanDerWaalsContact O-CB 3.3Å; A307-S313 WeakPolarHBondContact O-CB 3.46Å
308	P	90.3	Very high	91.4	Very high	4 Å²	4	42.2 Å²	42.2	3%	0.026	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.3	-171.4	-23.4	33.4	0	0	0	115.6	L170 H224 R227 T228 Q231 K232	L170-P308 HydrophobicContact CD1-CB 4.43Å; H224-P308 PolarHBondContact CE1-O 2.85Å; H224-P308 VanDerWaalsContact CE1-O 3.3Å; H224-P308 PolarHBondContact NE2-O 2.68Å; R227-P308 HydrophobicContact CG-CG 4.17Å; T228-P308 VanDerWaalsContact OG1-CB 3.23Å; T228-P308 WeakPolarHBondContact OG1-CB 3.32Å; Q231-P308 HydrophobicContact CB-CG 3.98Å; Q231-P308 HydrophobicContact CG-CG 4.49Å; K232-P308 HydrophobicContact CG-CG 4.32Å
309	D	90.7	Very high	91.5	Very high	97 Å²	97	40.6 Å²	40.6	52%	0.519	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-20.8	171.9	42	-19.9	0	0	0	114.6	L170 K232 A307	L170-D309 HydrophobicContact CD1-CB 4.21Å; K232-D309 WeakPolarHBondContact CE-OD1 3.41Å; K232-D309 WeakPolarHBondContact CE-OD2 3.26Å; K232-D309 IonicContact NZ-OD1 3.79Å; K232-D309 PolarHBondContact NZ-OD1 2.76Å; K232-D309 IonicContact NZ-OD2 3.08Å; K232-D309 PolarHBondContact NZ-OD2 3.26Å; A307-D309 WeakPolarHBondContact CB-OD1 3.45Å; A307-D309 PolarHBondContact O-N 2.88Å
310	D	92.6	Very high	91.4	Very high	70 Å²	70	41.5 Å²	41.5	37%	0.374	24%	0.239	S	C	.	.	S	Bend	trans	-74.1	141.2	-178.2	-170.4	23.4	0	0	0	111	P306 A307 S312 S313	P306-D310 HydrophobicContact CB-CB 4.26Å; A307-D310 WeakPolarHBondContact O-CB 3Å; A307-D310 PolarHBondContact O-N 3.39Å; D310-S312 PolarHBondContact O-N 3.48Å; D310-S312 VanDerWaalsContact OD2-CB 3.26Å; D310-S312 WeakPolarHBondContact OD2-CB 3.11Å; D310-S312 PolarHBondContact OD2-OG 2.67Å; D310-S313 WeakPolarHBondContact O-CB 3.33Å; D310-S313 PolarHBondContact O-N 3.11Å; D310-S313 VanDerWaalsContact O-N 3.08Å
311	A	90.9	Very high	91.4	Very high	63 Å²	63	42.8 Å²	42.8	52%	0.521	25%	0.245	S	C	.	.	H	α-helix	trans	-61.3	-38.4	178.8	0	0	0	0	0	111	S313 K314 E315	A311-S313 PolarHBondContact O-N 2.68Å; A311-S313 VanDerWaalsContact O-N 3.12Å; A311-K314 WeakPolarHBondContact O-CB 3.32Å; A311-K314 PolarHBondContact O-N 3.4Å; A311-E315 PolarHBondContact O-N 2.98Å
312	S	92.9	Very high	91.4	Very high	37 Å²	37	50 Å²	50	26%	0.259	27%	0.272	S	S	.	.	H	α-helix	trans	-57.2	-27	175.9	-31	0	0	0	0	113	D310 E315 C316	D310-S312 PolarHBondContact O-N 3.48Å; D310-S312 VanDerWaalsContact OD2-CB 3.26Å; D310-S312 WeakPolarHBondContact OD2-CB 3.11Å; D310-S312 PolarHBondContact OD2-OG 2.67Å; S312-E315 PolarHBondContact O-N 3.47Å; S312-C316 WeakPolarHBondContact O-CB 3.2Å; S312-C316 PolarHBondContact O-N 3.3Å
313	S	91.6	Very high	91.6	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.4	-40.7	176.1	-164.7	0	0	0	0	111.1	W299 P306 A307 D310 A311 C316 L317	W299-S313 VanDerWaalsContact CH2-O 3.24Å; W299-S313 WeakPolarHBondContact CH2-O 3.36Å; W299-S313 WeakPolarHBondContact CH2-OG 3.29Å; P306-S313 PolarHBondContact O-OG 2.87Å; A307-S313 VanDerWaalsContact O-CB 3.3Å; A307-S313 WeakPolarHBondContact O-CB 3.46Å; D310-S313 WeakPolarHBondContact O-CB 3.33Å; D310-S313 PolarHBondContact O-N 3.11Å; D310-S313 VanDerWaalsContact O-N 3.08Å; A311-S313 PolarHBondContact O-N 2.68Å; A311-S313 VanDerWaalsContact O-N 3.12Å; S313-C316 PolarHBondContact O-N 3.33Å; S313-L317 PolarHBondContact O-N 3.12Å
314	K	92.1	Very high	91.8	Very high	107 Å²	107	49.7 Å²	49.7	47%	0.465	26%	0.264	S	S	.	.	H	α-helix	trans	-66.8	-40.1	178.1	-63.8	-176.9	-179.5	178.9	0	111.4	F220 A311 L317 M318	F220-K314 HydrophobicContact CZ-CB 4.05Å; F220-K314 HydrophobicContact CZ-CG 4.12Å; A311-K314 WeakPolarHBondContact O-CB 3.32Å; A311-K314 PolarHBondContact O-N 3.4Å; K314-L317 PolarHBondContact O-N 3.47Å; K314-M318 WeakPolarHBondContact O-CG 3.47Å; K314-M318 PolarHBondContact O-N 3.14Å
315	E	93.1	Very high	92	Very high	122 Å²	122	51.4 Å²	51.4	57%	0.57	28%	0.278	S	S	*	.	H	α-helix	trans	-62.3	-45.3	176.5	-66.8	173.7	-173.1	0	0	112.1	A311 S312 L317 M318 S319	A311-E315 PolarHBondContact O-N 2.98Å; S312-E315 PolarHBondContact O-N 3.47Å; E315-L317 VanDerWaalsContact C-N 3.32Å; E315-L317 PolarHBondContact O-N 2.89Å; E315-M318 HydrophobicContact CB-CE 4.38Å; E315-M318 HydrophobicContact CG-CE 4.04Å; E315-M318 PolarHBondContact O-N 3.06Å; E315-S319 PolarHBondContact O-N 3.36Å
316	C	92.7	Very high	92.1	Very high	11 Å²	11	57.5 Å²	57.5	7%	0.074	31%	0.309	C	S	.	.	H	α-helix	trans	-58.8	-44.5	175.2	-176.7	0	0	0	0	111.7	W299 S312 S313 S319 L320 I393	W299-C316 HydrophobicContact CZ3-CB 4.16Å; S312-C316 WeakPolarHBondContact O-CB 3.2Å; S312-C316 PolarHBondContact O-N 3.3Å; S313-C316 PolarHBondContact O-N 3.33Å; C316-S319 PolarHBondContact O-N 2.97Å; C316-L320 PolarHBondContact O-N 2.94Å; C316-I393 WeakPolarHBondContact SG-CD1 3.14Å
317	L	93.5	Very high	92	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-64.4	-40.5	175.8	-177.7	56.1	0	0	0	112.5	F220 I223 H224 L291 W299 S313 K314 E315 S319 L320 L321	F220-L317 HydrophobicContact CD2-CD2 3.69Å; F220-L317 HydrophobicContact CD2-CG 3.98Å; F220-L317 HydrophobicContact CE2-CB 4.09Å; F220-L317 HydrophobicContact CE2-CD2 3.53Å; F220-L317 HydrophobicContact CE2-CG 3.79Å; F220-L317 HydrophobicContact CG-CD2 4.27Å; F220-L317 HydrophobicContact CZ-CD2 3.99Å; I223-L317 HydrophobicContact CD1-CD1 3.7Å; I223-L317 HydrophobicContact CD1-CD2 4.09Å; I223-L317 HydrophobicContact CD1-CG 4.31Å; I223-L317 HydrophobicContact CG1-CD1 4.11Å; I223-L317 HydrophobicContact CG1-CD2 3.83Å; H224-L317 HydrophobicContact CB-CD2 4.27Å; L291-L317 HydrophobicContact CD1-CD1 4.47Å; W299-L317 HydrophobicContact CD2-CD1 4.08Å; W299-L317 HydrophobicContact CG-CD1 4.46Å; W299-L317 HydrophobicContact CH2-CB 3.76Å; W299-L317 HydrophobicContact CZ2-CB 3.73Å; W299-L317 HydrophobicContact CZ2-CD1 4.11Å; W299-L317 HydrophobicContact CZ2-CD2 4Å; W299-L317 HydrophobicContact CZ2-CG 4.16Å; W299-L317 HydrophobicContact CZ3-CB 4.3Å; S313-L317 PolarHBondContact O-N 3.12Å; K314-L317 PolarHBondContact O-N 3.47Å; E315-L317 VanDerWaalsContact C-N 3.32Å; E315-L317 PolarHBondContact O-N 2.89Å; L317-S319 VanDerWaalsContact C-N 3.29Å; L317-S319 PolarHBondContact O-N 2.85Å; L317-L320 PolarHBondContact O-N 3.08Å; L317-L321 HydrophobicContact CD1-CD1 4.44Å; L317-L321 HydrophobicContact CD1-CG 4.32Å; L317-L321 HydrophobicContact CG-CD1 4.16Å; L317-L321 WeakPolarHBondContact O-CG 3.49Å; L317-L321 PolarHBondContact O-N 3.46Å
318	M	93.9	Very high	91.7	Very high	93 Å²	93	58.4 Å²	58.4	46%	0.458	31%	0.305	S	S	.	.	H	α-helix	trans	-61.9	-36.6	176	-74	-172.6	-64.5	0	0	112.1	F220 K314 E315 L321 R322	F220-M318 HydrophobicContact CE2-CG 3.95Å; K314-M318 WeakPolarHBondContact O-CG 3.47Å; K314-M318 PolarHBondContact O-N 3.14Å; E315-M318 HydrophobicContact CB-CE 4.38Å; E315-M318 HydrophobicContact CG-CE 4.04Å; E315-M318 PolarHBondContact O-N 3.06Å; M318-L321 PolarHBondContact O-N 3.36Å; M318-R322 WeakPolarHBondContact O-CB 3.42Å; M318-R322 PolarHBondContact O-N 3.32Å
319	S	94	Very high	91.3	Very high	25 Å²	25	62 Å²	62	18%	0.175	32%	0.324	C	S	.	.	H	α-helix	trans	-63	-48.5	174.6	-159.5	0	0	0	0	111.8	E315 C316 L317 L321 R322 E323	E315-S319 PolarHBondContact O-N 3.36Å; C316-S319 PolarHBondContact O-N 2.97Å; L317-S319 VanDerWaalsContact C-N 3.29Å; L317-S319 PolarHBondContact O-N 2.85Å; S319-L321 VanDerWaalsContact C-N 3.31Å; S319-L321 PolarHBondContact O-N 3.33Å; S319-R322 WeakPolarHBondContact O-CB 3.22Å; S319-R322 PolarHBondContact O-N 2.71Å; S319-R322 VanDerWaalsContact O-N 3.08Å; S319-E323 PolarHBondContact O-N 3.46Å
320	L	92.9	Very high	90.9	Very high	23 Å²	23	61.6 Å²	61.6	12%	0.12	32%	0.321	C	S	.	.	H	α-helix	trans	-59.6	-41.1	177.6	-68.5	173.3	0	0	0	112	L291 W299 C316 L317 R322 E323 A324 I393	L291-L320 HydrophobicContact CD2-CB 3.96Å; L291-L320 WeakPolarHBondContact CD2-O 3.39Å; W299-L320 HydrophobicContact CB-CD1 4.45Å; W299-L320 HydrophobicContact CD2-CD1 4.33Å; W299-L320 HydrophobicContact CE3-CD1 3.73Å; W299-L320 HydrophobicContact CZ3-CD1 4.45Å; C316-L320 PolarHBondContact O-N 2.94Å; L317-L320 PolarHBondContact O-N 3.08Å; L320-R322 VanDerWaalsContact C-N 3.34Å; L320-E323 PolarHBondContact O-N 3.46Å; L320-A324 PolarHBondContact O-N 2.94Å; L320-I393 HydrophobicContact CD1-CD1 4.36Å; L320-I393 HydrophobicContact CD2-CD1 4.03Å; L320-I393 HydrophobicContact CG-CD1 4.22Å
321	L	93.8	Very high	90.4	Very high	26 Å²	26	65.2 Å²	65.2	14%	0.136	34%	0.336	C	S	.	.	H	α-helix	trans	-68.6	-32.3	176.7	-70.4	173.9	0	0	0	112.7	Y219 F220 I223 L291 L317 M318 S319 A324 S325	Y219-L321 HydrophobicContact CD1-CD2 3.87Å; Y219-L321 HydrophobicContact CE1-CD2 3.57Å; F220-L321 HydrophobicContact CB-CD1 4.3Å; F220-L321 HydrophobicContact CD2-CD1 3.64Å; F220-L321 HydrophobicContact CG-CD1 4.46Å; I223-L321 HydrophobicContact CD1-CD1 4.38Å; I223-L321 HydrophobicContact CD1-CD2 4.04Å; L291-L321 HydrophobicContact CD2-CD2 4.07Å; L291-L321 HydrophobicContact CG-CD2 4.14Å; L317-L321 HydrophobicContact CD1-CD1 4.44Å; L317-L321 HydrophobicContact CD1-CG 4.32Å; L317-L321 HydrophobicContact CG-CD1 4.16Å; L317-L321 WeakPolarHBondContact O-CG 3.49Å; L317-L321 PolarHBondContact O-N 3.46Å; M318-L321 PolarHBondContact O-N 3.36Å; S319-L321 VanDerWaalsContact C-N 3.31Å; S319-L321 PolarHBondContact O-N 3.33Å; L321-A324 PolarHBondContact O-N 3.2Å; L321-S325 WeakPolarHBondContact O-CB 3.17Å; L321-S325 PolarHBondContact O-N 3.27Å; L321-S325 PolarHBondContact O-OG 2.98Å
322	R	93.1	Very high	90.1	Very high	156 Å²	156	66.1 Å²	66.1	59%	0.589	34%	0.335	S	S	*	.	H	α-helix	trans	-64.6	-46.1	173.8	-170.7	-172	-61.5	123.8	-1.7	110.7	M318 S319 L320 S325 I326	M318-R322 WeakPolarHBondContact O-CB 3.42Å; M318-R322 PolarHBondContact O-N 3.32Å; S319-R322 WeakPolarHBondContact O-CB 3.22Å; S319-R322 PolarHBondContact O-N 2.71Å; S319-R322 VanDerWaalsContact O-N 3.08Å; L320-R322 VanDerWaalsContact C-N 3.34Å; R322-S325 WeakPolarHBondContact O-CB 3.42Å; R322-S325 PolarHBondContact O-N 2.92Å; R322-I326 HydrophobicContact CG-CD1 4.36Å; R322-I326 WeakPolarHBondContact O-CG1 3.16Å; R322-I326 PolarHBondContact O-N 2.93Å
323	E	91.6	Very high	89.8	Confident	89 Å²	89	64.6 Å²	64.6	42%	0.416	32%	0.324	S	S	.	.	H	α-helix	trans	-60.1	-45.1	175.3	-70.9	165.5	-145.8	0	0	111.7	S319 L320 S325 I326 R327	S319-E323 PolarHBondContact O-N 3.46Å; L320-E323 PolarHBondContact O-N 3.46Å; E323-S325 VanDerWaalsContact C-N 3.29Å; E323-S325 PolarHBondContact O-N 3.2Å; E323-I326 PolarHBondContact O-N 2.89Å; E323-R327 WeakPolarHBondContact O-CB 3.4Å; E323-R327 PolarHBondContact O-N 3.42Å
324	A	91	Very high	89.4	Confident	1 Å²	1	70 Å²	70	1%	0.008	35%	0.349	C	S	.	.	H	α-helix	trans	-63.4	-35.3	175.2	0	0	0	0	0	112.7	L291 L320 L321 R327 G328	L291-A324 HydrophobicContact CD2-CB 3.84Å; L320-A324 PolarHBondContact O-N 2.94Å; L321-A324 PolarHBondContact O-N 3.2Å; A324-R327 PolarHBondContact O-N 2.82Å; A324-G328 PolarHBondContact O-N 2.92Å
325	S	90.3	Very high	89.1	Confident	71 Å²	71	71.4 Å²	71.4	50%	0.497	36%	0.355	S	S	.	.	H	α-helix	trans	-66.3	-39.5	175.5	-60.2	0	0	0	0	112.1	L321 R322 E323 G328	L321-S325 WeakPolarHBondContact O-CB 3.17Å; L321-S325 PolarHBondContact O-N 3.27Å; L321-S325 PolarHBondContact O-OG 2.98Å; R322-S325 WeakPolarHBondContact O-CB 3.42Å; R322-S325 PolarHBondContact O-N 2.92Å; E323-S325 VanDerWaalsContact C-N 3.29Å; E323-S325 PolarHBondContact O-N 3.2Å; S325-G328 PolarHBondContact O-N 2.66Å
326	I	90.9	Very high	88.8	Confident	141 Å²	141	71.1 Å²	71.1	72%	0.723	35%	0.354	S	S	*	.	H	α-helix	trans	-66.7	-41.8	175.6	-66.3	162.9	0	0	0	110.8	R322 E323 G328	R322-I326 HydrophobicContact CG-CD1 4.36Å; R322-I326 WeakPolarHBondContact O-CG1 3.16Å; R322-I326 PolarHBondContact O-N 2.93Å; E323-I326 PolarHBondContact O-N 2.89Å; I326-G328 VanDerWaalsContact C-N 3.31Å; I326-G328 PolarHBondContact O-N 3.14Å
327	R	88.5	Confident	88.6	Confident	71 Å²	71	70.8 Å²	70.8	27%	0.268	35%	0.352	S	S	.	.	H	α-helix	trans	-64.3	-34.7	178.3	173.8	166.2	44.5	90.5	-2.5	112.7	T292 E295 E323 A324 N330 I333	T292-R327 VanDerWaalsContact CG2-NH1 3.3Å; E295-R327 VanDerWaalsContact CD-NH2 3.31Å; E295-R327 IonicContact OE1-CZ 3.75Å; E295-R327 IonicContact OE1-NE 3.97Å; E295-R327 IonicContact OE1-NH2 3.06Å; E295-R327 PolarHBondContact OE1-NH2 2.98Å; E295-R327 IonicContact OE2-CZ 3.9Å; E295-R327 IonicContact OE2-NH2 2.74Å; E295-R327 PolarHBondContact OE2-NH2 3.39Å; E323-R327 WeakPolarHBondContact O-CB 3.4Å; E323-R327 PolarHBondContact O-N 3.42Å; A324-R327 PolarHBondContact O-N 2.82Å; R327-N330 PolarHBondContact O-ND2 2.85Å; R327-I333 HydrophobicContact CG-CD1 4.28Å
328	G	85.4	Confident	88.3	Confident	20 Å²	20	76.6 Å²	76.6	21%	0.206	38%	0.379	C	S	.	.			trans	69.2	-174.2	-178	0	0	0	0	0	113.6	A324 S325 I326 I333	A324-G328 PolarHBondContact O-N 2.92Å; S325-G328 PolarHBondContact O-N 2.66Å; I326-G328 VanDerWaalsContact C-N 3.31Å; I326-G328 PolarHBondContact O-N 3.14Å; G328-I333 WeakPolarHBondContact O-CD1 3.2Å
329	L	82	Confident	87.9	Confident	80 Å²	80	75.4 Å²	75.4	42%	0.419	38%	0.384	S	S	.	.			trans	-95.2	115.3	177.5	-64.5	172.7	0	0	0	109.8	R284	R284-L329 HydrophobicContact CG-CD2 3.8Å
330	N	82.3	Confident	87.5	Confident	88 Å²	88	74.7 Å²	74.7	47%	0.471	38%	0.378	S	S	.	.			trans	-134.3	151.2	-179.1	-60.5	-41.3	0	0	0	110.5	R327 T332 I333	R327-N330 PolarHBondContact O-ND2 2.85Å; N330-T332 PolarHBondContact O-N 2.91Å; N330-T332 VanDerWaalsContact O-N 3.09Å; N330-I333 HydrophobicContact CB-CD1 4.5Å; N330-I333 WeakPolarHBondContact O-CB 3.46Å; N330-I333 PolarHBondContact O-N 3.23Å
331	E	82.6	Confident	87.1	Confident	145 Å²	145	78 Å²	78	68%	0.678	39%	0.388	S	S	*	.	H	α-helix	trans	-58.1	-24.1	178.2	-64.6	-177.1	178.4	0	0	113.8	I333 E334 K335	E331-I333 VanDerWaalsContact C-N 3.27Å; E331-I333 PolarHBondContact O-N 3.35Å; E331-E334 PolarHBondContact O-N 2.82Å; E331-K335 PolarHBondContact O-N 3.42Å
332	T	84.6	Confident	86.4	Confident	83 Å²	83	85.3 Å²	85.3	51%	0.509	42%	0.415	S	S	.	.	H	α-helix	trans	-61.5	-37.3	176	47.8	0	0	0	0	112	N330 E334 K335 E336	N330-T332 PolarHBondContact O-N 2.91Å; N330-T332 VanDerWaalsContact O-N 3.09Å; T332-E334 VanDerWaalsContact C-N 3.34Å; T332-E334 PolarHBondContact O-N 2.96Å; T332-K335 PolarHBondContact O-N 2.79Å; T332-E336 WeakPolarHBondContact O-CG 3.49Å; T332-E336 PolarHBondContact O-N 2.75Å
333	I	85.1	Confident	85.9	Confident	4 Å²	4	79.3 Å²	79.3	2%	0.021	40%	0.396	C	S	.	.	H	α-helix	trans	-66.2	-40	-179.8	-61.1	164.5	0	0	0	110.5	R284 T292 R327 G328 N330 E331 K335 E336 D337	R284-I333 VanDerWaalsContact NH2-CG2 3.33Å; T292-I333 HydrophobicContact CG2-CG2 4.16Å; R327-I333 HydrophobicContact CG-CD1 4.28Å; G328-I333 WeakPolarHBondContact O-CD1 3.2Å; N330-I333 HydrophobicContact CB-CD1 4.5Å; N330-I333 WeakPolarHBondContact O-CB 3.46Å; N330-I333 PolarHBondContact O-N 3.23Å; E331-I333 VanDerWaalsContact C-N 3.27Å; E331-I333 PolarHBondContact O-N 3.35Å; I333-K335 VanDerWaalsContact C-N 3.34Å; I333-K335 PolarHBondContact O-N 3.11Å; I333-E336 PolarHBondContact O-N 3.37Å; I333-D337 WeakPolarHBondContact O-CB 3.4Å; I333-D337 PolarHBondContact O-N 2.8Å
334	E	83.9	Confident	85.2	Confident	114 Å²	114	82.5 Å²	82.5	53%	0.533	41%	0.411	S	S	.	.	H	α-helix	trans	-64	-42.6	179	-61.5	-170.1	155	0	0	111.1	E331 T332 D337 E338	E331-E334 PolarHBondContact O-N 2.82Å; T332-E334 VanDerWaalsContact C-N 3.34Å; T332-E334 PolarHBondContact O-N 2.96Å; E334-D337 PolarHBondContact O-N 3.4Å; E334-E338 WeakPolarHBondContact O-CB 3.43Å; E334-E338 WeakPolarHBondContact O-CG 3.47Å; E334-E338 PolarHBondContact O-N 2.89Å
335	K	86.6	Confident	84.5	Confident	136 Å²	136	83 Å²	83	59%	0.591	41%	0.413	S	S	*	.	H	α-helix	trans	-64.5	-41	176.4	-67.3	174.9	-174.6	167	0	112.3	E331 T332 I333 A339	E331-K335 PolarHBondContact O-N 3.42Å; T332-K335 PolarHBondContact O-N 2.79Å; I333-K335 VanDerWaalsContact C-N 3.34Å; I333-K335 PolarHBondContact O-N 3.11Å; K335-A339 WeakPolarHBondContact O-CB 3.46Å; K335-A339 PolarHBondContact O-N 3.42Å
336	E	85.7	Confident	83.7	Confident	116 Å²	116	80.7 Å²	80.7	54%	0.542	40%	0.397	S	S	.	.	H	α-helix	trans	-65.1	-42.3	175.8	-74.3	176.9	-174.1	0	0	112.1	T332 I333 A339 F340	T332-E336 WeakPolarHBondContact O-CG 3.49Å; T332-E336 PolarHBondContact O-N 2.75Å; I333-E336 PolarHBondContact O-N 3.37Å; E336-A339 PolarHBondContact O-N 3.45Å; E336-F340 PolarHBondContact O-N 2.9Å
337	D	88.7	Confident	82.7	Confident	5 Å²	5	76.6 Å²	76.6	3%	0.027	37%	0.372	C	S	.	.	H	α-helix	trans	-64.2	-42.4	177.2	-73.8	-10.4	0	0	0	111.7	R284 L293 I333 E334 F340 R341	R284-D337 IonicContact CZ-OD2 3.14Å; R284-D337 IonicContact NH1-OD2 2.73Å; R284-D337 PolarHBondContact NH1-OD2 3.39Å; R284-D337 IonicContact NH2-OD2 2.69Å; R284-D337 PolarHBondContact NH2-OD2 3.38Å; L293-D337 HydrophobicContact CB-CB 4.01Å; L293-D337 WeakPolarHBondContact CB-OD1 3.42Å; L293-D337 PolarHBondContact N-OD1 3Å; I333-D337 WeakPolarHBondContact O-CB 3.4Å; I333-D337 PolarHBondContact O-N 2.8Å; E334-D337 PolarHBondContact O-N 3.4Å; D337-F340 PolarHBondContact O-N 2.96Å; D337-R341 WeakPolarHBondContact O-CB 3.49Å; D337-R341 PolarHBondContact O-N 2.71Å
338	E	86.9	Confident	81.7	Confident	121 Å²	121	77.2 Å²	77.2	57%	0.565	38%	0.38	S	S	*	.	H	α-helix	trans	-61.9	-42.9	174.5	-76.7	-174.7	174.1	0	0	112	E334 F340 R341 Y342	E334-E338 WeakPolarHBondContact O-CB 3.43Å; E334-E338 WeakPolarHBondContact O-CG 3.47Å; E334-E338 PolarHBondContact O-N 2.89Å; E338-F340 PolarHBondContact O-N 2.86Å; E338-R341 WeakPolarHBondContact O-CB 3.38Å; E338-R341 PolarHBondContact O-N 3.04Å; E338-Y342 WeakPolarHBondContact O-CD2 3.36Å
339	A	85.9	Confident	80.9	Confident	69 Å²	69	79.5 Å²	79.5	57%	0.57	39%	0.388	S	S	*	.	H	α-helix	trans	-61.1	-45.1	176	0	0	0	0	0	111.4	K335 E336 R341 V343	K335-A339 WeakPolarHBondContact O-CB 3.46Å; K335-A339 PolarHBondContact O-N 3.42Å; E336-A339 PolarHBondContact O-N 3.45Å; A339-R341 VanDerWaalsContact C-N 3.34Å; A339-R341 PolarHBondContact O-N 3.18Å; A339-V343 WeakPolarHBondContact O-CG2 3.41Å
340	F	86.1	Confident	80.3	Confident	9 Å²	9	80.8 Å²	80.8	4%	0.039	40%	0.403	C	S	.	.	H	α-helix	trans	-71.2	-27.2	-179.3	-173.5	-101.5	0	0	0	113.5	R273 L293 R294 F297 E336 D337 E338 Y342 V343 I345 Y373	R273-F340 HydrophobicContact CG-CE1 4.02Å; R273-F340 PolarHBondContact NH1-O 3.15Å; L293-F340 HydrophobicContact CB-CD1 4.39Å; L293-F340 HydrophobicContact CD2-CD1 3.85Å; L293-F340 HydrophobicContact CG-CD1 3.74Å; L293-F340 HydrophobicContact CG-CE1 4.27Å; R294-F340 HydrophobicContact CB-CD2 4.44Å; R294-F340 HydrophobicContact CB-CG 4.5Å; R294-F340 HydrophobicContact CG-CE2 4.43Å; F297-F340 HydrophobicContact CB-CE1 3.94Å; F297-F340 HydrophobicContact CB-CZ 4.21Å; F297-F340 HydrophobicContact CD1-CE1 4.21Å; F297-F340 AromaticContact CD1-CZ 3.74Å; F297-F340 HydrophobicContact CD1-CZ 3.74Å; F297-F340 HydrophobicContact CE1-CZ 4.28Å; F297-F340 HydrophobicContact CG-CE1 4.01Å; F297-F340 HydrophobicContact CG-CZ 4.02Å; E336-F340 PolarHBondContact O-N 2.9Å; D337-F340 PolarHBondContact O-N 2.96Å; E338-F340 PolarHBondContact O-N 2.86Å; F340-Y342 VanDerWaalsContact C-N 3.27Å; F340-Y342 PolarHBondContact O-N 3.35Å; F340-V343 PolarHBondContact O-N 3.28Å; F340-I345 HydrophobicContact CE2-CD1 3.99Å; F340-I345 HydrophobicContact CZ-CD1 3.71Å; F340-Y373 AromaticContact CD2-CD1 3.92Å; F340-Y373 HydrophobicContact CD2-CD1 3.92Å; F340-Y373 AromaticContact CD2-CE1 3.65Å; F340-Y373 HydrophobicContact CD2-CE1 3.65Å; F340-Y373 AromaticContact CE2-CD1 3.44Å; F340-Y373 HydrophobicContact CE2-CD1 3.44Å; F340-Y373 VanDerWaalsContact CE2-CD1 3.44Å; F340-Y373 AromaticContact CE2-CE1 3.7Å; F340-Y373 HydrophobicContact CE2-CE1 3.7Å; F340-Y373 HydrophobicContact CE2-CG 4.17Å
341	R	83.5	Confident	79.5	Confident	92 Å²	92	80.9 Å²	80.9	35%	0.347	41%	0.407	S	S	.	.	H	α-helix	trans	-57.1	-37.5	-178.8	-171.4	176.8	-177.3	178.7	5.5	113.2	R273 H277 L293 D337 E338 A339	R273-R341 PolarHBondContact NH1-O 3.25Å; R273-R341 VanDerWaalsContact NH1-O 3.15Å; H277-R341 PolarHBondContact NE2-NH1 3.1Å; L293-R341 HydrophobicContact CD2-CB 4.44Å; D337-R341 WeakPolarHBondContact O-CB 3.49Å; D337-R341 PolarHBondContact O-N 2.71Å; E338-R341 WeakPolarHBondContact O-CB 3.38Å; E338-R341 PolarHBondContact O-N 3.04Å; A339-R341 VanDerWaalsContact C-N 3.34Å; A339-R341 PolarHBondContact O-N 3.18Å
342	Y	80	Confident	78.4	Confident	180 Å²	180	74.7 Å²	74.7	71%	0.706	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-1.6	-173.7	-60.8	-73	0	0	0	114.7	E338 F340 H344	E338-Y342 WeakPolarHBondContact O-CD2 3.36Å; F340-Y342 VanDerWaalsContact C-N 3.27Å; F340-Y342 PolarHBondContact O-N 3.35Å; Y342-H344 PolarHBondContact O-N 3.38Å
343	V	81.4	Confident	77.3	Confident	30 Å²	30	80 Å²	80	18%	0.182	39%	0.392	C	S	.	.			trans	-61	137.9	177.6	173.9	0	0	0	0	110.4	R273 A339 F340 I345 Y373	R273-V343 PolarHBondContact NH1-O 3.39Å; R273-V343 PolarHBondContact NH2-O 3.46Å; A339-V343 WeakPolarHBondContact O-CG2 3.41Å; F340-V343 PolarHBondContact O-N 3.28Å; V343-I345 HydrophobicContact CG1-CG1 3.86Å; V343-Y373 HydrophobicContact CB-CE2 4.39Å; V343-Y373 HydrophobicContact CG1-CD2 3.37Å; V343-Y373 HydrophobicContact CG1-CE2 3.49Å; V343-Y373 VanDerWaalsContact CG1-CE2 3.49Å; V343-Y373 HydrophobicContact CG1-CG 4.08Å; V343-Y373 HydrophobicContact CG2-CE2 4.01Å
344	H	77.1	Confident	76.2	Confident	157 Å²	157	83.4 Å²	83.4	73%	0.727	41%	0.414	S	S	*	.			trans	-88.7	114.6	171	177.9	-88.6	0	0	0	110.1	Y342	Y342-H344 PolarHBondContact O-N 3.38Å
345	I	77.1	Confident	75.6	Confident	11 Å²	11	83.2 Å²	83.2	6%	0.056	41%	0.412	C	S	.	.			trans	-108.6	112.1	-179	-49	174.1	0	0	0	109.8	L269 F297 F340 V343 I377	L269-I345 HydrophobicContact CD1-CG2 4.36Å; F297-I345 HydrophobicContact CE1-CD1 3.91Å; F297-I345 HydrophobicContact CZ-CD1 4.03Å; F340-I345 HydrophobicContact CE2-CD1 3.99Å; F340-I345 HydrophobicContact CZ-CD1 3.71Å; V343-I345 HydrophobicContact CG1-CG1 3.86Å; I345-I377 HydrophobicContact CG2-CD1 3.37Å
346	P	73.4	Confident	75.1	Confident	23 Å²	23	79.8 Å²	79.8	15%	0.149	40%	0.402	C	S	.	.			trans	-69.7	133.3	177.9	28.2	-32.2	0	0	0	110.7	Y374	P346-Y374 HydrophobicContact CG-CD1 4.22Å
347	R	70.1	Confident	74.8	Confident	55 Å²	55	81.5 Å²	81.5	21%	0.208	40%	0.403	C	S	.	.	S	Bend	trans	-74.9	-45	179.3	-179.7	63.4	-174.9	107.2	-12.1	113.3	H263 L269	H263-R347 PolarHBondContact O-NE 3.44Å; L269-R347 HydrophobicContact CD1-CB 3.82Å; L269-R347 HydrophobicContact CD1-CG 4.34Å; L269-R347 HydrophobicContact CG-CB 4.42Å
348	N	68.4	Low	74.3	Confident	83 Å²	83	82.9 Å²	82.9	44%	0.444	41%	0.411	S	S	.	.	S	Bend	trans	-107.3	135.6	-177.8	-67.9	-12	0	0	0	109	S350 V351 S352	N348-S350 WeakPolarHBondContact CB-OG 3.33Å; N348-S350 PolarHBondContact O-N 3.35Å; N348-V351 HydrophobicContact CB-CG2 4.35Å; N348-V351 PolarHBondContact O-N 2.96Å; N348-S352 PolarHBondContact O-N 3.04Å
349	L	68.5	Low	73.9	Confident	69 Å²	69	80 Å²	80	36%	0.361	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-13.7	175.9	-144.2	70.1	0	0	0	112.6	V351 S352 Y374 T378	L349-V351 VanDerWaalsContact C-N 3.31Å; L349-S352 VanDerWaalsContact C-OG 3.32Å; L349-S352 VanDerWaalsContact CA-OG 3.26Å; L349-S352 WeakPolarHBondContact CA-OG 3.19Å; L349-S352 PolarHBondContact O-OG 3.09Å; L349-Y374 HydrophobicContact CD1-CD2 3.7Å; L349-Y374 HydrophobicContact CD1-CE2 3.82Å; L349-T378 HydrophobicContact CD1-CG2 4.18Å
350	S	68.1	Low	73.8	Confident	106 Å²	106	80 Å²	80	74%	0.741	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-24.8	170.9	61	0	0	0	0	113.6	N348	N348-S350 WeakPolarHBondContact CB-OG 3.33Å; N348-S350 PolarHBondContact O-N 3.35Å
351	V	65.6	Low	73.6	Confident	91 Å²	91	82.2 Å²	82.2	55%	0.552	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-28	179.7	-176.3	0	0	0	0	110.8	N348 L349 Y353	N348-V351 HydrophobicContact CB-CG2 4.35Å; N348-V351 PolarHBondContact O-N 2.96Å; L349-V351 VanDerWaalsContact C-N 3.31Å; V351-Y353 PolarHBondContact O-N 2.92Å
352	S	59.6	Low	73.6	Confident	14 Å²	14	78.8 Å²	78.8	10%	0.098	38%	0.384	C	S	.	.	S	Bend	trans	-64	109	169.4	55.4	0	0	0	0	108.8	N348 L349	N348-S352 PolarHBondContact O-N 3.04Å; L349-S352 VanDerWaalsContact C-OG 3.32Å; L349-S352 VanDerWaalsContact CA-OG 3.26Å; L349-S352 WeakPolarHBondContact CA-OG 3.19Å; L349-S352 PolarHBondContact O-OG 3.09Å
353	Y	61	Low	73.7	Confident	196 Å²	196	76.4 Å²	76.4	77%	0.769	38%	0.38	S	S	*	.	S	Bend	trans	-37.7	140.4	160.1	-92.4	-94.8	0	0	0	109.9	V351 F355	V351-Y353 PolarHBondContact O-N 2.92Å; Y353-F355 PolarHBondContact O-N 3.31Å; Y353-F355 VanDerWaalsContact O-N 3.14Å
354	P	62.8	Low	73.9	Confident	74 Å²	74	83.2 Å²	83.2	48%	0.481	40%	0.402	S	S	.	.			trans	-49.8	118.1	-143.4	17.2	-30.6	0	0	0	110.9	V356 R357	P354-V356 HydrophobicContact CB-CB 4.35Å; P354-V356 HydrophobicContact CB-CG2 4.45Å; P354-V356 CarbonylContact O-C 3.57Å; P354-V356 PolarHBondContact O-N 2.83Å; P354-R357 VanDerWaalsContact O-CB 3.32Å; P354-R357 WeakPolarHBondContact O-CB 3.08Å; P354-R357 PolarHBondContact O-N 2.84Å
355	F	71.6	Confident	74.1	Confident	111 Å²	111	79 Å²	79	49%	0.487	40%	0.401	S	S	.	.	H	α-helix	trans	-35.4	-32.1	169.8	64.8	-83.5	0	0	0	113.6	Y353 R357 D358 F359	Y353-F355 PolarHBondContact O-N 3.31Å; Y353-F355 VanDerWaalsContact O-N 3.14Å; F355-R357 VanDerWaalsContact C-N 3.3Å; F355-R357 PolarHBondContact O-N 3.33Å; F355-D358 PolarHBondContact O-N 3.47Å; F355-F359 WeakPolarHBondContact O-CB 3.4Å; F355-F359 PolarHBondContact O-N 2.92Å
356	V	76	Confident	74.2	Confident	64 Å²	64	84.9 Å²	84.9	39%	0.388	43%	0.428	S	S	.	.	H	α-helix	trans	-52.4	-42.8	172.2	-174.9	0	0	0	0	112.6	P354 L360	P354-V356 HydrophobicContact CB-CB 4.35Å; P354-V356 HydrophobicContact CB-CG2 4.45Å; P354-V356 CarbonylContact O-C 3.57Å; P354-V356 PolarHBondContact O-N 2.83Å; V356-L360 HydrophobicContact CG1-CD1 4.03Å; V356-L360 HydrophobicContact CG1-CG 4.39Å; V356-L360 WeakPolarHBondContact O-CB 3.29Å; V356-L360 WeakPolarHBondContact O-CG 3.32Å; V356-L360 PolarHBondContact O-N 2.67Å
357	R	79.6	Confident	74.4	Confident	152 Å²	152	85.6 Å²	85.6	57%	0.574	43%	0.431	S	S	*	.	H	α-helix	trans	-62.2	-47.3	178.9	-177.4	-175.5	-178.4	-172.7	-0.8	111.1	P354 F355 L360 K361	P354-R357 VanDerWaalsContact O-CB 3.32Å; P354-R357 WeakPolarHBondContact O-CB 3.08Å; P354-R357 PolarHBondContact O-N 2.84Å; F355-R357 VanDerWaalsContact C-N 3.3Å; F355-R357 PolarHBondContact O-N 3.33Å; R357-L360 PolarHBondContact O-N 3.21Å; R357-K361 WeakPolarHBondContact O-CG 3.44Å; R357-K361 PolarHBondContact O-N 3.15Å
358	D	78	Confident	74.7	Confident	34 Å²	34	85.7 Å²	85.7	18%	0.182	44%	0.44	C	S	.	.	H	α-helix	trans	-71.4	-39.8	-178.1	-68.1	-19.7	0	0	0	110.2	F355 L360 K361 I362 L367	F355-D358 PolarHBondContact O-N 3.47Å; D358-L360 PolarHBondContact O-N 3.01Å; D358-K361 WeakPolarHBondContact O-CB 3.07Å; D358-K361 PolarHBondContact O-N 2.58Å; D358-K361 VanDerWaalsContact O-N 3.1Å; D358-K361 IonicContact OD1-NZ 3.43Å; D358-K361 PolarHBondContact OD1-NZ 3.27Å; D358-I362 WeakPolarHBondContact O-CG1 3.18Å; D358-I362 PolarHBondContact O-N 2.75Å; D358-L367 HydrophobicContact CB-CD2 4.13Å
359	F	78.4	Confident	74.9	Confident	61 Å²	61	85.8 Å²	85.8	27%	0.268	44%	0.437	S	S	.	.	H	α-helix	trans	-54.9	-47.3	169.4	179.2	-105.8	0	0	0	113	F355 K361 I362 Q363 L384 T385	F355-F359 WeakPolarHBondContact O-CB 3.4Å; F355-F359 PolarHBondContact O-N 2.92Å; F359-K361 VanDerWaalsContact C-N 3.3Å; F359-K361 PolarHBondContact O-N 3.25Å; F359-I362 WeakPolarHBondContact O-CB 3.45Å; F359-I362 PolarHBondContact O-N 3.43Å; F359-Q363 HydrophobicContact CE1-CG 4.32Å; F359-Q363 VanDerWaalsContact CE1-NE2 3.29Å; F359-Q363 HydrophobicContact CZ-CG 4.31Å; F359-Q363 PolarHBondContact O-N 2.8Å; F359-L384 HydrophobicContact CB-CD1 4.09Å; F359-L384 HydrophobicContact CD2-CB 4.07Å; F359-T385 HydrophobicContact CE2-CG2 4.43Å
360	L	82.9	Confident	75	Confident	68 Å²	68	84.8 Å²	84.8	36%	0.356	44%	0.436	S	S	.	.	H	α-helix	trans	-64.8	-32.6	177	-73.3	172.6	0	0	0	112.6	V356 R357 D358 R364	V356-L360 HydrophobicContact CG1-CD1 4.03Å; V356-L360 HydrophobicContact CG1-CG 4.39Å; V356-L360 WeakPolarHBondContact O-CB 3.29Å; V356-L360 WeakPolarHBondContact O-CG 3.32Å; V356-L360 PolarHBondContact O-N 2.67Å; R357-L360 PolarHBondContact O-N 3.21Å; D358-L360 PolarHBondContact O-N 3.01Å; L360-R364 WeakPolarHBondContact O-CB 3.22Å; L360-R364 WeakPolarHBondContact O-CD 3.49Å; L360-R364 WeakPolarHBondContact O-CG 3.42Å; L360-R364 PolarHBondContact O-N 3.39Å; L360-R364 VanDerWaalsContact O-N 3.12Å
361	K	83.4	Confident	75.2	Confident	55 Å²	55	83 Å²	83	24%	0.239	42%	0.418	C	S	.	.	H	α-helix	trans	-69.5	-39.2	174.9	-73.6	173.5	-178.1	169.4	0	112.1	R357 D358 F359 R364 G365 Q366 L367	R357-K361 WeakPolarHBondContact O-CG 3.44Å; R357-K361 PolarHBondContact O-N 3.15Å; D358-K361 WeakPolarHBondContact O-CB 3.07Å; D358-K361 PolarHBondContact O-N 2.58Å; D358-K361 VanDerWaalsContact O-N 3.1Å; D358-K361 IonicContact OD1-NZ 3.43Å; D358-K361 PolarHBondContact OD1-NZ 3.27Å; F359-K361 VanDerWaalsContact C-N 3.3Å; F359-K361 PolarHBondContact O-N 3.25Å; K361-R364 CarbonylContact O-C 3.56Å; K361-R364 PolarHBondContact O-N 3.45Å; K361-G365 PolarHBondContact O-N 3.3Å; K361-Q366 HydrophobicContact CB-CB 4.23Å; K361-Q366 PolarHBondContact O-N 3.4Å; K361-L367 HydrophobicContact CB-CB 3.79Å; K361-L367 HydrophobicContact CB-CD2 4.48Å
362	I	82.2	Confident	75.7	Confident	21 Å²	21	79 Å²	79	11%	0.108	39%	0.394	C	S	.	.	H	α-helix	trans	-59.1	-49.8	173.5	-61	162.7	0	0	0	109.6	D358 F359 R364 G365 H369 I372 L384	D358-I362 WeakPolarHBondContact O-CG1 3.18Å; D358-I362 PolarHBondContact O-N 2.75Å; F359-I362 WeakPolarHBondContact O-CB 3.45Å; F359-I362 PolarHBondContact O-N 3.43Å; I362-R364 PolarHBondContact O-N 3.3Å; I362-G365 PolarHBondContact O-N 3.06Å; I362-H369 WeakPolarHBondContact CG2-NE2 3.47Å; I362-I372 HydrophobicContact CD1-CD1 3.09Å; I362-I372 HydrophobicContact CG1-CD1 3.52Å; I362-L384 HydrophobicContact CD1-CD1 3.74Å; I362-L384 HydrophobicContact CD1-CG 4.02Å
363	Q	82.2	Confident	76.5	Confident	130 Å²	130	81.1 Å²	81.1	61%	0.607	40%	0.4	S	S	*	.	H	α-helix	trans	-60.4	-30	179.3	-72.2	-168.4	-25.7	0	0	113.1	F359 G365	F359-Q363 HydrophobicContact CE1-CG 4.32Å; F359-Q363 VanDerWaalsContact CE1-NE2 3.29Å; F359-Q363 HydrophobicContact CZ-CG 4.31Å; F359-Q363 PolarHBondContact O-N 2.8Å; Q363-G365 VanDerWaalsContact C-N 3.31Å
364	R	85.9	Confident	77.3	Confident	173 Å²	173	72.5 Å²	72.5	65%	0.653	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-0.8	175.3	-69.1	170.8	-177.5	-178.5	0	113.7	L360 K361 I362 Q366	L360-R364 WeakPolarHBondContact O-CB 3.22Å; L360-R364 WeakPolarHBondContact O-CD 3.49Å; L360-R364 WeakPolarHBondContact O-CG 3.42Å; L360-R364 PolarHBondContact O-N 3.39Å; L360-R364 VanDerWaalsContact O-N 3.12Å; K361-R364 CarbonylContact O-C 3.56Å; K361-R364 PolarHBondContact O-N 3.45Å; I362-R364 PolarHBondContact O-N 3.3Å; R364-Q366 HydrophobicContact CB-CG 3.95Å; R364-Q366 PolarHBondContact O-N 3.47Å
365	G	81.2	Confident	78	Confident	68 Å²	68	69.3 Å²	69.3	70%	0.701	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	16.1	-174.4	0	0	0	0	0	114.4	K361 I362 Q363	K361-G365 PolarHBondContact O-N 3.3Å; I362-G365 PolarHBondContact O-N 3.06Å; Q363-G365 VanDerWaalsContact C-N 3.31Å
366	Q	79.9	Confident	78.2	Confident	134 Å²	134	64.8 Å²	64.8	63%	0.626	33%	0.329	S	S	*	.	S	Bend	trans	-87.6	-12.8	-177.8	-67.4	-176.9	-35.3	0	0	113.5	K361 R364	K361-Q366 HydrophobicContact CB-CB 4.23Å; K361-Q366 PolarHBondContact O-N 3.4Å; R364-Q366 HydrophobicContact CB-CG 3.95Å; R364-Q366 PolarHBondContact O-N 3.47Å
367	L	76.4	Confident	78.2	Confident	39 Å²	39	62.1 Å²	62.1	20%	0.204	31%	0.312	C	S	.	.	S	Bend	trans	-137.9	128.4	-179.1	-169.2	69.8	0	0	0	107.9	D358 K361 D371 I372	D358-L367 HydrophobicContact CB-CD2 4.13Å; K361-L367 HydrophobicContact CB-CB 3.79Å; K361-L367 HydrophobicContact CB-CD2 4.48Å; L367-D371 HydrophobicContact CD1-CB 3.77Å; L367-D371 HydrophobicContact CG-CB 4.21Å; L367-I372 HydrophobicContact CD2-CD1 3.91Å; L367-I372 HydrophobicContact CD2-CG1 3.76Å; L367-I372 HydrophobicContact CG-CG1 4.35Å
368	S	76.4	Confident	78	Confident	57 Å²	57	57.1 Å²	57.1	40%	0.399	30%	0.299	S	S	.	.			trans	-74.8	148.7	175.2	-179.3	0	0	0	0	110	S370 D371	S368-S370 VanDerWaalsContact CB-OG 3.26Å; S368-S370 WeakPolarHBondContact CB-OG 3.38Å; S368-S370 PolarHBondContact O-N 2.7Å; S368-S370 VanDerWaalsContact O-N 3.15Å; S368-S370 PolarHBondContact OG-N 3.38Å; S368-S370 PolarHBondContact OG-OG 3.26Å; S368-D371 WeakPolarHBondContact CB-OD2 3.31Å; S368-D371 PolarHBondContact N-OD2 2.79Å; S368-D371 WeakPolarHBondContact O-CB 3.32Å; S368-D371 PolarHBondContact O-N 3.49Å
369	H	72.8	Confident	77.8	Confident	85 Å²	85	55.7 Å²	55.7	39%	0.394	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-52.9	-32.2	169.9	-64.7	92.4	0	0	0	111.9	I362 D371 P382 D383	I362-H369 WeakPolarHBondContact CG2-NE2 3.47Å; H369-D371 PolarHBondContact O-N 3.24Å; H369-P382 HydrophobicContact CB-CB 3.98Å; H369-D383 IonicContact CD2-OD1 3.1Å; H369-D383 PolarHBondContact CD2-OD1 3.36Å; H369-D383 IonicContact NE2-OD1 3.23Å; H369-D383 PolarHBondContact NE2-OD1 3.12Å
370	S	70.3	Confident	77.7	Confident	47 Å²	47	54.5 Å²	54.5	33%	0.329	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-65.9	-22.4	177.6	56.9	0	0	0	0	114	R294 S368 I372	R294-S370 VanDerWaalsContact CZ-O 3.27Å; R294-S370 PolarHBondContact NH1-O 3.49Å; R294-S370 PolarHBondContact NH2-O 2.81Å; S368-S370 VanDerWaalsContact CB-OG 3.26Å; S368-S370 WeakPolarHBondContact CB-OG 3.38Å; S368-S370 PolarHBondContact O-N 2.7Å; S368-S370 VanDerWaalsContact O-N 3.15Å; S368-S370 PolarHBondContact OG-N 3.38Å; S368-S370 PolarHBondContact OG-OG 3.26Å; S370-I372 VanDerWaalsContact C-N 3.33Å
371	D	73.3	Confident	77.4	Confident	70 Å²	70	55.5 Å²	55.5	37%	0.374	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-90.5	-2.4	-170.9	-55	-23.1	0	0	0	112.3	L367 S368 H369 Y373	L367-D371 HydrophobicContact CD1-CB 3.77Å; L367-D371 HydrophobicContact CG-CB 4.21Å; S368-D371 WeakPolarHBondContact CB-OD2 3.31Å; S368-D371 PolarHBondContact N-OD2 2.79Å; S368-D371 WeakPolarHBondContact O-CB 3.32Å; S368-D371 PolarHBondContact O-N 3.49Å; H369-D371 PolarHBondContact O-N 3.24Å; D371-Y373 WeakPolarHBondContact O-CD2 3.4Å; D371-Y373 VanDerWaalsContact O-CE2 3.25Å; D371-Y373 WeakPolarHBondContact O-CE2 3.49Å; D371-Y373 PolarHBondContact O-N 3.06Å
372	I	76.8	Confident	76.8	Confident	6 Å²	6	55 Å²	55	3%	0.031	29%	0.292	C	S	.	.			trans	-98.3	77.9	-176.7	-53.5	-177.6	0	0	0	110.1	I362 L367 S370 Y374 A375 L384	I362-I372 HydrophobicContact CD1-CD1 3.09Å; I362-I372 HydrophobicContact CG1-CD1 3.52Å; L367-I372 HydrophobicContact CD2-CD1 3.91Å; L367-I372 HydrophobicContact CD2-CG1 3.76Å; L367-I372 HydrophobicContact CG-CG1 4.35Å; S370-I372 VanDerWaalsContact C-N 3.33Å; I372-Y374 VanDerWaalsContact C-N 3.27Å; I372-Y374 HydrophobicContact CG2-CD1 3.97Å; I372-Y374 HydrophobicContact CG2-CD2 4.16Å; I372-Y374 HydrophobicContact CG2-CE1 3.55Å; I372-Y374 HydrophobicContact CG2-CE2 3.73Å; I372-Y374 HydrophobicContact CG2-CG 4.26Å; I372-Y374 PolarHBondContact O-N 3.19Å; I372-A375 HydrophobicContact CG2-CB 4.09Å; I372-A375 WeakPolarHBondContact O-CB 3.42Å; I372-A375 PolarHBondContact O-N 2.87Å; I372-L384 HydrophobicContact CD1-CD1 4.11Å; I372-L384 HydrophobicContact CD1-CG 4.41Å; I372-L384 HydrophobicContact CG2-CD2 4.2Å
373	Y	75.5	Confident	76.2	Confident	59 Å²	59	57.5 Å²	57.5	23%	0.231	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-25.3	-173.4	-55	-70	0	0	0	114.5	F340 V343 D371 A375	F340-Y373 AromaticContact CD2-CD1 3.92Å; F340-Y373 HydrophobicContact CD2-CD1 3.92Å; F340-Y373 AromaticContact CD2-CE1 3.65Å; F340-Y373 HydrophobicContact CD2-CE1 3.65Å; F340-Y373 AromaticContact CE2-CD1 3.44Å; F340-Y373 HydrophobicContact CE2-CD1 3.44Å; F340-Y373 VanDerWaalsContact CE2-CD1 3.44Å; F340-Y373 AromaticContact CE2-CE1 3.7Å; F340-Y373 HydrophobicContact CE2-CE1 3.7Å; F340-Y373 HydrophobicContact CE2-CG 4.17Å; V343-Y373 HydrophobicContact CB-CE2 4.39Å; V343-Y373 HydrophobicContact CG1-CD2 3.37Å; V343-Y373 HydrophobicContact CG1-CE2 3.49Å; V343-Y373 VanDerWaalsContact CG1-CE2 3.49Å; V343-Y373 HydrophobicContact CG1-CG 4.08Å; V343-Y373 HydrophobicContact CG2-CE2 4.01Å; D371-Y373 WeakPolarHBondContact O-CD2 3.4Å; D371-Y373 VanDerWaalsContact O-CE2 3.25Å; D371-Y373 WeakPolarHBondContact O-CE2 3.49Å; D371-Y373 PolarHBondContact O-N 3.06Å; Y373-A375 VanDerWaalsContact C-N 3.28Å; Y373-A375 PolarHBondContact O-N 3.14Å
374	Y	77.7	Confident	75.6	Confident	15 Å²	15	52.6 Å²	52.6	6%	0.059	28%	0.283	C	S	.	.	H	α-helix	trans	-76.2	-14.3	179.2	64.2	-101.8	0	0	0	113.1	P346 L349 I372 I377 T378 L384	P346-Y374 HydrophobicContact CG-CD1 4.22Å; L349-Y374 HydrophobicContact CD1-CD2 3.7Å; L349-Y374 HydrophobicContact CD1-CE2 3.82Å; I372-Y374 VanDerWaalsContact C-N 3.27Å; I372-Y374 HydrophobicContact CG2-CD1 3.97Å; I372-Y374 HydrophobicContact CG2-CD2 4.16Å; I372-Y374 HydrophobicContact CG2-CE1 3.55Å; I372-Y374 HydrophobicContact CG2-CE2 3.73Å; I372-Y374 HydrophobicContact CG2-CG 4.26Å; I372-Y374 PolarHBondContact O-N 3.19Å; Y374-I377 WeakPolarHBondContact O-CB 3.47Å; Y374-I377 PolarHBondContact O-N 3.34Å; Y374-T378 PolarHBondContact O-N 3.07Å; Y374-T378 VanDerWaalsContact O-N 3.08Å; Y374-T378 PolarHBondContact O-OG1 3.45Å; Y374-T378 VanDerWaalsContact O-OG1 3.06Å; Y374-L384 HydrophobicContact CE2-CD2 3.92Å
375	A	76.8	Confident	75.1	Confident	7 Å²	7	48.9 Å²	48.9	6%	0.058	28%	0.28	C	S	.	.	H	α-helix	trans	-60.6	-49.2	-179.7	0	0	0	0	0	111.1	I372 Y373 I377 T378 G379 L380 L384	I372-A375 HydrophobicContact CG2-CB 4.09Å; I372-A375 WeakPolarHBondContact O-CB 3.42Å; I372-A375 PolarHBondContact O-N 2.87Å; Y373-A375 VanDerWaalsContact C-N 3.28Å; Y373-A375 PolarHBondContact O-N 3.14Å; A375-I377 PolarHBondContact O-N 2.88Å; A375-T378 PolarHBondContact O-N 3.33Å; A375-T378 VanDerWaalsContact O-N 3.14Å; A375-T378 PolarHBondContact O-OG1 2.91Å; A375-G379 PolarHBondContact O-N 3.13Å; A375-L380 PolarHBondContact O-N 2.97Å; A375-L380 VanDerWaalsContact O-N 3.1Å; A375-L384 HydrophobicContact CB-CD2 4.49Å
376	A	75.8	Confident	74.7	Confident	16 Å²	16	46.9 Å²	46.9	13%	0.132	26%	0.259	C	S	.	.	H	α-helix	trans	-57.9	-34.8	176.4	0	0	0	0	0	112.7	E298	E298-A376 HydrophobicContact CB-CB 4.45Å; E298-A376 HydrophobicContact CG-CB 3.85Å
377	I	76.8	Confident	74.2	Confident	7 Å²	7	44.9 Å²	44.9	4%	0.036	26%	0.257	C	S	.	.	H	α-helix	trans	-70.3	-40	179.9	-57.2	-172.6	0	0	0	111.9	L269 F297 V301 I345 Y374 A375	L269-I377 HydrophobicContact CD1-CD1 3.43Å; L269-I377 VanDerWaalsContact CD1-CD1 3.43Å; L269-I377 HydrophobicContact CD2-CD1 4.17Å; L269-I377 HydrophobicContact CG-CD1 4.42Å; F297-I377 HydrophobicContact CE1-CD1 4.07Å; F297-I377 HydrophobicContact CE1-CG1 4.25Å; F297-I377 HydrophobicContact CZ-CD1 4.09Å; V301-I377 HydrophobicContact CG1-CB 3.99Å; V301-I377 HydrophobicContact CG1-CG1 3.79Å; V301-I377 HydrophobicContact CG1-CG2 3.86Å; I345-I377 HydrophobicContact CG2-CD1 3.37Å; Y374-I377 WeakPolarHBondContact O-CB 3.47Å; Y374-I377 PolarHBondContact O-N 3.34Å; A375-I377 PolarHBondContact O-N 2.88Å
378	T	74.5	Confident	73.9	Confident	48 Å²	48	44.9 Å²	44.9	29%	0.294	26%	0.256	S	S	.	.	H	α-helix	trans	-85	-11.2	-178.8	53.9	0	0	0	0	113.9	L349 Y374 A375 L380	L349-T378 HydrophobicContact CD1-CG2 4.18Å; Y374-T378 PolarHBondContact O-N 3.07Å; Y374-T378 VanDerWaalsContact O-N 3.08Å; Y374-T378 PolarHBondContact O-OG1 3.45Å; Y374-T378 VanDerWaalsContact O-OG1 3.06Å; A375-T378 PolarHBondContact O-N 3.33Å; A375-T378 VanDerWaalsContact O-N 3.14Å; A375-T378 PolarHBondContact O-OG1 2.91Å; T378-L380 PolarHBondContact O-N 3.26Å; T378-L380 WeakPolarHBondContact OG1-CD1 3.41Å; T378-L380 VanDerWaalsContact OG1-CG 3.25Å; T378-L380 WeakPolarHBondContact OG1-CG 3.39Å
379	G	74.6	Confident	73.4	Confident	3 Å²	3	49.5 Å²	49.5	3%	0.031	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	21.6	-171	0	0	0	0	0	113.2	A375 T387 I388	A375-G379 PolarHBondContact O-N 3.13Å; G379-T387 WeakPolarHBondContact O-CA 3.27Å; G379-I388 PolarHBondContact O-N 3.3Å
380	L	77	Confident	72.8	Confident	36 Å²	36	50.8 Å²	50.8	19%	0.188	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-79.3	150	173.5	-70.2	174.4	0	0	0	110.1	A375 T378 L384 G386 T387 I388	A375-L380 PolarHBondContact O-N 2.97Å; A375-L380 VanDerWaalsContact O-N 3.1Å; T378-L380 PolarHBondContact O-N 3.26Å; T378-L380 WeakPolarHBondContact OG1-CD1 3.41Å; T378-L380 VanDerWaalsContact OG1-CG 3.25Å; T378-L380 WeakPolarHBondContact OG1-CG 3.39Å; L380-L384 HydrophobicContact CB-CD2 4.43Å; L380-L384 HydrophobicContact CD1-CD2 4.03Å; L380-G386 WeakPolarHBondContact CA-O 3.46Å; L380-G386 WeakPolarHBondContact CD2-O 2.99Å; L380-T387 HydrophobicContact CD2-CG2 4.27Å; L380-I388 WeakPolarHBondContact O-CD1 3.47Å
381	K	75.2	Confident	72.3	Confident	89 Å²	89	49.2 Å²	49.2	39%	0.387	27%	0.27	S	S	.	.			trans	-59.9	149.9	166.7	-70.4	-179.7	-178.4	-178.9	0	109.5	D383 L384 G386 I388	K381-D383 PolarHBondContact O-N 2.86Å; K381-D383 VanDerWaalsContact O-N 3.12Å; K381-L384 WeakPolarHBondContact O-CA 3.45Å; K381-L384 PolarHBondContact O-N 3.11Å; K381-G386 PolarHBondContact N-O 3.09Å; K381-I388 HydrophobicContact CB-CG1 4.34Å; K381-I388 HydrophobicContact CG-CG1 3.65Å
382	P	71.1	Confident	71.6	Confident	46 Å²	46	52.7 Å²	52.7	30%	0.299	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-34.6	175.4	16.1	-28.2	0	0	0	112.7	H369 L384	H369-P382 HydrophobicContact CB-CB 3.98Å; P382-L384 PolarHBondContact O-N 3.32Å
383	D	69.6	Low	70.6	Confident	72 Å²	72	54.5 Å²	54.5	39%	0.385	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-0.9	-179.8	-45.7	-5	0	0	0	113.6	H369 K381 T385	H369-D383 IonicContact CD2-OD1 3.1Å; H369-D383 PolarHBondContact CD2-OD1 3.36Å; H369-D383 IonicContact NE2-OD1 3.23Å; H369-D383 PolarHBondContact NE2-OD1 3.12Å; K381-D383 PolarHBondContact O-N 2.86Å; K381-D383 VanDerWaalsContact O-N 3.12Å; D383-T385 HydrophobicContact CB-CG2 4.2Å; D383-T385 PolarHBondContact O-N 3.43Å
384	L	70.9	Confident	69.2	Low	27 Å²	27	55.8 Å²	55.8	14%	0.141	30%	0.303	C	S	.	.	S	Bend	trans	57	12	-175.1	-55.1	175.2	0	0	0	115.2	F359 I362 I372 Y374 A375 L380 K381 P382 G386	F359-L384 HydrophobicContact CB-CD1 4.09Å; F359-L384 HydrophobicContact CD2-CB 4.07Å; I362-L384 HydrophobicContact CD1-CD1 3.74Å; I362-L384 HydrophobicContact CD1-CG 4.02Å; I372-L384 HydrophobicContact CD1-CD1 4.11Å; I372-L384 HydrophobicContact CD1-CG 4.41Å; I372-L384 HydrophobicContact CG2-CD2 4.2Å; Y374-L384 HydrophobicContact CE2-CD2 3.92Å; A375-L384 HydrophobicContact CB-CD2 4.49Å; L380-L384 HydrophobicContact CB-CD2 4.43Å; L380-L384 HydrophobicContact CD1-CD2 4.03Å; K381-L384 WeakPolarHBondContact O-CA 3.45Å; K381-L384 PolarHBondContact O-N 3.11Å; P382-L384 PolarHBondContact O-N 3.32Å; L384-G386 VanDerWaalsContact C-N 3.29Å; L384-G386 PolarHBondContact O-N 3.35Å
385	T	73.8	Confident	67.9	Low	95 Å²	95	60.1 Å²	60.1	58%	0.583	32%	0.322	S	S	*	.	S	Bend	trans	-74.9	-12.8	-177.7	42.6	0	0	0	0	114.3	F359 D383	F359-T385 HydrophobicContact CE2-CG2 4.43Å; D383-T385 HydrophobicContact CB-CG2 4.2Å; D383-T385 PolarHBondContact O-N 3.43Å
386	G	73.3	Confident	66.1	Low	26 Å²	26	66.8 Å²	66.8	27%	0.268	35%	0.352	S	S	.	.	S	Bend	trans	167.8	-172.2	178.5	0	0	0	0	0	112.8	L380 K381 L384	L380-G386 WeakPolarHBondContact CA-O 3.46Å; L380-G386 WeakPolarHBondContact CD2-O 2.99Å; K381-G386 PolarHBondContact N-O 3.09Å; L384-G386 VanDerWaalsContact C-N 3.29Å; L384-G386 PolarHBondContact O-N 3.35Å
387	T	70.1	Confident	64.3	Low	93 Å²	93	72.4 Å²	72.4	57%	0.571	38%	0.379	S	S	*	.	B	Isolated β-bridge	trans	-80.2	150.6	175.2	50.2	0	0	0	0	111.5	G379 L380 I389	G379-T387 WeakPolarHBondContact O-CA 3.27Å; L380-T387 HydrophobicContact CD2-CG2 4.27Å; T387-I389 PolarHBondContact O-N 3.07Å
388	I	69.8	Low	62.2	Low	38 Å²	38	77.2 Å²	77.2	20%	0.195	41%	0.405	C	S	.	.			trans	-77.9	120	172.7	-62.5	165.5	0	0	0	108	T304 G379 L380 K381 Q390	T304-I388 HydrophobicContact CG2-CB 4.03Å; G379-I388 PolarHBondContact O-N 3.3Å; L380-I388 WeakPolarHBondContact O-CD1 3.47Å; K381-I388 HydrophobicContact CB-CG1 4.34Å; K381-I388 HydrophobicContact CG-CG1 3.65Å; I388-Q390 WeakPolarHBondContact CG2-O 3.21Å
389	I	66.5	Low	60.2	Low	155 Å²	155	82.5 Å²	82.5	80%	0.795	43%	0.427	S	S	*	.	S	Bend	trans	-84	-31.8	179.1	-58.6	172.8	0	0	0	111.2	T387	T387-I389 PolarHBondContact O-N 3.07Å
390	Q	58.8	Low	58	Low	112 Å²	112	88.1 Å²	88.1	52%	0.523	46%	0.464	S	S	.	.	S	Bend	trans	-137.4	134.2	178.3	-76.1	175.4	-15.6	0	0	110.1	I388	I388-Q390 WeakPolarHBondContact CG2-O 3.21Å
391	P	60.1	Low	55.6	Low	14 Å²	14	95.4 Å²	95.4	9%	0.091	50%	0.497	C	S	.	.			trans	-63.2	137.6	177.4	26.5	-32.8	0	0	0	110.5	L305 I393 M394	L305-P391 HydrophobicContact CD2-CB 3.96Å; P391-I393 PolarHBondContact O-N 3.22Å; P391-I393 VanDerWaalsContact O-N 3.17Å; P391-M394 HydrophobicContact CG-CB 4.23Å; P391-M394 HydrophobicContact CG-CG 3.81Å; P391-M394 HydrophobicContact CG-SD 3.68Å; P391-M394 PolarHBondContact O-N 3.18Å
392	Q	58.8	Low	53.3	Low	143 Å²	143	95.7 Å²	95.7	67%	0.668	51%	0.51	S	S	*	.	H	α-helix	trans	-55.7	-34.4	-178.2	-73.7	174.1	-31	0	0	112.3	M394 K395	Q392-M394 PolarHBondContact O-N 3.24Å; Q392-K395 WeakPolarHBondContact O-CB 3.44Å; Q392-K395 PolarHBondContact O-N 2.93Å
393	I	56	Low	51.2	Low	43 Å²	43	99.7 Å²	99.7	22%	0.221	53%	0.529	C	S	.	.	H	α-helix	trans	-62.6	-25.8	-179.7	-56.6	165.3	0	0	0	112.4	L305 C316 L320 P391	L305-I393 HydrophobicContact CD2-CD1 4.25Å; C316-I393 WeakPolarHBondContact SG-CD1 3.14Å; L320-I393 HydrophobicContact CD1-CD1 4.36Å; L320-I393 HydrophobicContact CD2-CD1 4.03Å; L320-I393 HydrophobicContact CG-CD1 4.22Å; P391-I393 PolarHBondContact O-N 3.22Å; P391-I393 VanDerWaalsContact O-N 3.17Å
394	M	46.8	Very low	49.4	Very low	87 Å²	87	103.5 Å²	103.5	43%	0.429	55%	0.549	S	S	.	.	H	α-helix	trans	-85.7	-17.2	175.8	-68.4	-176.8	84.6	0	0	113.2	P391 Q392	P391-M394 HydrophobicContact CG-CB 4.23Å; P391-M394 HydrophobicContact CG-CG 3.81Å; P391-M394 HydrophobicContact CG-SD 3.68Å; P391-M394 PolarHBondContact O-N 3.18Å; Q392-M394 PolarHBondContact O-N 3.24Å
395	K	49.3	Very low	47.5	Very low	106 Å²	106	110.4 Å²	110.4	46%	0.461	58%	0.581	S	S	.	*	H	α-helix	trans	-72.1	-38.6	-178.5	-69.7	-171.2	172.4	-166.3	0	111.8	Q392 N397 N398 E399	Q392-K395 WeakPolarHBondContact O-CB 3.44Å; Q392-K395 PolarHBondContact O-N 2.93Å; K395-N397 PolarHBondContact O-N 3.03Å; K395-N398 PolarHBondContact O-N 2.69Å; K395-N398 VanDerWaalsContact O-N 3.08Å; K395-E399 PolarHBondContact O-N 3.39Å
396	E	39.8	Very low	45.3	Very low	147 Å²	147	110.2 Å²	110.2	69%	0.687	58%	0.584	S	S	*	*	H	α-helix	trans	-64.6	-25.4	179.6	-67	-177.7	176.3	0	0	113
397	N	36.7	Very low	43.2	Very low	133 Å²	133	115.7 Å²	115.7	71%	0.711	61%	0.605	S	S	*	*	H	α-helix	trans	-87.4	-13.7	176.2	-71.6	-16.4	0	0	0	114.1	K395	K395-N397 PolarHBondContact O-N 3.03Å
398	N	34.4	Very low	41.3	Very low	108 Å²	108	117.5 Å²	117.5	58%	0.578	62%	0.617	S	S	*	*	H	α-helix	trans	-107.3	1.8	-174.9	-78.1	-12.3	0	0	0	113.7	K395 C400	K395-N398 PolarHBondContact O-N 2.69Å; K395-N398 VanDerWaalsContact O-N 3.08Å; N398-C400 PolarHBondContact O-N 2.69Å
399	E	32	Very low	39.2	Very low	160 Å²	160	123.2 Å²	123.2	75%	0.748	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	18	176.7	-76.4	179	-175.6	0	0	113.7	K395	K395-E399 PolarHBondContact O-N 3.39Å
400	C	27.5	Very low	37.6	Very low	121 Å²	121	125.9 Å²	125.9	82%	0.818	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.5	6.6	177.8	-68.9	0	0	0	0	115.5	N398	N398-C400 PolarHBondContact O-N 2.69Å
401	E	28.1	Very low	36	Very low	188 Å²	188	125.1 Å²	125.1	88%	0.879	67%	0.666	S	S	*	*			trans	-129.8	92.9	169.9	-70.9	-168.6	165.9	0	0	110.2
402	S	26	Very low	34.5	Very low	96 Å²	96	129.7 Å²	129.7	67%	0.671	70%	0.698	S	S	*	*			trans	-82	148.2	170.3	90	0	0	0	0	111.1
403	D	26.9	Very low	32.9	Very low	129 Å²	129	131.9 Å²	131.9	69%	0.69	71%	0.709	S	S	*	*			trans	69.6	103.6	147.9	-48.9	-31.8	0	0	0	117.8
404	N	31.3	Very low	31.6	Very low	152 Å²	152	135.1 Å²	135.1	81%	0.813	74%	0.735	S	S	*	*				-170.8	109.6	118.6	-88.7	-38.4	0	0	0	113.2
405	E	32.3	Very low	30.6	Very low	173 Å²	173	136.1 Å²	136.1	81%	0.808	75%	0.751	S	S	*	*			trans	32.2	112.2	135.5	-63.6	-170.1	159.6	0	0	122.4
406	S	27.3	Very low	29.6	Very low	91 Å²	91	137 Å²	137	64%	0.636	77%	0.77	S	S	*	*				60.9	130	109.9	97.8	0	0	0	0	122.8
407	I	28.5	Very low	29.2	Very low	141 Å²	141	138.3 Å²	138.3	72%	0.723	78%	0.776	S	S	*	*			trans	82.7	107.8	142.2	-60.8	162	0	0	0	118.4
408	T	30.2	Very low	28.7	Very low	131 Å²	131	137.1 Å²	137.1	80%	0.804	78%	0.778	S	S	*	*				164.1	130.7	100	21.8	0	0	0	0	112.7
409	D	26.7	Very low	28.6	Very low	158 Å²	158	139 Å²	139	85%	0.845	79%	0.787	S	S	*	*			trans	-65.7	130.2	160.1	-71.9	-52.5	0	0	0	111.1
410	K	31.9	Very low	28.4	Very low	210 Å²	210	143.3 Å²	143.3	91%	0.913	80%	0.796	S	S	*	*			trans	-155.4	126.5	143	-84.7	-148.3	178.8	174.6	0	112.6
411	A	25.9	Very low	28.5	Very low	96 Å²	96	145.9 Å²	145.9	79%	0.793	79%	0.794	S	S	*	*			trans	-71.2	139.4	167.4	0	0	0	0	0	111.8
412	S	28.1	Very low	28.6	Very low	110 Å²	110	145.6 Å²	145.6	77%	0.769	80%	0.798	S	S	*	*			trans	-179.9	120.5	135.5	51.4	0	0	0	0	112.2
413	E	26.3	Very low	29	Very low	189 Å²	189	146 Å²	146	88%	0.883	80%	0.797	S	S	*	*			trans	58.1	125	131.6	-65.7	-172.9	157.7	0	0	123.6
414	S	26.7	Very low	29.5	Very low	112 Å²	112	146 Å²	146	78%	0.783	80%	0.801	S	S	*	*			trans	76.1	103.8	131.2	-165.6	0	0	0	0	119
415	S	26	Very low	29.7	Very low	107 Å²	107	147.1 Å²	147.1	75%	0.748	80%	0.802	S	S	*	*				172.1	131.7	96.9	61	0	0	0	0	109.3
416	S	28.7	Very low	30.1	Very low	124 Å²	124	145.1 Å²	145.1	87%	0.867	80%	0.801	S	S	*	*			trans	-130.4	109.5	164.3	41.8	0	0	0	0	109.5
417	Q	31	Very low	31.2	Very low	175 Å²	175	147.8 Å²	147.8	82%	0.818	80%	0.801	S	S	*	*			trans	-69.5	125.9	172.8	-76.8	170.4	-27	0	0	110.4
418	S	27	Very low	32.4	Very low	108 Å²	108	148.4 Å²	148.4	76%	0.755	81%	0.806	S	S	*	*			trans	19.2	106.5	144.5	58.8	0	0	0	0	119
419	I	32.1	Very low	33.9	Very low	148 Å²	148	149.4 Å²	149.4	76%	0.759	81%	0.807	S	S	*	*			trans	-128.6	111	149.8	-60.6	179.4	0	0	0	108.5	K421	I419-K421 HydrophobicContact CG2-CG 4.43Å; I419-K421 PolarHBondContact O-N 3.38Å
420	R	27.1	Very low	35.7	Very low	251 Å²	251	145.8 Å²	145.8	95%	0.947	80%	0.798	S	S	*	*			trans	-67.9	111.6	173.9	-65	174.7	178.8	177.4	-0.6	108.6
421	K	30.8	Very low	37.3	Very low	175 Å²	175	145.2 Å²	145.2	76%	0.761	79%	0.791	S	S	*	*			trans	-135.5	124.2	163.1	-80.8	-176.1	177.4	174.1	0	108.8	I419 V423	I419-K421 HydrophobicContact CG2-CG 4.43Å; I419-K421 PolarHBondContact O-N 3.38Å; K421-V423 VanDerWaalsContact C-N 3.28Å; K421-V423 PolarHBondContact O-N 3.35Å
422	D	30.7	Very low	39.3	Very low	181 Å²	181	144.7 Å²	144.7	97%	0.968	78%	0.779	S	S	*	*			trans	-56.4	87.4	173.3	-78.6	-48.7	0	0	0	110.5
423	V	34.1	Very low	41.3	Very low	106 Å²	106	151.3 Å²	151.3	64%	0.642	79%	0.787	S	S	*	*			trans	-102.8	122.3	167.8	-179.8	0	0	0	0	105.5	K421 Q425	K421-V423 VanDerWaalsContact C-N 3.28Å; K421-V423 PolarHBondContact O-N 3.35Å; V423-Q425 VanDerWaalsContact C-N 3.3Å; V423-Q425 PolarHBondContact O-N 2.97Å
424	T	36.2	Very low	43.5	Very low	129 Å²	129	149.8 Å²	149.8	79%	0.791	79%	0.785	S	S	*	*			trans	-46	97.8	164.6	46.5	0	0	0	0	108.5	T426	T424-T426 VanDerWaalsContact C-N 3.35Å; T424-T426 PolarHBondContact O-N 3.41Å
425	Q	35.5	Very low	46	Very low	175 Å²	175	146.6 Å²	146.6	82%	0.818	76%	0.758	S	S	*	*			trans	-64.3	98.5	-176.7	-78.3	-176.1	-3.6	0	0	108	V423 K427	V423-Q425 VanDerWaalsContact C-N 3.3Å; V423-Q425 PolarHBondContact O-N 2.97Å; Q425-K427 PolarHBondContact O-N 3.46Å
426	T	40.5	Very low	48.6	Very low	130 Å²	130	144.5 Å²	144.5	80%	0.798	74%	0.743	S	S	*	*			trans	-58.4	97.2	156.7	41.2	0	0	0	0	106.1	T424 N428	T424-T426 VanDerWaalsContact C-N 3.35Å; T424-T426 PolarHBondContact O-N 3.41Å; T426-N428 PolarHBondContact O-N 3.03Å
427	K	50.6	Low	51.2	Low	148 Å²	148	143.2 Å²	143.2	64%	0.643	73%	0.731	S	S	*	*			trans	-52.5	113.8	175.6	-76.7	-175.2	177.7	-178.3	0	107.7	Q425 N429	Q425-K427 PolarHBondContact O-N 3.46Å; K427-N429 PolarHBondContact O-N 3.3Å
428	N	54.2	Low	53.7	Low	154 Å²	154	141.5 Å²	141.5	82%	0.824	72%	0.724	S	S	*	*			trans	-62.3	110.4	177.4	-128.5	-13.4	0	0	0	107.5	T426 A430	T426-N428 PolarHBondContact O-N 3.03Å; N428-A430 PolarHBondContact O-N 3.4Å; N428-A430 VanDerWaalsContact O-N 3.13Å
429	N	62.6	Low	56.3	Low	152 Å²	152	139 Å²	139	81%	0.813	71%	0.706	S	S	*	*			trans	-78.1	12.6	-177	-76.9	-32.8	0	0	0	112.9	K427 R431	K427-N429 PolarHBondContact O-N 3.3Å; N429-R431 PolarHBondContact O-N 2.81Å
430	A	63.8	Low	58.7	Low	81 Å²	81	138 Å²	138	67%	0.669	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-66.5	130.7	-177.6	0	0	0	0	0	110.6	N428	N428-A430 PolarHBondContact O-N 3.4Å; N428-A430 VanDerWaalsContact O-N 3.13Å
431	R	66.4	Low	61.5	Low	199 Å²	199	135.1 Å²	135.1	75%	0.751	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-84.6	133.5	177.9	-60.5	175.7	-174.7	176.6	3.2	108.6	N429 R433	N429-R431 PolarHBondContact O-N 2.81Å; R431-R433 PolarHBondContact O-N 3.32Å
432	P	67.3	Low	64.2	Low	84 Å²	84	131.5 Å²	131.5	55%	0.545	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-64	131.8	170	23.7	-28.6	0	0	0	109.5	N434 E435	P432-N434 PolarHBondContact O-N 2.74Å; P432-E435 HydrophobicContact CG-CB 4.34Å
433	R	69	Low	66.8	Low	249 Å²	249	126.8 Å²	126.8	94%	0.94	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-25.1	-172	-151.6	172.9	-176.4	172.5	-0.7	112.9	R431	R431-R433 PolarHBondContact O-N 3.32Å
434	N	73.7	Confident	69.4	Low	157 Å²	157	127.3 Å²	127.3	84%	0.84	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.4	48	-175.8	-62.3	-11.3	0	0	0	112.5	P432	P432-N434 PolarHBondContact O-N 2.74Å
435	E	78	Confident	72.1	Confident	46 Å²	46	127.6 Å²	127.6	22%	0.215	62%	0.624	C	S	.	*			trans	-73.7	124.6	179.8	-168.2	177.9	-154.2	0	0	111.3	P432 R440 R443	P432-E435 HydrophobicContact CG-CB 4.34Å; E435-R440 VanDerWaalsContact CD-CA 3.48Å; E435-R440 HydrophobicContact CG-CB 4.04Å; E435-R440 VanDerWaalsContact OE1-CA 3.29Å; E435-R440 WeakPolarHBondContact OE1-CA 3.47Å; E435-R440 PolarHBondContact OE1-N 2.81Å; E435-R443 IonicContact OE1-CZ 3.61Å; E435-R443 IonicContact OE1-NE 2.89Å; E435-R443 PolarHBondContact OE1-NE 3.42Å; E435-R443 IonicContact OE1-NH2 2.71Å; E435-R443 IonicContact OE2-CZ 2.67Å; E435-R443 IonicContact OE2-NE 3.97Å; E435-R443 PolarHBondContact OE2-NE 2.86Å; E435-R443 IonicContact OE2-NH2 3.32Å; E435-R443 PolarHBondContact OE2-NH2 3.46Å
436	S	82.1	Confident	74.6	Confident	63 Å²	63	121.6 Å²	121.6	44%	0.441	60%	0.604	S	S	.	*			trans	-63.2	151.8	174.4	77.4	0	0	0	0	111.6	E438 S439 R440	S436-E438 PolarHBondContact O-N 3.34Å; S436-E438 VanDerWaalsContact O-N 3.11Å; S436-S439 PolarHBondContact O-N 2.93Å; S436-S439 WeakPolarHBondContact OG-CB 3.47Å; S436-S439 PolarHBondContact OG-N 3.48Å; S436-R440 PolarHBondContact O-N 2.86Å
437	P	82.6	Confident	77	Confident	96 Å²	96	118.4 Å²	118.4	62%	0.623	58%	0.581	S	S	*	*	H	α-helix	trans	-54.4	-33.3	-179.9	-26.9	34.6	0	0	0	113.9	R441	P437-R441 WeakPolarHBondContact O-CG 3.35Å; P437-R441 PolarHBondContact O-N 3.46Å
438	E	83.1	Confident	79	Confident	140 Å²	140	118.8 Å²	118.8	65%	0.654	58%	0.583	S	S	*	*	H	α-helix	trans	-77.8	-44.1	-179.5	-166.4	164.1	-153.6	0	0	112.5	S436 R440 R441 N442	S436-E438 PolarHBondContact O-N 3.34Å; S436-E438 VanDerWaalsContact O-N 3.11Å; E438-R440 VanDerWaalsContact C-N 3.27Å; E438-R440 PolarHBondContact O-N 2.92Å; E438-R441 WeakPolarHBondContact O-CB 3.5Å; E438-R441 PolarHBondContact O-N 3.39Å; E438-N442 PolarHBondContact O-N 3.3Å
439	S	82.6	Confident	80.7	Confident	56 Å²	56	116.6 Å²	116.6	39%	0.392	57%	0.568	S	S	.	*	H	α-helix	trans	-55.9	-43.1	172.2	179.3	0	0	0	0	111.5	S436 R441 N442 R443	S436-S439 PolarHBondContact O-N 2.93Å; S436-S439 WeakPolarHBondContact OG-CB 3.47Å; S436-S439 PolarHBondContact OG-N 3.48Å; S439-R441 VanDerWaalsContact C-N 3.34Å; S439-R441 PolarHBondContact O-N 2.86Å; S439-N442 PolarHBondContact O-N 3.32Å; S439-R443 PolarHBondContact O-N 3.13Å
440	R	82.2	Confident	82.1	Confident	127 Å²	127	112.7 Å²	112.7	48%	0.479	55%	0.545	S	S	.	.	H	α-helix	trans	-60.9	-38.4	175.4	-170.7	178.4	70	169.7	-0.3	113.4	E435 S436 E438 K444	E435-R440 VanDerWaalsContact CD-CA 3.48Å; E435-R440 HydrophobicContact CG-CB 4.04Å; E435-R440 VanDerWaalsContact OE1-CA 3.29Å; E435-R440 WeakPolarHBondContact OE1-CA 3.47Å; E435-R440 PolarHBondContact OE1-N 2.81Å; S436-R440 PolarHBondContact O-N 2.86Å; E438-R440 VanDerWaalsContact C-N 3.27Å; E438-R440 PolarHBondContact O-N 2.92Å; R440-K444 WeakPolarHBondContact O-CB 3.5Å; R440-K444 WeakPolarHBondContact O-CG 3.29Å; R440-K444 PolarHBondContact O-N 3.06Å; R440-K444 VanDerWaalsContact O-N 3.13Å
441	R	86.6	Confident	83.5	Confident	189 Å²	189	113.1 Å²	113.1	71%	0.713	53%	0.533	S	S	*	.	H	α-helix	trans	-67.6	-46.1	176.4	-76.4	177.6	179.5	-179.6	1.3	110.5	P437 E438 S439 K444 K445	P437-R441 WeakPolarHBondContact O-CG 3.35Å; P437-R441 PolarHBondContact O-N 3.46Å; E438-R441 WeakPolarHBondContact O-CB 3.5Å; E438-R441 PolarHBondContact O-N 3.39Å; S439-R441 VanDerWaalsContact C-N 3.34Å; S439-R441 PolarHBondContact O-N 2.86Å; R441-K444 PolarHBondContact O-N 3.14Å; R441-K445 WeakPolarHBondContact O-CB 3.33Å; R441-K445 PolarHBondContact O-N 3.19Å
442	N	86.4	Confident	84.8	Confident	100 Å²	100	105.9 Å²	105.9	54%	0.535	52%	0.515	S	S	.	.	H	α-helix	trans	-62.3	-44.2	178.8	-70.9	-17.8	0	0	0	112	E438 S439 K444 K445 A446	E438-N442 PolarHBondContact O-N 3.3Å; S439-N442 PolarHBondContact O-N 3.32Å; N442-K444 PolarHBondContact O-N 3.37Å; N442-K445 WeakPolarHBondContact O-CB 3.47Å; N442-K445 PolarHBondContact O-N 2.67Å; N442-K445 VanDerWaalsContact O-N 3.15Å; N442-A446 PolarHBondContact O-N 2.91Å
443	R	85.8	Confident	86	Confident	81 Å²	81	107.4 Å²	107.4	31%	0.306	52%	0.515	S	S	.	.	H	α-helix	trans	-60.7	-45.9	174.6	-177.3	177.4	62.1	100.2	-4.8	112.6	E435 S439 K445 A446 I447	E435-R443 IonicContact OE1-CZ 3.61Å; E435-R443 IonicContact OE1-NE 2.89Å; E435-R443 PolarHBondContact OE1-NE 3.42Å; E435-R443 IonicContact OE1-NH2 2.71Å; E435-R443 IonicContact OE2-CZ 2.67Å; E435-R443 IonicContact OE2-NE 3.97Å; E435-R443 PolarHBondContact OE2-NE 2.86Å; E435-R443 IonicContact OE2-NH2 3.32Å; E435-R443 PolarHBondContact OE2-NH2 3.46Å; S439-R443 PolarHBondContact O-N 3.13Å; R443-K445 VanDerWaalsContact C-N 3.26Å; R443-K445 PolarHBondContact O-N 3.35Å; R443-A446 PolarHBondContact O-N 2.95Å; R443-I447 HydrophobicContact CG-CD1 3.93Å; R443-I447 HydrophobicContact CG-CG1 4.48Å; R443-I447 WeakPolarHBondContact O-CG1 3.33Å; R443-I447 PolarHBondContact O-N 2.9Å
444	K	89.1	Confident	87.1	Confident	118 Å²	118	101.7 Å²	101.7	51%	0.513	50%	0.497	S	S	.	.	H	α-helix	trans	-61.1	-37.1	175.5	-77.5	-179.2	178.5	-175.9	0	111.6	R440 R441 N442 K448	R440-K444 WeakPolarHBondContact O-CB 3.5Å; R440-K444 WeakPolarHBondContact O-CG 3.29Å; R440-K444 PolarHBondContact O-N 3.06Å; R440-K444 VanDerWaalsContact O-N 3.13Å; R441-K444 PolarHBondContact O-N 3.14Å; N442-K444 PolarHBondContact O-N 3.37Å; K444-K448 WeakPolarHBondContact O-CB 3.42Å; K444-K448 WeakPolarHBondContact O-CG 3.3Å; K444-K448 PolarHBondContact O-N 3.39Å; K444-K448 VanDerWaalsContact O-N 3.08Å
445	K	91.7	Very high	88	Confident	135 Å²	135	101.5 Å²	101.5	59%	0.587	49%	0.485	S	S	*	.	H	α-helix	trans	-65.9	-46.7	175.7	-167.8	178.1	179.6	-177	0	111.2	R441 N442 R443 K448 Q449	R441-K445 WeakPolarHBondContact O-CB 3.33Å; R441-K445 PolarHBondContact O-N 3.19Å; N442-K445 WeakPolarHBondContact O-CB 3.47Å; N442-K445 PolarHBondContact O-N 2.67Å; N442-K445 VanDerWaalsContact O-N 3.15Å; R443-K445 VanDerWaalsContact C-N 3.26Å; R443-K445 PolarHBondContact O-N 3.35Å; K445-K448 PolarHBondContact O-N 3.15Å; K445-Q449 WeakPolarHBondContact O-CG 3.39Å; K445-Q449 PolarHBondContact O-N 2.93Å
446	A	89.4	Confident	88.7	Confident	49 Å²	49	107.1 Å²	107.1	41%	0.405	51%	0.509	S	S	.	.	H	α-helix	trans	-61.1	-46.8	176.4	0	0	0	0	0	112.4	N442 R443 K448 Q449 E450	N442-A446 PolarHBondContact O-N 2.91Å; R443-A446 PolarHBondContact O-N 2.95Å; A446-K448 VanDerWaalsContact C-N 3.29Å; A446-K448 PolarHBondContact O-N 3.08Å; A446-Q449 PolarHBondContact O-N 3.24Å; A446-Q449 VanDerWaalsContact O-N 3.15Å; A446-E450 PolarHBondContact O-N 3.48Å
447	I	89.3	Confident	89.1	Confident	63 Å²	63	112.1 Å²	112.1	32%	0.323	53%	0.525	S	S	.	.	H	α-helix	trans	-60.4	-40.6	176.2	-68.3	168.5	0	0	0	110.9	R443 Q451	R443-I447 HydrophobicContact CG-CD1 3.93Å; R443-I447 HydrophobicContact CG-CG1 4.48Å; R443-I447 WeakPolarHBondContact O-CG1 3.33Å; R443-I447 PolarHBondContact O-N 2.9Å; I447-Q451 HydrophobicContact CG2-CG 4.37Å; I447-Q451 WeakPolarHBondContact O-CB 3.25Å; I447-Q451 VanDerWaalsContact O-CG 3.23Å; I447-Q451 WeakPolarHBondContact O-CG 3.23Å; I447-Q451 PolarHBondContact O-N 3.3Å
448	K	92.7	Very high	89.6	Confident	155 Å²	155	114 Å²	114	67%	0.674	52%	0.523	S	S	*	.	H	α-helix	trans	-65.1	-40	176.3	-79.3	-179.4	177.9	-173.8	0	111.9	K444 K445 A446 A452	K444-K448 WeakPolarHBondContact O-CB 3.42Å; K444-K448 WeakPolarHBondContact O-CG 3.3Å; K444-K448 PolarHBondContact O-N 3.39Å; K444-K448 VanDerWaalsContact O-N 3.08Å; K445-K448 PolarHBondContact O-N 3.15Å; A446-K448 VanDerWaalsContact C-N 3.29Å; A446-K448 PolarHBondContact O-N 3.08Å; K448-A452 VanDerWaalsContact O-CB 3.3Å; K448-A452 WeakPolarHBondContact O-CB 3.33Å; K448-A452 PolarHBondContact O-N 3.31Å
449	Q	90.9	Very high	89.9	Confident	108 Å²	108	112.9 Å²	112.9	51%	0.505	52%	0.52	S	S	.	.	H	α-helix	trans	-65	-48.5	175.6	-75.5	173.2	-34	0	0	111.4	K445 A446 Q451 A452 E453	K445-Q449 WeakPolarHBondContact O-CG 3.39Å; K445-Q449 PolarHBondContact O-N 2.93Å; A446-Q449 PolarHBondContact O-N 3.24Å; A446-Q449 VanDerWaalsContact O-N 3.15Å; Q449-Q451 VanDerWaalsContact C-N 3.31Å; Q449-Q451 PolarHBondContact O-N 3.13Å; Q449-A452 WeakPolarHBondContact O-CA 3.32Å; Q449-A452 WeakPolarHBondContact O-CB 3.44Å; Q449-A452 PolarHBondContact O-N 2.89Å; Q449-E453 PolarHBondContact O-N 3.23Å
450	E	91.6	Very high	90.4	Very high	71 Å²	71	113 Å²	113	33%	0.332	52%	0.52	S	S	.	.	H	α-helix	trans	-59.4	-42.4	176.3	-171.8	-171.8	173.2	0	0	111.3	A446 A452 E453 K454	A446-E450 PolarHBondContact O-N 3.48Å; E450-A452 VanDerWaalsContact C-N 3.34Å; E450-E453 PolarHBondContact O-N 3.36Å; E450-K454 HydrophobicContact CG-CD 4.43Å; E450-K454 WeakPolarHBondContact O-CB 3.44Å; E450-K454 VanDerWaalsContact O-CG 3.3Å; E450-K454 WeakPolarHBondContact O-CG 3.32Å; E450-K454 PolarHBondContact O-N 3.05Å; E450-K454 WeakPolarHBondContact OE1-CE 3.36Å; E450-K454 IonicContact OE1-NZ 3.34Å; E450-K454 PolarHBondContact OE1-NZ 2.99Å
451	Q	93.5	Very high	91	Very high	89 Å²	89	113.8 Å²	113.8	42%	0.416	53%	0.527	S	S	.	.	H	α-helix	trans	-67.1	-33.8	174.4	-73.8	-178.8	11.5	0	0	112.7	I447 Q449 R455	I447-Q451 HydrophobicContact CG2-CG 4.37Å; I447-Q451 WeakPolarHBondContact O-CB 3.25Å; I447-Q451 VanDerWaalsContact O-CG 3.23Å; I447-Q451 WeakPolarHBondContact O-CG 3.23Å; I447-Q451 PolarHBondContact O-N 3.3Å; Q449-Q451 VanDerWaalsContact C-N 3.31Å; Q449-Q451 PolarHBondContact O-N 3.13Å; Q451-R455 WeakPolarHBondContact O-CB 3.48Å; Q451-R455 WeakPolarHBondContact O-CD 3.14Å; Q451-R455 WeakPolarHBondContact O-CG 3.47Å; Q451-R455 PolarHBondContact O-N 3.21Å
452	A	92.6	Very high	91.3	Very high	47 Å²	47	112.7 Å²	112.7	39%	0.388	52%	0.524	S	S	.	.	H	α-helix	trans	-68.2	-43.4	176.3	0	0	0	0	0	111.3	K448 Q449 E450 R455 K456	K448-A452 VanDerWaalsContact O-CB 3.3Å; K448-A452 WeakPolarHBondContact O-CB 3.33Å; K448-A452 PolarHBondContact O-N 3.31Å; Q449-A452 WeakPolarHBondContact O-CA 3.32Å; Q449-A452 WeakPolarHBondContact O-CB 3.44Å; Q449-A452 PolarHBondContact O-N 2.89Å; E450-A452 VanDerWaalsContact C-N 3.34Å; A452-R455 WeakPolarHBondContact O-CB 3.46Å; A452-R455 PolarHBondContact O-N 3.21Å; A452-R455 VanDerWaalsContact O-N 3.15Å; A452-K456 PolarHBondContact O-N 3.11Å; A452-K456 VanDerWaalsContact O-N 3.16Å
453	E	92.3	Very high	91.6	Very high	116 Å²	116	110 Å²	110	54%	0.542	51%	0.511	S	S	.	.	H	α-helix	trans	-61.6	-47.7	173.7	-71.3	173.8	177.1	0	0	111.6	Q449 E450 R455 K456 H457	Q449-E453 PolarHBondContact O-N 3.23Å; E450-E453 PolarHBondContact O-N 3.36Å; E453-R455 PolarHBondContact O-N 3.05Å; E453-K456 WeakPolarHBondContact O-CB 3.32Å; E453-K456 PolarHBondContact O-N 3.32Å; E453-H457 PolarHBondContact O-CD2 3.32Å
454	K	93.4	Very high	91.9	Very high	130 Å²	130	112.9 Å²	112.9	57%	0.565	53%	0.525	S	S	*	.	H	α-helix	trans	-57.8	-32	173.5	-73.8	175	-174.8	171.4	0	112.6	E450 K458	E450-K454 HydrophobicContact CG-CD 4.43Å; E450-K454 WeakPolarHBondContact O-CB 3.44Å; E450-K454 VanDerWaalsContact O-CG 3.3Å; E450-K454 WeakPolarHBondContact O-CG 3.32Å; E450-K454 PolarHBondContact O-N 3.05Å; E450-K454 WeakPolarHBondContact OE1-CE 3.36Å; E450-K454 IonicContact OE1-NZ 3.34Å; E450-K454 PolarHBondContact OE1-NZ 2.99Å; K454-K458 PolarHBondContact O-N 3.25Å
455	R	92.9	Very high	91.9	Very high	153 Å²	153	114.7 Å²	114.7	58%	0.577	53%	0.529	S	S	*	.	H	α-helix	trans	-74.5	-24.9	176.9	-75.8	167.7	-168.7	-177.6	6.7	113.3	Q451 A452 E453 K458	Q451-R455 WeakPolarHBondContact O-CB 3.48Å; Q451-R455 WeakPolarHBondContact O-CD 3.14Å; Q451-R455 WeakPolarHBondContact O-CG 3.47Å; Q451-R455 PolarHBondContact O-N 3.21Å; A452-R455 WeakPolarHBondContact O-CB 3.46Å; A452-R455 PolarHBondContact O-N 3.21Å; A452-R455 VanDerWaalsContact O-N 3.15Å; E453-R455 PolarHBondContact O-N 3.05Å; R455-K458 HydrophobicContact CB-CD 4.34Å; R455-K458 HydrophobicContact CG-CD 4.46Å; R455-K458 WeakPolarHBondContact O-CD 3.38Å; R455-K458 VanDerWaalsContact O-CG 3.25Å; R455-K458 WeakPolarHBondContact O-CG 3.49Å
456	K	91.1	Very high	91.8	Very high	164 Å²	164	117 Å²	117	71%	0.713	53%	0.534	S	S	*	.	H	α-helix	trans	-66.8	-39.5	174.6	-67	178	-179.4	179.7	0	111.2	A452 E453	A452-K456 PolarHBondContact O-N 3.11Å; A452-K456 VanDerWaalsContact O-N 3.16Å; E453-K456 WeakPolarHBondContact O-CB 3.32Å; E453-K456 PolarHBondContact O-N 3.32Å
457	H	90.7	Very high	91.7	Very high	167 Å²	167	121.6 Å²	121.6	77%	0.773	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	13.8	-179.3	-53.1	-66.3	0	0	0	113.8	E453	E453-H457 PolarHBondContact O-CD2 3.32Å
458	K	93.2	Very high	91.3	Very high	137 Å²	137	124.7 Å²	124.7	60%	0.596	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-71.2	146.8	-178.6	78.5	-170.9	175.8	-173.4	0	111.2	K454 R455 P460	K454-K458 PolarHBondContact O-N 3.25Å; R455-K458 HydrophobicContact CB-CD 4.34Å; R455-K458 HydrophobicContact CG-CD 4.46Å; R455-K458 WeakPolarHBondContact O-CD 3.38Å; R455-K458 VanDerWaalsContact O-CG 3.25Å; R455-K458 WeakPolarHBondContact O-CG 3.49Å; K458-P460 WeakPolarHBondContact O-CD 3.43Å
459	I	90.5	Very high	90.1	Very high	116 Å²	116	126.6 Å²	126.6	60%	0.595	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-60.1	127.8	171.6	-58.9	170.9	0	0	0	109.2	V463	I459-V463 HydrophobicContact CG2-CB 3.97Å; I459-V463 HydrophobicContact CG2-CG1 3.99Å
460	P	93.3	Very high	88.2	Confident	58 Å²	58	132.2 Å²	132.2	38%	0.377	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-56.4	140.4	177.9	-26.4	34.2	0	0	0	112.6	K458 Y462 V463 K464	K458-P460 WeakPolarHBondContact O-CD 3.43Å; P460-Y462 HydrophobicContact CB-CD1 3.6Å; P460-Y462 HydrophobicContact CB-CE1 3.32Å; P460-Y462 HydrophobicContact CG-CE1 4.06Å; P460-Y462 PolarHBondContact O-N 3.48Å; P460-V463 HydrophobicContact CB-CG2 4.14Å; P460-V463 HydrophobicContact CG-CG2 4.38Å; P460-V463 WeakPolarHBondContact O-CB 3.42Å; P460-V463 PolarHBondContact O-N 3Å; P460-K464 PolarHBondContact O-N 3.18Å; P460-K464 VanDerWaalsContact O-N 3.14Å
461	K	93.2	Very high	88	Confident	144 Å²	144	135.3 Å²	135.3	63%	0.626	61%	0.605	S	S	*	*	H	α-helix	trans	-57.9	-35.6	-175.2	-170.7	179.7	-176.9	-178.5	0	112.6	K464 R465	K461-K464 PolarHBondContact O-N 3.16Å; K461-R465 WeakPolarHBondContact O-CB 3.47Å; K461-R465 WeakPolarHBondContact O-CG 3.43Å; K461-R465 PolarHBondContact O-N 3.15Å
462	Y	93.2	Very high	87.7	Confident	166 Å²	166	137.7 Å²	137.7	65%	0.651	62%	0.615	S	S	*	*	H	α-helix	trans	-66.9	-38	178.7	75	-93.4	0	0	0	112	P460 R465 R466	P460-Y462 HydrophobicContact CB-CD1 3.6Å; P460-Y462 HydrophobicContact CB-CE1 3.32Å; P460-Y462 HydrophobicContact CG-CE1 4.06Å; P460-Y462 PolarHBondContact O-N 3.48Å; Y462-R465 PolarHBondContact O-N 3.02Å; Y462-R466 WeakPolarHBondContact O-CB 3.4Å; Y462-R466 PolarHBondContact O-N 3.5Å
463	V	92.7	Very high	87.5	Confident	44 Å²	44	142.7 Å²	142.7	27%	0.267	63%	0.627	S	S	.	*	H	α-helix	trans	-64.6	-44.8	174	-179.5	0	0	0	0	110.2	I459 P460 R465 R466 K467	I459-V463 HydrophobicContact CG2-CB 3.97Å; I459-V463 HydrophobicContact CG2-CG1 3.99Å; P460-V463 HydrophobicContact CB-CG2 4.14Å; P460-V463 HydrophobicContact CG-CG2 4.38Å; P460-V463 WeakPolarHBondContact O-CB 3.42Å; P460-V463 PolarHBondContact O-N 3Å; V463-R465 PolarHBondContact O-N 2.96Å; V463-R466 PolarHBondContact O-N 2.88Å; V463-K467 WeakPolarHBondContact O-CB 3.3Å; V463-K467 WeakPolarHBondContact O-CG 3.47Å; V463-K467 PolarHBondContact O-N 2.88Å
464	K	92.2	Very high	87.2	Confident	140 Å²	140	144.3 Å²	144.3	61%	0.609	63%	0.632	S	S	*	*	H	α-helix	trans	-60.6	-43.8	176.3	-170.9	176.5	-178.1	177.4	0	111.9	P460 K461 K467 I468	P460-K464 PolarHBondContact O-N 3.18Å; P460-K464 VanDerWaalsContact O-N 3.14Å; K461-K464 PolarHBondContact O-N 3.16Å; K464-K467 PolarHBondContact O-N 3.01Å; K464-I468 HydrophobicContact CG-CD1 4.38Å; K464-I468 WeakPolarHBondContact O-CD1 3.48Å; K464-I468 WeakPolarHBondContact O-CG1 3.4Å; K464-I468 PolarHBondContact O-N 2.86Å
465	R	90.6	Very high	86.8	Confident	156 Å²	156	145.2 Å²	145.2	59%	0.589	64%	0.637	S	S	*	*	H	α-helix	trans	-66.8	-40	176.9	-76	-178.9	169.8	-171.3	-5	112.5	K461 Y462 V463 K467 I468 K469	K461-R465 WeakPolarHBondContact O-CB 3.47Å; K461-R465 WeakPolarHBondContact O-CG 3.43Å; K461-R465 PolarHBondContact O-N 3.15Å; Y462-R465 PolarHBondContact O-N 3.02Å; V463-R465 PolarHBondContact O-N 2.96Å; R465-K467 VanDerWaalsContact C-N 3.35Å; R465-I468 PolarHBondContact O-N 3.15Å; R465-K469 PolarHBondContact O-N 3.35Å
466	R	88.9	Confident	86.4	Confident	183 Å²	183	144.7 Å²	144.7	69%	0.691	64%	0.64	S	S	*	*	H	α-helix	trans	-67.3	-35.6	177.6	-165.3	175.2	-175.3	178.5	1	111.9	Y462 V463 I468 K469 K470	Y462-R466 WeakPolarHBondContact O-CB 3.4Å; Y462-R466 PolarHBondContact O-N 3.5Å; V463-R466 PolarHBondContact O-N 2.88Å; R466-I468 VanDerWaalsContact C-N 3.35Å; R466-K469 PolarHBondContact O-N 2.94Å; R466-K470 PolarHBondContact O-N 2.85Å
467	K	86.2	Confident	86	Confident	146 Å²	146	143.3 Å²	143.3	64%	0.635	64%	0.635	S	S	*	*	H	α-helix	trans	-66.4	-30	174.1	-79.5	-170.5	177.8	-170.8	0	114	V463 K464 R465 K469	V463-K467 WeakPolarHBondContact O-CB 3.3Å; V463-K467 WeakPolarHBondContact O-CG 3.47Å; V463-K467 PolarHBondContact O-N 2.88Å; K464-K467 PolarHBondContact O-N 3.01Å; R465-K467 VanDerWaalsContact C-N 3.35Å; K467-K469 VanDerWaalsContact C-N 3.32Å
468	I	82.5	Confident	85.7	Confident	129 Å²	129	141.5 Å²	141.5	66%	0.662	63%	0.625	S	S	*	*	H	α-helix	trans	-78.3	-21.2	178	-64.7	162.6	0	0	0	111.4	K464 R465 R466	K464-I468 HydrophobicContact CG-CD1 4.38Å; K464-I468 WeakPolarHBondContact O-CD1 3.48Å; K464-I468 WeakPolarHBondContact O-CG1 3.4Å; K464-I468 PolarHBondContact O-N 2.86Å; R465-I468 PolarHBondContact O-N 3.15Å; R466-I468 VanDerWaalsContact C-N 3.35Å
469	K	67.5	Low	85.1	Confident	194 Å²	194	141.8 Å²	141.8	84%	0.843	63%	0.627	S	S	*	*			trans	-91.1	-10.5	179.3	-72.4	-169.5	174.8	-167.4	0	114.2	R465 R466 K467	R465-K469 PolarHBondContact O-N 3.35Å; R466-K469 PolarHBondContact O-N 2.94Å; K467-K469 VanDerWaalsContact C-N 3.32Å
470	K	49.9	Very low	84.6	Confident	226 Å²	226	144.2 Å²	144.2	98%	0.983	63%	0.63	S	S	*	*			trans	-95.8	0	168.1	-80.2	-170.7	170.5	-168.1	0	107.9	R466	R466-K470 PolarHBondContact O-N 2.85Å

Retrieved 470 of 470 residues in 298.8 ms (Link to these results)

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