A0A077Z804_TRITR Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A077Z804, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 542 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	36.7	Very low	32	Very low	244 Å²	244	157.1 Å²	157.1	100%	1.202	80%	0.8	S	S	*	*				0	73.9	0	-72.5	175.1	-174.4	0	0	107.1
2	M	25.8	Very low	31.7	Very low	179 Å²	179	151.1 Å²	151.1	88%	0.882	81%	0.806	S	S	*	*				52	105	83.4	-82.7	-156	177.5	0	0	113.9
3	T	31	Very low	31.5	Very low	97 Å²	97	144.5 Å²	144.5	60%	0.595	80%	0.796	S	S	*	*			trans	96.8	95.6	136.9	-42.6	0	0	0	0	119	L5	T3-L5 HydrophobicContact CG2-CB 4.47Å; T3-L5 HydrophobicContact CG2-CD1 3.28Å; T3-L5 HydrophobicContact CG2-CG 3.65Å
4	I	43.6	Very low	31.6	Very low	173 Å²	173	148.2 Å²	148.2	89%	0.887	80%	0.804	S	S	*	*			trans	-145.9	74.5	142.6	-58	-177.1	0	0	0	106.2
5	L	33.5	Very low	32	Very low	133 Å²	133	144.8 Å²	144.8	70%	0.696	80%	0.796	S	S	*	*				41.7	104.3	92.9	-80	167.5	0	0	0	114.2	T3	T3-L5 HydrophobicContact CG2-CB 4.47Å; T3-L5 HydrophobicContact CG2-CD1 3.28Å; T3-L5 HydrophobicContact CG2-CG 3.65Å
6	K	33.5	Very low	32.3	Very low	175 Å²	175	147.3 Å²	147.3	76%	0.761	80%	0.8	S	S	*	*				54.1	111	75.8	-96.4	-171.6	-177.1	176.7	0	116.2
7	T	35.3	Very low	32.5	Very low	134 Å²	134	145 Å²	145	82%	0.822	80%	0.798	S	S	*	*			trans	-160.5	121.2	148.4	23.4	0	0	0	0	107.4
8	W	28.3	Very low	32.6	Very low	196 Å²	196	142.9 Å²	142.9	74%	0.742	79%	0.794	S	S	*	*				60.7	130.3	58	-70.4	38.4	0	0	0	110.4
9	F	29.2	Very low	32.9	Very low	136 Å²	136	143.6 Å²	143.6	60%	0.596	80%	0.796	S	S	*	*			cis	-177.9	160.3	24.2	-130.4	-132	0	0	0	109.8
10	K	28.3	Very low	33.1	Very low	181 Å²	181	143.3 Å²	143.3	79%	0.787	80%	0.797	S	S	*	*			trans	24.7	121.9	145	-71.8	-178.6	175.4	173.8	0	121.5
11	G	27.2	Very low	33.5	Very low	80 Å²	80	142.8 Å²	142.8	83%	0.825	80%	0.798	S	S	*	*				73.4	113.9	101.5	0	0	0	0	0	120.8
12	G	27.6	Very low	33.8	Very low	85 Å²	85	138.7 Å²	138.7	88%	0.876	78%	0.781	S	S	*	*				87.3	128.8	125.9	0	0	0	0	0	120.1
13	G	29.1	Very low	34.4	Very low	65 Å²	65	137 Å²	137	67%	0.67	78%	0.776	S	S	*	*			trans	88.8	103.7	155	0	0	0	0	0	115
14	E	32.7	Very low	35.1	Very low	197 Å²	197	140 Å²	140	92%	0.921	79%	0.788	S	S	*	*				64.9	121.8	96.4	-70.4	178.8	175.8	0	0	111.6
15	S	37.7	Very low	35.2	Very low	97 Å²	97	135.6 Å²	135.6	68%	0.678	77%	0.772	S	S	*	*			cis	-173.9	159.9	27.5	44.5	0	0	0	0	111.2
16	E	36.8	Very low	35.8	Very low	185 Å²	185	135.8 Å²	135.8	86%	0.864	78%	0.779	S	S	*	*			trans	75.2	126.3	156.3	-68.6	170.1	162.7	0	0	119.3
17	S	36.3	Very low	36.3	Very low	108 Å²	108	135.8 Å²	135.8	76%	0.755	78%	0.781	S	S	*	*			cis	-166.1	157.6	7.7	51.6	0	0	0	0	112.3
18	C	33.5	Very low	37	Very low	107 Å²	107	136.9 Å²	136.9	72%	0.723	78%	0.781	S	S	*	*			trans	87.3	85.4	156.5	-68.2	0	0	0	0	121.7
19	D	38.3	Very low	38.7	Very low	157 Å²	157	131.5 Å²	131.5	84%	0.84	77%	0.773	S	S	*	*				81.9	118.2	123.4	-53.4	-32.5	0	0	0	122.3
20	V	38.1	Very low	40	Very low	136 Å²	136	135.8 Å²	135.8	82%	0.824	79%	0.785	S	S	*	*			trans	-136.2	134.8	-165.8	170.6	0	0	0	0	109.1
21	V	41.6	Very low	41.1	Very low	134 Å²	134	131.9 Å²	131.9	81%	0.812	78%	0.778	S	S	*	*			trans	-174.5	135.4	150.2	-114.4	0	0	0	0	106.8
22	D	43.1	Very low	42.6	Very low	158 Å²	158	137.4 Å²	137.4	85%	0.845	78%	0.775	S	S	*	*			cis	-159.2	158.7	11.1	-145.3	-14.1	0	0	0	109
23	D	36.9	Very low	43.7	Very low	143 Å²	143	139 Å²	139	77%	0.765	76%	0.764	S	S	*	*			trans	-90.2	107.8	-164	179.5	40.1	0	0	0	113.7	S25	D23-S25 PolarHBondContact O-N 3.48Å
24	D	46.4	Very low	44.5	Very low	161 Å²	161	140.7 Å²	140.7	86%	0.861	76%	0.761	S	S	*	*			trans	-84.2	90	171.8	-103.2	-16.2	0	0	0	110.2	V26	D24-V26 PolarHBondContact O-N 3.32Å
25	S	45.1	Very low	45.2	Very low	79 Å²	79	140 Å²	140	55%	0.552	75%	0.75	S	S	*	*			trans	-48.7	127.4	170.6	64.3	0	0	0	0	111.7	D23 Q27	D23-S25 PolarHBondContact O-N 3.48Å; S25-Q27 VanDerWaalsContact C-N 3.32Å; S25-Q27 PolarHBondContact O-N 3.39Å
26	V	46	Very low	45.7	Very low	137 Å²	137	142.9 Å²	142.9	83%	0.83	75%	0.753	S	S	*	*			trans	-65.2	91.9	171.3	179.9	0	0	0	0	108.7	D24 I28	D24-V26 PolarHBondContact O-N 3.32Å; V26-I28 PolarHBondContact O-N 3.37Å
27	Q	45.8	Very low	46.5	Very low	175 Å²	175	139.8 Å²	139.8	82%	0.818	74%	0.738	S	S	*	*			trans	-72.8	105.3	169.6	-76.9	-174.1	-7.8	0	0	109.1	S25 S29	S25-Q27 VanDerWaalsContact C-N 3.32Å; S25-Q27 PolarHBondContact O-N 3.39Å; Q27-S29 PolarHBondContact O-N 3.35Å; Q27-S29 VanDerWaalsContact O-N 3.16Å
28	I	49.5	Very low	47.5	Very low	158 Å²	158	139.5 Å²	139.5	81%	0.81	72%	0.724	S	S	*	*			trans	-66.6	112.3	166	-59.6	173.9	0	0	0	107	V26	V26-I28 PolarHBondContact O-N 3.37Å
29	S	64.5	Low	49	Very low	82 Å²	82	139.7 Å²	139.7	57%	0.573	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-60.8	148.5	174.4	60.4	0	0	0	0	110.4	Q27	Q27-S29 PolarHBondContact O-N 3.35Å; Q27-S29 VanDerWaalsContact O-N 3.16Å
30	R	56.9	Low	50.5	Low	227 Å²	227	132.8 Å²	132.8	86%	0.857	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-54.8	143.5	164.5	-68.2	-176.1	178.9	-175.3	-0.5	108.8	Y32	R30-Y32 PolarHBondContact O-N 3.03Å
31	P	51.1	Low	52	Low	98 Å²	98	127 Å²	127	64%	0.636	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-54.5	117.9	177.6	21.5	-31.6	0	0	0	109.2	T34	P31-T34 HydrophobicContact CB-CG2 3.81Å; P31-T34 HydrophobicContact CG-CG2 4.13Å
32	Y	58.7	Low	53.6	Low	197 Å²	197	123.1 Å²	123.1	77%	0.773	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	145.3	174.5	67.3	-87.2	0	0	0	108.5	R30 T34	R30-Y32 PolarHBondContact O-N 3.03Å; Y32-T34 VanDerWaalsContact C-N 3.33Å; Y32-T34 PolarHBondContact O-N 2.81Å
33	N	49.2	Very low	55.3	Low	118 Å²	118	118.8 Å²	118.8	63%	0.631	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.7	36.3	177.4	-158.3	22.3	0	0	0	114.8	R35	N33-R35 PolarHBondContact O-N 3.46Å; N33-R35 VanDerWaalsContact O-N 3.09Å
34	T	47.1	Very low	57.1	Low	101 Å²	101	118.3 Å²	118.3	62%	0.62	59%	0.585	S	S	*	*			trans	-63.1	110.6	169.4	20.6	0	0	0	0	109.8	P31 Y32	P31-T34 HydrophobicContact CB-CG2 3.81Å; P31-T34 HydrophobicContact CG-CG2 4.13Å; Y32-T34 VanDerWaalsContact C-N 3.33Å; Y32-T34 PolarHBondContact O-N 2.81Å
35	R	46.3	Very low	58.4	Low	181 Å²	181	117.3 Å²	117.3	68%	0.683	59%	0.585	S	S	*	*			trans	-98.3	106.6	173.2	-66	-175.9	-179.3	-167.2	-1	109.1	N33 E37	N33-R35 PolarHBondContact O-N 3.46Å; N33-R35 VanDerWaalsContact O-N 3.09Å; R35-E37 VanDerWaalsContact C-N 3.29Å; R35-E37 HydrophobicContact CB-CG 4.49Å; R35-E37 PolarHBondContact O-N 3.22Å
36	H	50.1	Low	59.9	Low	159 Å²	159	117 Å²	117	74%	0.736	58%	0.58	S	S	*	*			trans	-71.3	92.7	159	-91	81	0	0	0	107.1	F38	H36-F38 VanDerWaalsContact C-N 3.31Å; H36-F38 PolarHBondContact O-N 3.38Å
37	E	52.8	Low	61.2	Low	120 Å²	120	111.3 Å²	111.3	56%	0.561	55%	0.549	S	S	*	.			trans	-62.6	-40	-175.3	-68.3	-170.4	150.2	0	0	111.6	R35 K88	R35-E37 VanDerWaalsContact C-N 3.29Å; R35-E37 HydrophobicContact CB-CG 4.49Å; R35-E37 PolarHBondContact O-N 3.22Å; E37-K88 IonicContact OE2-NZ 3.86Å; E37-K88 PolarHBondContact OE2-NZ 3.2Å
38	F	57	Low	62.7	Low	102 Å²	102	109.3 Å²	109.3	45%	0.447	54%	0.539	S	S	.	.			trans	-151.6	120.1	-179.3	-54.8	-72	0	0	0	111.7	H36 P53	H36-F38 VanDerWaalsContact C-N 3.31Å; H36-F38 PolarHBondContact O-N 3.38Å; F38-P53 HydrophobicContact CD1-CB 4.49Å; F38-P53 HydrophobicContact CD1-CG 3.55Å; F38-P53 HydrophobicContact CD2-CG 4.43Å; F38-P53 HydrophobicContact CE1-CB 4.08Å; F38-P53 HydrophobicContact CE1-CG 3.49Å; F38-P53 VanDerWaalsContact CE1-CG 3.49Å; F38-P53 HydrophobicContact CE2-CG 4.35Å; F38-P53 HydrophobicContact CG-CG 4.06Å; F38-P53 HydrophobicContact CZ-CG 3.91Å
39	H	66	Low	63.9	Low	110 Å²	110	102.4 Å²	102.4	51%	0.509	50%	0.503	S	S	.	.			trans	-110.6	100.9	165.9	180	86.2	0	0	0	108.3	G41 S50 G51	H39-G41 PolarHBondContact O-N 3.14Å; H39-G41 VanDerWaalsContact O-N 3.17Å; H39-S50 VanDerWaalsContact O-O 3.12Å; H39-G51 WeakPolarHBondContact O-CA 2.82Å
40	I	69.5	Low	64.4	Low	12 Å²	12	101.4 Å²	101.4	6%	0.062	50%	0.496	C	S	.	.			trans	-77.6	102.8	178.5	-57.3	178.5	0	0	0	108.8	F49 S50 V52 W56 V77 L80 K81	I40-F49 HydrophobicContact CG2-CD1 4.43Å; I40-S50 VanDerWaalsContact CA-O 3.31Å; I40-S50 WeakPolarHBondContact CA-O 3.41Å; I40-V52 HydrophobicContact CB-CG2 4.22Å; I40-V52 HydrophobicContact CD1-CG2 4.19Å; I40-V52 HydrophobicContact CG1-CG2 3.89Å; I40-V52 HydrophobicContact CG2-CG2 3.56Å; I40-W56 HydrophobicContact CD1-CE3 4.15Å; I40-W56 HydrophobicContact CD1-CZ3 4.02Å; I40-V77 HydrophobicContact CG2-CG1 4.26Å; I40-V77 HydrophobicContact CG2-CG2 4.29Å; I40-L80 HydrophobicContact CD1-CB 4.04Å; I40-L80 HydrophobicContact CG2-CD1 4.35Å; I40-K81 HydrophobicContact CD1-CG 4.49Å
41	G	68.1	Low	65.1	Low	14 Å²	14	92.7 Å²	92.7	14%	0.144	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	164.9	170.7	0	0	0	0	0	111.4	H39 F49 S50	H39-G41 PolarHBondContact O-N 3.14Å; H39-G41 VanDerWaalsContact O-N 3.17Å; G41-F49 CarbonylContact O-C 3.57Å; G41-F49 VanDerWaalsContact O-CA 3.29Å; G41-F49 WeakPolarHBondContact O-CA 3.48Å; G41-S50 PolarHBondContact N-O 3.01Å; G41-S50 PolarHBondContact O-N 3.14Å
42	Y	76.6	Confident	66.1	Low	54 Å²	54	88.8 Å²	88.8	21%	0.212	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	117.1	166.5	176.7	-101.3	0	0	0	108	Q44 G47 F49 P73	Y42-Q44 HydrophobicContact CD1-CG 4.12Å; Y42-Q44 HydrophobicContact CE1-CG 4.28Å; Y42-Q44 PolarHBondContact O-N 2.83Å; Y42-G47 WeakPolarHBondContact CE2-O 3.35Å; Y42-G47 WeakPolarHBondContact OH-CA 3.27Å; Y42-F49 HydrophobicContact CD2-CD1 4.02Å; Y42-F49 HydrophobicContact CD2-CD2 4.24Å; Y42-F49 AromaticContact CD2-CE1 3.71Å; Y42-F49 HydrophobicContact CD2-CE1 3.71Å; Y42-F49 AromaticContact CD2-CE2 3.92Å; Y42-F49 HydrophobicContact CD2-CE2 3.92Å; Y42-F49 HydrophobicContact CD2-CG 4.27Å; Y42-F49 AromaticContact CD2-CZ 3.64Å; Y42-F49 HydrophobicContact CD2-CZ 3.64Å; Y42-F49 HydrophobicContact CE2-CE2 4.12Å; Y42-F49 HydrophobicContact CE2-CZ 4.08Å; Y42-F49 HydrophobicContact CG-CE1 4.35Å; Y42-P73 HydrophobicContact CD1-CB 3.44Å; Y42-P73 VanDerWaalsContact CD1-CB 3.44Å; Y42-P73 HydrophobicContact CD1-CG 3.75Å; Y42-P73 HydrophobicContact CD2-CB 3.63Å; Y42-P73 HydrophobicContact CE1-CB 3.55Å; Y42-P73 HydrophobicContact CE1-CG 3.62Å; Y42-P73 HydrophobicContact CE2-CB 3.73Å; Y42-P73 HydrophobicContact CG-CB 3.46Å; Y42-P73 VanDerWaalsContact CG-CB 3.46Å; Y42-P73 HydrophobicContact CG-CG 4.29Å
43	N	77.4	Confident	66.7	Low	66 Å²	66	80.7 Å²	80.7	35%	0.353	42%	0.423	S	S	.	.			trans	-79.9	109.2	175.7	-176.7	-23.8	0	0	0	108.5	V45 T46 G47 E48	N43-V45 PolarHBondContact O-N 2.99Å; N43-V45 WeakPolarHBondContact OD1-CA 3.33Å; N43-V45 WeakPolarHBondContact OD1-CB 3.34Å; N43-V45 PolarHBondContact OD1-N 2.99Å; N43-T46 VanDerWaalsContact CB-OG1 3.32Å; N43-T46 WeakPolarHBondContact CB-OG1 3.37Å; N43-T46 VanDerWaalsContact CG-OG1 3.28Å; N43-T46 PolarHBondContact ND2-OG1 3.47Å; N43-T46 PolarHBondContact OD1-N 3.11Å; N43-G47 VanDerWaalsContact O-CA 3.3Å; N43-G47 WeakPolarHBondContact O-CA 3.47Å; N43-G47 PolarHBondContact O-N 3.14Å; N43-E48 PolarHBondContact N-O 2.99Å
44	Q	75.4	Confident	67.8	Low	134 Å²	134	82.2 Å²	82.2	63%	0.626	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-23.9	-178.7	-63.5	-175.2	15	0	0	113.3	Y42	Y42-Q44 HydrophobicContact CD1-CG 4.12Å; Y42-Q44 HydrophobicContact CE1-CG 4.28Å; Y42-Q44 PolarHBondContact O-N 2.83Å
45	V	74.3	Confident	69.1	Low	139 Å²	139	84.3 Å²	84.3	84%	0.842	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-47.6	-178.2	-176.3	0	0	0	0	110.9	N43	N43-V45 PolarHBondContact O-N 2.99Å; N43-V45 WeakPolarHBondContact OD1-CA 3.33Å; N43-V45 WeakPolarHBondContact OD1-CB 3.34Å; N43-V45 PolarHBondContact OD1-N 2.99Å
46	T	76.8	Confident	70.3	Confident	74 Å²	74	77.2 Å²	77.2	45%	0.454	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-21.3	180	64.4	0	0	0	0	112.6	N43 E48	N43-T46 VanDerWaalsContact CB-OG1 3.32Å; N43-T46 WeakPolarHBondContact CB-OG1 3.37Å; N43-T46 VanDerWaalsContact CG-OG1 3.28Å; N43-T46 PolarHBondContact ND2-OG1 3.47Å; N43-T46 PolarHBondContact OD1-N 3.11Å; T46-E48 PolarHBondContact O-N 3.3Å; T46-E48 WeakPolarHBondContact OG1-CB 3.39Å; T46-E48 PolarHBondContact OG1-N 3.44Å
47	G	73.4	Confident	71.4	Confident	17 Å²	17	72.1 Å²	72.1	18%	0.175	38%	0.378	C	S	.	.			trans	72.4	12.2	-170.7	0	0	0	0	0	113.4	Y42 N43	Y42-G47 WeakPolarHBondContact CE2-O 3.35Å; Y42-G47 WeakPolarHBondContact OH-CA 3.27Å; N43-G47 VanDerWaalsContact O-CA 3.3Å; N43-G47 WeakPolarHBondContact O-CA 3.47Å; N43-G47 PolarHBondContact O-N 3.14Å
48	E	75.9	Confident	72.5	Confident	132 Å²	132	73.3 Å²	73.3	62%	0.617	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-102.4	147.9	-176.2	-60.9	177.7	153	0	0	111.6	N43 T46	N43-E48 PolarHBondContact N-O 2.99Å; T46-E48 PolarHBondContact O-N 3.3Å; T46-E48 WeakPolarHBondContact OG1-CB 3.39Å; T46-E48 PolarHBondContact OG1-N 3.44Å
49	F	75.7	Confident	73.3	Confident	14 Å²	14	69.7 Å²	69.7	6%	0.061	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	125.6	172.5	-65.7	-91.8	0	0	0	110.1	I40 G41 Y42 V52 L60 Q69 P73 V76 V77 L80	I40-F49 HydrophobicContact CG2-CD1 4.43Å; G41-F49 CarbonylContact O-C 3.57Å; G41-F49 VanDerWaalsContact O-CA 3.29Å; G41-F49 WeakPolarHBondContact O-CA 3.48Å; Y42-F49 HydrophobicContact CD2-CD1 4.02Å; Y42-F49 HydrophobicContact CD2-CD2 4.24Å; Y42-F49 AromaticContact CD2-CE1 3.71Å; Y42-F49 HydrophobicContact CD2-CE1 3.71Å; Y42-F49 AromaticContact CD2-CE2 3.92Å; Y42-F49 HydrophobicContact CD2-CE2 3.92Å; Y42-F49 HydrophobicContact CD2-CG 4.27Å; Y42-F49 AromaticContact CD2-CZ 3.64Å; Y42-F49 HydrophobicContact CD2-CZ 3.64Å; Y42-F49 HydrophobicContact CE2-CE2 4.12Å; Y42-F49 HydrophobicContact CE2-CZ 4.08Å; Y42-F49 HydrophobicContact CG-CE1 4.35Å; F49-V52 HydrophobicContact CB-CG2 3.7Å; F49-L60 HydrophobicContact CD2-CD2 3.7Å; F49-L60 HydrophobicContact CE2-CD2 3.88Å; F49-L60 HydrophobicContact CG-CD2 4.28Å; F49-Q69 HydrophobicContact CE2-CB 4.13Å; F49-Q69 HydrophobicContact CE2-CG 4.3Å; F49-Q69 VanDerWaalsContact CE2-OE1 3.25Å; F49-Q69 HydrophobicContact CZ-CB 4.48Å; F49-P73 HydrophobicContact CZ-CB 4.49Å; F49-V76 HydrophobicContact CE1-CB 3.91Å; F49-V76 HydrophobicContact CE1-CG1 3.61Å; F49-V76 HydrophobicContact CE2-CG1 4Å; F49-V76 HydrophobicContact CZ-CB 3.61Å; F49-V76 HydrophobicContact CZ-CG1 3.33Å; F49-V76 HydrophobicContact CZ-CG2 4.25Å; F49-V77 HydrophobicContact CD1-CG2 4.04Å; F49-V77 HydrophobicContact CE1-CG2 3.72Å; F49-L80 HydrophobicContact CD1-CD1 4.4Å
50	S	74.5	Confident	73.9	Confident	60 Å²	60	64.4 Å²	64.4	42%	0.42	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	150.7	175.6	58.6	0	0	0	0	110.9	H39 I40 G41 V52	H39-S50 VanDerWaalsContact O-O 3.12Å; I40-S50 VanDerWaalsContact CA-O 3.31Å; I40-S50 WeakPolarHBondContact CA-O 3.41Å; G41-S50 PolarHBondContact N-O 3.01Å; G41-S50 PolarHBondContact O-N 3.14Å; S50-V52 PolarHBondContact O-N 3.14Å
51	G	71.8	Confident	74.3	Confident	44 Å²	44	68.3 Å²	68.3	45%	0.454	36%	0.359	S	S	.	.	S	Bend	trans	67.3	14.1	174.9	0	0	0	0	0	116.2	H39	H39-G51 WeakPolarHBondContact O-CA 2.82Å
52	V	71.1	Confident	74.9	Confident	17 Å²	17	72 Å²	72	10%	0.103	38%	0.383	C	S	.	.			trans	-85.9	126.2	172	-178.5	0	0	0	0	108.9	I40 F49 S50 E54 W56 L57 L80	I40-V52 HydrophobicContact CB-CG2 4.22Å; I40-V52 HydrophobicContact CD1-CG2 4.19Å; I40-V52 HydrophobicContact CG1-CG2 3.89Å; I40-V52 HydrophobicContact CG2-CG2 3.56Å; F49-V52 HydrophobicContact CB-CG2 3.7Å; S50-V52 PolarHBondContact O-N 3.14Å; V52-E54 PolarHBondContact O-N 3.22Å; V52-W56 HydrophobicContact CG1-CB 3.52Å; V52-W56 HydrophobicContact CG1-CE3 4.47Å; V52-L57 HydrophobicContact CB-CD1 4.17Å; V52-L57 HydrophobicContact CG1-CB 4.13Å; V52-L57 HydrophobicContact CG1-CD1 4.48Å; V52-L80 HydrophobicContact CG2-CD1 4.25Å
53	P	72.7	Confident	75	Confident	26 Å²	26	71.9 Å²	71.9	17%	0.169	38%	0.384	C	S	.	.			trans	-52.3	138.7	171.4	-16.3	20.9	0	0	0	111.3	F38 K55 W56 L57	F38-P53 HydrophobicContact CD1-CB 4.49Å; F38-P53 HydrophobicContact CD1-CG 3.55Å; F38-P53 HydrophobicContact CD2-CG 4.43Å; F38-P53 HydrophobicContact CE1-CB 4.08Å; F38-P53 HydrophobicContact CE1-CG 3.49Å; F38-P53 VanDerWaalsContact CE1-CG 3.49Å; F38-P53 HydrophobicContact CE2-CG 4.35Å; F38-P53 HydrophobicContact CG-CG 4.06Å; F38-P53 HydrophobicContact CZ-CG 3.91Å; P53-K55 PolarHBondContact O-N 3.05Å; P53-W56 HydrophobicContact CB-CD2 4.3Å; P53-W56 HydrophobicContact CB-CG 4.25Å; P53-W56 VanDerWaalsContact CD-CE3 3.43Å; P53-W56 HydrophobicContact CG-CD2 3.62Å; P53-W56 HydrophobicContact CG-CE3 3.7Å; P53-W56 HydrophobicContact CG-CG 4.08Å; P53-W56 HydrophobicContact CG-CH2 4.12Å; P53-W56 HydrophobicContact CG-CZ2 4.13Å; P53-W56 HydrophobicContact CG-CZ3 3.92Å; P53-W56 WeakPolarHBondContact O-CA 3.36Å; P53-W56 WeakPolarHBondContact O-CB 3.41Å; P53-W56 PolarHBondContact O-N 3.46Å; P53-L57 PolarHBondContact O-N 3.07Å
54	E	71.7	Confident	75.1	Confident	150 Å²	150	68.8 Å²	68.8	70%	0.701	37%	0.368	S	S	*	.	H	α-helix	trans	-52.3	-38	-176.3	-72	-173.4	-177.2	0	0	113.8	V52 W56 L57 K58	V52-E54 PolarHBondContact O-N 3.22Å; E54-W56 PolarHBondContact O-N 3.05Å; E54-L57 PolarHBondContact O-N 3.31Å; E54-K58 WeakPolarHBondContact O-CG 3.34Å; E54-K58 PolarHBondContact O-N 3.48Å
55	K	74.1	Confident	75.5	Confident	146 Å²	146	65.1 Å²	65.1	64%	0.635	36%	0.357	S	S	*	.	H	α-helix	trans	-59	-37.9	176.6	-174.4	179.2	177.8	-174.6	0	111.6	P53 M59	P53-K55 PolarHBondContact O-N 3.05Å; K55-M59 WeakPolarHBondContact O-CB 3.1Å; K55-M59 PolarHBondContact O-N 2.97Å; K55-M59 VanDerWaalsContact O-N 3.12Å
56	W	70.9	Confident	75.8	Confident	32 Å²	32	64.5 Å²	64.5	12%	0.121	35%	0.345	C	S	.	.	H	α-helix	trans	-77.6	-34.1	178.4	-62.7	4.4	0	0	0	111.5	I40 V52 P53 E54 M59 L60 A84	I40-W56 HydrophobicContact CD1-CE3 4.15Å; I40-W56 HydrophobicContact CD1-CZ3 4.02Å; V52-W56 HydrophobicContact CG1-CB 3.52Å; V52-W56 HydrophobicContact CG1-CE3 4.47Å; P53-W56 HydrophobicContact CB-CD2 4.3Å; P53-W56 HydrophobicContact CB-CG 4.25Å; P53-W56 VanDerWaalsContact CD-CE3 3.43Å; P53-W56 HydrophobicContact CG-CD2 3.62Å; P53-W56 HydrophobicContact CG-CE3 3.7Å; P53-W56 HydrophobicContact CG-CG 4.08Å; P53-W56 HydrophobicContact CG-CH2 4.12Å; P53-W56 HydrophobicContact CG-CZ2 4.13Å; P53-W56 HydrophobicContact CG-CZ3 3.92Å; P53-W56 WeakPolarHBondContact O-CA 3.36Å; P53-W56 WeakPolarHBondContact O-CB 3.41Å; P53-W56 PolarHBondContact O-N 3.46Å; E54-W56 PolarHBondContact O-N 3.05Å; W56-M59 PolarHBondContact O-N 3.38Å; W56-L60 VanDerWaalsContact O-CB 3.25Å; W56-L60 WeakPolarHBondContact O-CB 3.32Å; W56-L60 PolarHBondContact O-N 2.92Å; W56-A84 HydrophobicContact CE3-CB 4.18Å; W56-A84 HydrophobicContact CH2-CB 3.17Å; W56-A84 HydrophobicContact CZ2-CB 3.91Å; W56-A84 HydrophobicContact CZ3-CB 3.32Å
57	L	73.4	Confident	76.1	Confident	51 Å²	51	64.4 Å²	64.4	27%	0.267	35%	0.351	S	S	.	.	H	α-helix	trans	-66.9	-43.9	175.7	-157.7	128	0	0	0	111.1	V52 P53 E54 M59 L60 H61	V52-L57 HydrophobicContact CB-CD1 4.17Å; V52-L57 HydrophobicContact CG1-CB 4.13Å; V52-L57 HydrophobicContact CG1-CD1 4.48Å; P53-L57 PolarHBondContact O-N 3.07Å; E54-L57 PolarHBondContact O-N 3.31Å; L57-M59 VanDerWaalsContact C-N 3.33Å; L57-M59 PolarHBondContact O-N 3.19Å; L57-L60 WeakPolarHBondContact O-CB 3.41Å; L57-L60 PolarHBondContact O-N 3.44Å; L57-H61 WeakPolarHBondContact CD2-CE1 3.48Å; L57-H61 PolarHBondContact O-CD2 3.28Å; L57-H61 VanDerWaalsContact O-CG 3.28Å; L57-H61 PolarHBondContact O-N 3.1Å
58	K	75.6	Confident	76.5	Confident	145 Å²	145	66 Å²	66	63%	0.63	36%	0.356	S	S	*	.	H	α-helix	trans	-58.1	-44.9	170.7	-72.5	176.2	-176.3	172.2	0	111.7	E54 S62	E54-K58 WeakPolarHBondContact O-CG 3.34Å; E54-K58 PolarHBondContact O-N 3.48Å; K58-S62 WeakPolarHBondContact O-CB 3.11Å; K58-S62 PolarHBondContact O-N 2.95Å; K58-S62 PolarHBondContact O-OG 2.98Å
59	M	75	Confident	76.8	Confident	26 Å²	26	60.2 Å²	60.2	13%	0.128	33%	0.329	C	S	.	.	H	α-helix	trans	-66	-41.4	177.7	-176	-171.3	61.5	0	0	112	K55 W56 L57 S62 Q63 Y83 L448	K55-M59 WeakPolarHBondContact O-CB 3.1Å; K55-M59 PolarHBondContact O-N 2.97Å; K55-M59 VanDerWaalsContact O-N 3.12Å; W56-M59 PolarHBondContact O-N 3.38Å; L57-M59 VanDerWaalsContact C-N 3.33Å; L57-M59 PolarHBondContact O-N 3.19Å; M59-S62 WeakPolarHBondContact CA-OG 3.4Å; M59-S62 PolarHBondContact O-N 3.41Å; M59-S62 PolarHBondContact O-OG 3.44Å; M59-Q63 HydrophobicContact CG-CG 4.48Å; M59-Q63 WeakPolarHBondContact O-CB 3.5Å; M59-Q63 WeakPolarHBondContact O-CG 3.43Å; M59-Q63 PolarHBondContact O-N 2.94Å; M59-Q63 VanDerWaalsContact O-N 3.08Å; M59-Y83 HydrophobicContact CE-CD1 3.29Å; M59-Y83 HydrophobicContact CE-CE1 3.17Å; M59-Y83 HydrophobicContact CE-CG 4.21Å; M59-Y83 HydrophobicContact SD-CD1 3.99Å; M59-Y83 HydrophobicContact SD-CE1 3.21Å; M59-Y83 WeakPolarHBondContact SD-CE1 3.35Å; M59-Y83 VanDerWaalsContact SD-CZ 3.58Å; M59-L448 HydrophobicContact CE-CD2 3.54Å
60	L	78	Confident	77.1	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-58.2	-52.4	175.9	176.4	67.8	0	0	0	110.4	F49 W56 L57 S62 Q63 I64 V76 L80	F49-L60 HydrophobicContact CD2-CD2 3.7Å; F49-L60 HydrophobicContact CE2-CD2 3.88Å; F49-L60 HydrophobicContact CG-CD2 4.28Å; W56-L60 VanDerWaalsContact O-CB 3.25Å; W56-L60 WeakPolarHBondContact O-CB 3.32Å; W56-L60 PolarHBondContact O-N 2.92Å; L57-L60 WeakPolarHBondContact O-CB 3.41Å; L57-L60 PolarHBondContact O-N 3.44Å; L60-S62 PolarHBondContact O-N 3.44Å; L60-Q63 PolarHBondContact O-N 3.36Å; L60-I64 HydrophobicContact CD1-CB 4.15Å; L60-I64 HydrophobicContact CD1-CD1 3.74Å; L60-I64 HydrophobicContact CD1-CG1 4.12Å; L60-I64 PolarHBondContact O-N 3.2Å; L60-V76 HydrophobicContact CD1-CG1 3.4Å; L60-V76 HydrophobicContact CD2-CG1 4.05Å; L60-V76 HydrophobicContact CG-CG1 4.34Å; L60-L80 HydrophobicContact CB-CD2 4.36Å; L60-L80 HydrophobicContact CD1-CD1 4.32Å; L60-L80 HydrophobicContact CD1-CD2 4.23Å; L60-L80 HydrophobicContact CD1-CG 4.34Å; L60-L80 HydrophobicContact CD2-CD1 4.04Å
61	H	78.6	Confident	77.6	Confident	93 Å²	93	69.7 Å²	69.7	43%	0.431	36%	0.363	S	S	.	.	H	α-helix	trans	-63.8	-29.2	179.8	-64.7	-175.1	0	0	0	112.1	L57	L57-H61 WeakPolarHBondContact CD2-CE1 3.48Å; L57-H61 PolarHBondContact O-CD2 3.28Å; L57-H61 VanDerWaalsContact O-CG 3.28Å; L57-H61 PolarHBondContact O-N 3.1Å
62	S	80	Confident	78	Confident	91 Å²	91	69.6 Å²	69.6	64%	0.636	35%	0.352	S	S	*	.	H	α-helix	trans	-76	-21.7	175	74.1	0	0	0	0	114.3	K58 M59 L60	K58-S62 WeakPolarHBondContact O-CB 3.11Å; K58-S62 PolarHBondContact O-N 2.95Å; K58-S62 PolarHBondContact O-OG 2.98Å; M59-S62 WeakPolarHBondContact CA-OG 3.4Å; M59-S62 PolarHBondContact O-N 3.41Å; M59-S62 PolarHBondContact O-OG 3.44Å; L60-S62 PolarHBondContact O-N 3.44Å
63	Q	79.4	Confident	78.6	Confident	52 Å²	52	70.1 Å²	70.1	24%	0.243	36%	0.356	C	S	.	.	H	α-helix	trans	-114.1	-27.5	-171.5	-68.1	-178.4	23.3	0	0	113.7	M59 L60 A446 K449	M59-Q63 HydrophobicContact CG-CG 4.48Å; M59-Q63 WeakPolarHBondContact O-CB 3.5Å; M59-Q63 WeakPolarHBondContact O-CG 3.43Å; M59-Q63 PolarHBondContact O-N 2.94Å; M59-Q63 VanDerWaalsContact O-N 3.08Å; L60-Q63 PolarHBondContact O-N 3.36Å; Q63-A446 HydrophobicContact CG-CB 4.29Å; Q63-A446 VanDerWaalsContact OE1-CB 3.3Å; Q63-K449 WeakPolarHBondContact O-CD 3.29Å
64	I	78.9	Confident	79	Confident	1 Å²	1	75.7 Å²	75.7	1%	0.005	37%	0.373	C	S	.	.	S	Bend	trans	-128.7	120.9	-178	-50.7	-175.3	0	0	0	108	L60 D68 Q69 V76 K449 Y452	L60-I64 HydrophobicContact CD1-CB 4.15Å; L60-I64 HydrophobicContact CD1-CD1 3.74Å; L60-I64 HydrophobicContact CD1-CG1 4.12Å; L60-I64 PolarHBondContact O-N 3.2Å; I64-D68 HydrophobicContact CG2-CB 3.61Å; I64-Q69 HydrophobicContact CB-CG 4.14Å; I64-Q69 HydrophobicContact CG2-CG 3.69Å; I64-Q69 PolarHBondContact O-NE2 3.46Å; I64-V76 HydrophobicContact CD1-CG2 4.3Å; I64-V76 HydrophobicContact CG2-CG2 4.43Å; I64-K449 HydrophobicContact CG1-CD 3.96Å; I64-Y452 HydrophobicContact CD1-CD1 4.38Å; I64-Y452 HydrophobicContact CD1-CD2 4.06Å; I64-Y452 HydrophobicContact CD1-CG 3.77Å; I64-Y452 HydrophobicContact CG2-CD1 4.47Å; I64-Y452 HydrophobicContact CG2-CE1 4.38Å; I64-Y452 HydrophobicContact CG2-CE2 4.45Å
65	S	83.2	Confident	79.5	Confident	57 Å²	57	68.6 Å²	68.6	40%	0.399	34%	0.34	S	S	.	.			trans	-62.4	151.6	179.3	72.2	0	0	0	0	111.4	A67 D68 Q69	S65-A67 PolarHBondContact O-N 2.95Å; S65-D68 WeakPolarHBondContact O-CB 3.13Å; S65-D68 PolarHBondContact O-N 2.94Å; S65-D68 VanDerWaalsContact O-N 3.08Å; S65-D68 WeakPolarHBondContact OG-CB 3.48Å; S65-D68 PolarHBondContact OG-N 3.43Å; S65-D68 VanDerWaalsContact OG-N 3.15Å; S65-D68 PolarHBondContact OG-OD2 2.92Å; S65-Q69 WeakPolarHBondContact O-CG 3.5Å; S65-Q69 PolarHBondContact O-N 2.6Å
66	E	81.8	Confident	79.9	Confident	126 Å²	126	61.7 Å²	61.7	59%	0.589	31%	0.31	S	S	*	.	H	α-helix	trans	-58.6	-33.4	177.3	-68.3	-178.1	-175.1	0	0	112.5	Q69 K70	E66-Q69 PolarHBondContact O-N 3.49Å; E66-K70 WeakPolarHBondContact O-CG 3.39Å; E66-K70 PolarHBondContact O-N 3.19Å
67	A	82.3	Confident	80.4	Confident	72 Å²	72	60.9 Å²	60.9	60%	0.595	31%	0.309	S	S	*	.	H	α-helix	trans	-63.8	-44.6	174.7	0	0	0	0	0	111.8	S65 Q69 K70 K71	S65-A67 PolarHBondContact O-N 2.95Å; A67-Q69 VanDerWaalsContact C-N 3.34Å; A67-K70 PolarHBondContact O-N 3.41Å; A67-K71 WeakPolarHBondContact O-CB 3.39Å; A67-K71 PolarHBondContact O-N 3.37Å
68	D	81.9	Confident	80.6	Confident	52 Å²	52	60.7 Å²	60.7	28%	0.278	31%	0.306	S	S	.	.	H	α-helix	trans	-64.4	-39.1	175.3	-74.3	-18.6	0	0	0	111.8	I64 S65 K71 N72 K449 Y452	I64-D68 HydrophobicContact CG2-CB 3.61Å; S65-D68 WeakPolarHBondContact O-CB 3.13Å; S65-D68 PolarHBondContact O-N 2.94Å; S65-D68 VanDerWaalsContact O-N 3.08Å; S65-D68 WeakPolarHBondContact OG-CB 3.48Å; S65-D68 PolarHBondContact OG-N 3.43Å; S65-D68 VanDerWaalsContact OG-N 3.15Å; S65-D68 PolarHBondContact OG-OD2 2.92Å; D68-K71 WeakPolarHBondContact O-CB 3.49Å; D68-K71 PolarHBondContact O-N 3Å; D68-N72 PolarHBondContact O-N 3.46Å; D68-K449 IonicContact OD2-NZ 3.4Å; D68-K449 PolarHBondContact OD2-NZ 2.68Å; D68-Y452 HydrophobicContact CB-CE1 4.2Å; D68-Y452 WeakPolarHBondContact CB-OH 3.27Å; D68-Y452 PolarHBondContact O-OH 3.16Å
69	Q	82	Confident	80.8	Confident	9 Å²	9	53.8 Å²	53.8	4%	0.042	28%	0.276	C	S	.	.	H	α-helix	trans	-62.3	-45.3	177.9	-68.1	174.5	47.3	0	0	111.3	F49 I64 S65 E66 A67 K71 N72 P73 V76	F49-Q69 HydrophobicContact CE2-CB 4.13Å; F49-Q69 HydrophobicContact CE2-CG 4.3Å; F49-Q69 VanDerWaalsContact CE2-OE1 3.25Å; F49-Q69 HydrophobicContact CZ-CB 4.48Å; I64-Q69 HydrophobicContact CB-CG 4.14Å; I64-Q69 HydrophobicContact CG2-CG 3.69Å; I64-Q69 PolarHBondContact O-NE2 3.46Å; S65-Q69 WeakPolarHBondContact O-CG 3.5Å; S65-Q69 PolarHBondContact O-N 2.6Å; E66-Q69 PolarHBondContact O-N 3.49Å; A67-Q69 VanDerWaalsContact C-N 3.34Å; Q69-K71 VanDerWaalsContact C-N 3.33Å; Q69-K71 PolarHBondContact O-N 2.84Å; Q69-N72 CarbonylContact O-C 3.55Å; Q69-P73 WeakPolarHBondContact O-CA 3.47Å; Q69-P73 VanDerWaalsContact O-N 3.15Å; Q69-V76 HydrophobicContact CB-CG2 4.33Å; Q69-V76 HydrophobicContact CG-CG2 4.18Å
70	K	82.1	Confident	81	Confident	128 Å²	128	52.6 Å²	52.6	56%	0.557	27%	0.27	S	S	*	.	H	α-helix	trans	-67.3	-32.3	176.7	-72	175.4	-179.2	175.6	0	112.7	E66 A67 N72	E66-K70 WeakPolarHBondContact O-CG 3.39Å; E66-K70 PolarHBondContact O-N 3.19Å; A67-K70 PolarHBondContact O-N 3.41Å; K70-N72 PolarHBondContact O-N 3.1Å
71	K	84.6	Confident	80.8	Confident	146 Å²	146	55.3 Å²	55.3	64%	0.635	28%	0.282	S	S	*	.	H	α-helix	trans	-63	-38.8	179.3	-174.2	178.3	178.7	-179.2	0	112.6	A67 D68 Q69	A67-K71 WeakPolarHBondContact O-CB 3.39Å; A67-K71 PolarHBondContact O-N 3.37Å; D68-K71 WeakPolarHBondContact O-CB 3.49Å; D68-K71 PolarHBondContact O-N 3Å; Q69-K71 VanDerWaalsContact C-N 3.33Å; Q69-K71 PolarHBondContact O-N 2.84Å
72	N	81.3	Confident	80.3	Confident	41 Å²	41	51 Å²	51	22%	0.219	26%	0.262	C	S	.	.			trans	-150.3	83.8	174.4	-170.1	-13.6	0	0	0	111.7	D68 Q69 K70 R74 A75 V76 Q456	D68-N72 PolarHBondContact O-N 3.46Å; Q69-N72 CarbonylContact O-C 3.55Å; K70-N72 PolarHBondContact O-N 3.1Å; N72-R74 PolarHBondContact O-N 2.69Å; N72-R74 PolarHBondContact OD1-N 2.82Å; N72-A75 HydrophobicContact CB-CB 4.05Å; N72-A75 VanDerWaalsContact CG-CB 3.46Å; N72-A75 WeakPolarHBondContact ND2-CB 3.47Å; N72-A75 PolarHBondContact O-N 2.88Å; N72-A75 PolarHBondContact OD1-N 3.44Å; N72-V76 PolarHBondContact O-N 2.84Å; N72-Q456 VanDerWaalsContact CG-OE1 3.23Å; N72-Q456 PolarHBondContact ND2-OE1 2.98Å
73	P	82.7	Confident	80	Confident	29 Å²	29	49.4 Å²	49.4	19%	0.188	24%	0.243	C	C	.	.	H	α-helix	trans	-64.5	-31.6	-179.1	24	-33.5	0	0	0	112	Y42 F49 Q69 A75 V76 V77	Y42-P73 HydrophobicContact CD1-CB 3.44Å; Y42-P73 VanDerWaalsContact CD1-CB 3.44Å; Y42-P73 HydrophobicContact CD1-CG 3.75Å; Y42-P73 HydrophobicContact CD2-CB 3.63Å; Y42-P73 HydrophobicContact CE1-CB 3.55Å; Y42-P73 HydrophobicContact CE1-CG 3.62Å; Y42-P73 HydrophobicContact CE2-CB 3.73Å; Y42-P73 HydrophobicContact CG-CB 3.46Å; Y42-P73 VanDerWaalsContact CG-CB 3.46Å; Y42-P73 HydrophobicContact CG-CG 4.29Å; F49-P73 HydrophobicContact CZ-CB 4.49Å; Q69-P73 WeakPolarHBondContact O-CA 3.47Å; Q69-P73 VanDerWaalsContact O-N 3.15Å; P73-A75 PolarHBondContact O-N 2.79Å; P73-V76 PolarHBondContact O-N 2.85Å; P73-V77 WeakPolarHBondContact O-CG2 3.41Å; P73-V77 PolarHBondContact O-N 2.87Å
74	R	82.6	Confident	79.5	Confident	143 Å²	143	47.6 Å²	47.6	54%	0.54	24%	0.236	S	C	.	.	H	α-helix	trans	-62.4	-44.5	177.4	-70.2	-176.9	175.1	168.7	-0.7	111.5	N72 V76 V77 H78 I116	N72-R74 PolarHBondContact O-N 2.69Å; N72-R74 PolarHBondContact OD1-N 2.82Å; R74-V76 VanDerWaalsContact C-N 3.31Å; R74-V76 PolarHBondContact O-N 2.94Å; R74-V77 PolarHBondContact O-N 2.65Å; R74-H78 VanDerWaalsContact O-CG 3.28Å; R74-H78 PolarHBondContact O-N 3.06Å; R74-I116 PolarHBondContact NH2-O 2.9Å; R74-I116 VanDerWaalsContact NH2-O 3.14Å
75	A	81.5	Confident	78.9	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.008	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-39.3	175.7	0	0	0	0	0	112.1	N72 P73 H78 A79 Y452 A455	N72-A75 HydrophobicContact CB-CB 4.05Å; N72-A75 VanDerWaalsContact CG-CB 3.46Å; N72-A75 WeakPolarHBondContact ND2-CB 3.47Å; N72-A75 PolarHBondContact O-N 2.88Å; N72-A75 PolarHBondContact OD1-N 3.44Å; P73-A75 PolarHBondContact O-N 2.79Å; A75-H78 PolarHBondContact O-N 2.82Å; A75-A79 VanDerWaalsContact O-CB 3.32Å; A75-A79 WeakPolarHBondContact O-CB 3.43Å; A75-A79 PolarHBondContact O-N 3.45Å; A75-Y452 HydrophobicContact CB-CD2 3.95Å; A75-Y452 HydrophobicContact CB-CE2 4.13Å; A75-A455 HydrophobicContact CB-CB 3.82Å
76	V	82.5	Confident	77.9	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.9	-47.6	174.7	177.7	0	0	0	0	111.5	F49 L60 I64 Q69 N72 P73 R74 H78 A79 L80 Y452	F49-V76 HydrophobicContact CE1-CB 3.91Å; F49-V76 HydrophobicContact CE1-CG1 3.61Å; F49-V76 HydrophobicContact CE2-CG1 4Å; F49-V76 HydrophobicContact CZ-CB 3.61Å; F49-V76 HydrophobicContact CZ-CG1 3.33Å; F49-V76 HydrophobicContact CZ-CG2 4.25Å; L60-V76 HydrophobicContact CD1-CG1 3.4Å; L60-V76 HydrophobicContact CD2-CG1 4.05Å; L60-V76 HydrophobicContact CG-CG1 4.34Å; I64-V76 HydrophobicContact CD1-CG2 4.3Å; I64-V76 HydrophobicContact CG2-CG2 4.43Å; Q69-V76 HydrophobicContact CB-CG2 4.33Å; Q69-V76 HydrophobicContact CG-CG2 4.18Å; N72-V76 PolarHBondContact O-N 2.84Å; P73-V76 PolarHBondContact O-N 2.85Å; R74-V76 VanDerWaalsContact C-N 3.31Å; R74-V76 PolarHBondContact O-N 2.94Å; V76-H78 VanDerWaalsContact C-N 3.29Å; V76-H78 PolarHBondContact O-N 3.38Å; V76-A79 PolarHBondContact O-N 3.25Å; V76-L80 HydrophobicContact CG1-CD1 3.86Å; V76-L80 HydrophobicContact CG1-CG 4.22Å; V76-L80 WeakPolarHBondContact O-CB 3.01Å; V76-L80 WeakPolarHBondContact O-CG 3.5Å; V76-L80 PolarHBondContact O-N 3.46Å; V76-Y452 HydrophobicContact CG2-CD2 3.6Å; V76-Y452 HydrophobicContact CG2-CE2 3.62Å
77	V	80.3	Confident	76.9	Confident	16 Å²	16	43.2 Å²	43.2	10%	0.097	22%	0.22	C	C	.	.	H	α-helix	trans	-57.3	-45.2	176.4	173.7	0	0	0	0	110.5	I40 F49 P73 R74 L80 K81	I40-V77 HydrophobicContact CG2-CG1 4.26Å; I40-V77 HydrophobicContact CG2-CG2 4.29Å; F49-V77 HydrophobicContact CD1-CG2 4.04Å; F49-V77 HydrophobicContact CE1-CG2 3.72Å; P73-V77 WeakPolarHBondContact O-CG2 3.41Å; P73-V77 PolarHBondContact O-N 2.87Å; R74-V77 PolarHBondContact O-N 2.65Å; V77-L80 PolarHBondContact O-N 3.36Å; V77-K81 HydrophobicContact CG1-CD 3.87Å; V77-K81 HydrophobicContact CG1-CG 4.19Å; V77-K81 VanDerWaalsContact O-CB 3.29Å; V77-K81 WeakPolarHBondContact O-CB 3.42Å; V77-K81 VanDerWaalsContact O-CG 3.26Å; V77-K81 WeakPolarHBondContact O-CG 3.39Å; V77-K81 PolarHBondContact O-N 2.96Å
78	H	78.9	Confident	75.8	Confident	46 Å²	46	44 Å²	44	21%	0.213	21%	0.21	C	C	.	.	H	α-helix	trans	-62.6	-46.3	178.1	-69.9	168.7	0	0	0	112.5	R74 A75 V76 K81 F82 N415	R74-H78 VanDerWaalsContact O-CG 3.28Å; R74-H78 PolarHBondContact O-N 3.06Å; A75-H78 PolarHBondContact O-N 2.82Å; V76-H78 VanDerWaalsContact C-N 3.29Å; V76-H78 PolarHBondContact O-N 3.38Å; H78-K81 PolarHBondContact O-N 3.2Å; H78-F82 WeakPolarHBondContact O-CB 3.37Å; H78-F82 PolarHBondContact O-N 3.13Å; H78-N415 PolarHBondContact CE1-O 3.25Å; H78-N415 WeakPolarHBondContact ND1-CA 3.49Å; H78-N415 PolarHBondContact ND1-OD1 3.26Å
79	A	80	Confident	74.4	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62	-43.3	177	0	0	0	0	0	111.7	A75 V76 F82 Y83 L448 L451	A75-A79 VanDerWaalsContact O-CB 3.32Å; A75-A79 WeakPolarHBondContact O-CB 3.43Å; A75-A79 PolarHBondContact O-N 3.45Å; V76-A79 PolarHBondContact O-N 3.25Å; A79-F82 WeakPolarHBondContact O-CB 3.46Å; A79-F82 PolarHBondContact O-N 3.1Å; A79-Y83 WeakPolarHBondContact O-CB 3.36Å; A79-Y83 PolarHBondContact O-N 2.67Å; A79-L448 HydrophobicContact CB-CD1 3.63Å; A79-L448 WeakPolarHBondContact O-CD1 3.29Å; A79-L451 HydrophobicContact CB-CB 3.94Å
80	L	78.6	Confident	73	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-63.8	-48.9	176	-76	172.7	0	0	0	111.7	I40 F49 V52 L60 V76 V77 F82 Y83 A84 L448	I40-L80 HydrophobicContact CD1-CB 4.04Å; I40-L80 HydrophobicContact CG2-CD1 4.35Å; F49-L80 HydrophobicContact CD1-CD1 4.4Å; V52-L80 HydrophobicContact CG2-CD1 4.25Å; L60-L80 HydrophobicContact CB-CD2 4.36Å; L60-L80 HydrophobicContact CD1-CD1 4.32Å; L60-L80 HydrophobicContact CD1-CD2 4.23Å; L60-L80 HydrophobicContact CD1-CG 4.34Å; L60-L80 HydrophobicContact CD2-CD1 4.04Å; V76-L80 HydrophobicContact CG1-CD1 3.86Å; V76-L80 HydrophobicContact CG1-CG 4.22Å; V76-L80 WeakPolarHBondContact O-CB 3.01Å; V76-L80 WeakPolarHBondContact O-CG 3.5Å; V76-L80 PolarHBondContact O-N 3.46Å; V77-L80 PolarHBondContact O-N 3.36Å; L80-F82 PolarHBondContact O-N 2.93Å; L80-Y83 PolarHBondContact O-N 3.46Å; L80-A84 WeakPolarHBondContact O-CB 3.25Å; L80-A84 PolarHBondContact O-N 3.01Å; L80-L448 HydrophobicContact CD2-CD1 4.15Å; L80-L448 HydrophobicContact CD2-CD2 3.9Å; L80-L448 HydrophobicContact CG-CD1 4.42Å
81	K	73	Confident	71.4	Confident	58 Å²	58	51 Å²	51	25%	0.252	24%	0.237	S	C	.	.	H	α-helix	trans	-57.9	-32	174.6	-74.2	-177.9	178.1	179.5	0	110.6	I40 V77 H78 A85 R416	I40-K81 HydrophobicContact CD1-CG 4.49Å; V77-K81 HydrophobicContact CG1-CD 3.87Å; V77-K81 HydrophobicContact CG1-CG 4.19Å; V77-K81 VanDerWaalsContact O-CB 3.29Å; V77-K81 WeakPolarHBondContact O-CB 3.42Å; V77-K81 VanDerWaalsContact O-CG 3.26Å; V77-K81 WeakPolarHBondContact O-CG 3.39Å; V77-K81 PolarHBondContact O-N 2.96Å; H78-K81 PolarHBondContact O-N 3.2Å; K81-A85 PolarHBondContact O-N 3.05Å; K81-R416 PolarHBondContact O-NH2 2.93Å
82	F	69.8	Low	69.4	Low	2 Å²	2	49.8 Å²	49.8	1%	0.009	23%	0.234	C	C	.	.	H	α-helix	trans	-71	-51.4	173.9	-177	-72.5	0	0	0	112.9	H78 A79 L80 A84 A85 S86 M402 P406 M409 L451	H78-F82 WeakPolarHBondContact O-CB 3.37Å; H78-F82 PolarHBondContact O-N 3.13Å; A79-F82 WeakPolarHBondContact O-CB 3.46Å; A79-F82 PolarHBondContact O-N 3.1Å; L80-F82 PolarHBondContact O-N 2.93Å; F82-A84 VanDerWaalsContact C-N 3.27Å; F82-A84 PolarHBondContact O-N 2.82Å; F82-A85 PolarHBondContact O-N 2.89Å; F82-S86 PolarHBondContact O-N 3.02Å; F82-M402 WeakPolarHBondContact CA-SD 3.37Å; F82-M402 HydrophobicContact CB-CE 3.84Å; F82-M402 HydrophobicContact CB-SD 3.63Å; F82-M402 HydrophobicContact CD2-CE 3.72Å; F82-M402 HydrophobicContact CD2-CG 3.16Å; F82-M402 HydrophobicContact CD2-SD 3.16Å; F82-M402 WeakPolarHBondContact CD2-SD 3.28Å; F82-M402 HydrophobicContact CE2-CG 3.27Å; F82-M402 HydrophobicContact CE2-SD 3.86Å; F82-M402 HydrophobicContact CG-CE 4.22Å; F82-M402 HydrophobicContact CG-CG 4.16Å; F82-M402 HydrophobicContact CG-SD 3.6Å; F82-M402 VanDerWaalsContact CG-SD 3.6Å; F82-M402 HydrophobicContact CZ-CG 4.41Å; F82-P406 HydrophobicContact CE1-CG 3.98Å; F82-P406 HydrophobicContact CZ-CG 4.31Å; F82-M409 HydrophobicContact CD2-CE 3.87Å; F82-M409 HydrophobicContact CD2-SD 4.16Å; F82-M409 HydrophobicContact CE1-SD 4.41Å; F82-M409 HydrophobicContact CE2-CE 3.2Å; F82-M409 HydrophobicContact CE2-SD 3.24Å; F82-M409 WeakPolarHBondContact CE2-SD 3.49Å; F82-M409 HydrophobicContact CZ-CE 3.98Å; F82-M409 HydrophobicContact CZ-SD 3.36Å; F82-M409 WeakPolarHBondContact CZ-SD 3.42Å; F82-L451 HydrophobicContact CB-CD1 3.98Å; F82-L451 HydrophobicContact CD1-CD1 3.06Å; F82-L451 HydrophobicContact CD1-CD2 3.97Å; F82-L451 HydrophobicContact CD1-CG 4.14Å; F82-L451 HydrophobicContact CD2-CD2 4.12Å; F82-L451 HydrophobicContact CE1-CD1 3.62Å; F82-L451 HydrophobicContact CE1-CD2 4.09Å; F82-L451 HydrophobicContact CE1-CG 4.47Å; F82-L451 HydrophobicContact CE2-CD2 4.35Å; F82-L451 HydrophobicContact CG-CD1 3.6Å; F82-L451 HydrophobicContact CG-CD2 3.99Å; F82-L451 HydrophobicContact CG-CG 4.42Å; F82-L451 HydrophobicContact CZ-CD2 4.3Å
83	Y	71.8	Confident	67.3	Low	58 Å²	58	50.9 Å²	50.9	23%	0.227	25%	0.245	C	C	.	.	H	α-helix	trans	-62.5	-39.1	-177.6	-169.7	-99.8	0	0	0	111.3	M59 A79 L80 A85 S86 I87 L448	M59-Y83 HydrophobicContact CE-CD1 3.29Å; M59-Y83 HydrophobicContact CE-CE1 3.17Å; M59-Y83 HydrophobicContact CE-CG 4.21Å; M59-Y83 HydrophobicContact SD-CD1 3.99Å; M59-Y83 HydrophobicContact SD-CE1 3.21Å; M59-Y83 WeakPolarHBondContact SD-CE1 3.35Å; M59-Y83 VanDerWaalsContact SD-CZ 3.58Å; A79-Y83 WeakPolarHBondContact O-CB 3.36Å; A79-Y83 PolarHBondContact O-N 2.67Å; L80-Y83 PolarHBondContact O-N 3.46Å; Y83-A85 PolarHBondContact O-N 2.99Å; Y83-S86 CarbonylContact O-C 3.59Å; Y83-S86 WeakPolarHBondContact O-CA 3.45Å; Y83-S86 PolarHBondContact O-N 3.25Å; Y83-I87 HydrophobicContact CD1-CD1 3.38Å; Y83-I87 HydrophobicContact CD1-CG1 3.8Å; Y83-I87 HydrophobicContact CE1-CD1 3.03Å; Y83-I87 HydrophobicContact CE1-CG1 3.47Å; Y83-I87 VanDerWaalsContact CE1-CG1 3.47Å; Y83-I87 HydrophobicContact CG-CD1 4.47Å; Y83-I87 WeakPolarHBondContact O-CG1 3.33Å; Y83-I87 PolarHBondContact O-N 2.57Å; Y83-L448 HydrophobicContact CD2-CB 3.97Å; Y83-L448 HydrophobicContact CG-CB 4.15Å; Y83-L448 HydrophobicContact CG-CD1 4.38Å
84	A	69.8	Low	65.1	Low	13 Å²	13	52.8 Å²	52.8	11%	0.107	26%	0.263	C	S	.	.	H	α-helix	trans	-51.2	-53.9	171	0	0	0	0	0	113	W56 L80 F82 S86 I87 K88	W56-A84 HydrophobicContact CE3-CB 4.18Å; W56-A84 HydrophobicContact CH2-CB 3.17Å; W56-A84 HydrophobicContact CZ2-CB 3.91Å; W56-A84 HydrophobicContact CZ3-CB 3.32Å; L80-A84 WeakPolarHBondContact O-CB 3.25Å; L80-A84 PolarHBondContact O-N 3.01Å; F82-A84 VanDerWaalsContact C-N 3.27Å; F82-A84 PolarHBondContact O-N 2.82Å; A84-S86 PolarHBondContact O-N 3.18Å; A84-I87 PolarHBondContact O-N 2.84Å; A84-K88 PolarHBondContact O-N 2.83Å; A84-K88 VanDerWaalsContact O-N 3.11Å
85	A	65.4	Low	62.9	Low	37 Å²	37	49.4 Å²	49.4	31%	0.306	27%	0.265	S	S	.	.	H	α-helix	trans	-62.1	-34.8	177.3	0	0	0	0	0	111.2	K81 F82 Y83 R89 M402	K81-A85 PolarHBondContact O-N 3.05Å; F82-A85 PolarHBondContact O-N 2.89Å; Y83-A85 PolarHBondContact O-N 2.99Å; A85-R89 WeakPolarHBondContact O-CG 3.38Å; A85-R89 PolarHBondContact O-N 2.88Å; A85-M402 HydrophobicContact CB-SD 4.2Å
86	S	62.4	Low	60.5	Low	29 Å²	29	58 Å²	58	20%	0.203	30%	0.302	C	S	.	.	H	α-helix	trans	-75.9	-30.9	179	-162.7	0	0	0	0	115.1	F82 Y83 A84 R89	F82-S86 PolarHBondContact O-N 3.02Å; Y83-S86 CarbonylContact O-C 3.59Å; Y83-S86 WeakPolarHBondContact O-CA 3.45Å; Y83-S86 PolarHBondContact O-N 3.25Å; A84-S86 PolarHBondContact O-N 3.18Å; S86-R89 VanDerWaalsContact CB-NH2 3.26Å; S86-R89 WeakPolarHBondContact O-CB 3.27Å; S86-R89 PolarHBondContact OG-NH2 2.68Å
87	I	62.1	Low	58.1	Low	26 Å²	26	68 Å²	68	13%	0.133	34%	0.342	C	S	.	.	H	α-helix	trans	-73.6	-43.2	173.9	-62.4	168.3	0	0	0	110.1	Y83 A84 R89 K90 E91	Y83-I87 HydrophobicContact CD1-CD1 3.38Å; Y83-I87 HydrophobicContact CD1-CG1 3.8Å; Y83-I87 HydrophobicContact CE1-CD1 3.03Å; Y83-I87 HydrophobicContact CE1-CG1 3.47Å; Y83-I87 VanDerWaalsContact CE1-CG1 3.47Å; Y83-I87 HydrophobicContact CG-CD1 4.47Å; Y83-I87 WeakPolarHBondContact O-CG1 3.33Å; Y83-I87 PolarHBondContact O-N 2.57Å; A84-I87 PolarHBondContact O-N 2.84Å; I87-R89 PolarHBondContact O-N 3.4Å; I87-R89 VanDerWaalsContact O-N 3.13Å; I87-K90 WeakPolarHBondContact O-CA 3.38Å; I87-K90 PolarHBondContact O-N 2.82Å; I87-E91 HydrophobicContact CG2-CG 3.89Å; I87-E91 PolarHBondContact O-N 3.05Å
88	K	57.7	Low	55.6	Low	89 Å²	89	74.1 Å²	74.1	39%	0.387	37%	0.373	S	S	.	.	H	α-helix	trans	-53.2	-36.7	175.6	-76.1	-167.2	173.8	-166	0	110.7	E37 A84 K90 Q92	E37-K88 IonicContact OE2-NZ 3.86Å; E37-K88 PolarHBondContact OE2-NZ 3.2Å; A84-K88 PolarHBondContact O-N 2.83Å; A84-K88 VanDerWaalsContact O-N 3.11Å; K88-K90 PolarHBondContact O-N 2.86Å; K88-Q92 VanDerWaalsContact O-CB 3.31Å; K88-Q92 WeakPolarHBondContact O-CB 3.48Å; K88-Q92 VanDerWaalsContact O-CG 3.23Å; K88-Q92 WeakPolarHBondContact O-CG 3.43Å; K88-Q92 PolarHBondContact O-N 3.26Å
89	R	54.2	Low	53.3	Low	69 Å²	69	80 Å²	80	26%	0.26	41%	0.405	S	S	.	.	H	α-helix	trans	-59.2	-36.5	171.3	-71	-173.7	-67.9	-142.5	0.1	114.5	A85 S86 I87 S93 M402	A85-R89 WeakPolarHBondContact O-CG 3.38Å; A85-R89 PolarHBondContact O-N 2.88Å; S86-R89 VanDerWaalsContact CB-NH2 3.26Å; S86-R89 WeakPolarHBondContact O-CB 3.27Å; S86-R89 PolarHBondContact OG-NH2 2.68Å; I87-R89 PolarHBondContact O-N 3.4Å; I87-R89 VanDerWaalsContact O-N 3.13Å; R89-S93 PolarHBondContact O-OG 3.35Å; R89-M402 PolarHBondContact NH1-O 2.91Å
90	K	51.7	Low	50.6	Low	165 Å²	165	88.2 Å²	88.2	72%	0.717	44%	0.444	S	S	*	.	H	α-helix	trans	-83.1	-38.2	-179.5	-75.2	-176.5	173.8	-179.7	0	112.6	I87 K88	I87-K90 WeakPolarHBondContact O-CA 3.38Å; I87-K90 PolarHBondContact O-N 2.82Å; K88-K90 PolarHBondContact O-N 2.86Å
91	E	48.3	Very low	48.1	Very low	101 Å²	101	96.2 Å²	96.2	47%	0.472	48%	0.481	S	S	.	.	H	α-helix	trans	-75.3	-36.8	-178.6	-72.3	177.1	170.4	0	0	111.9	I87 S93 A94 A95	I87-E91 HydrophobicContact CG2-CG 3.89Å; I87-E91 PolarHBondContact O-N 3.05Å; E91-S93 VanDerWaalsContact C-N 3.26Å; E91-S93 PolarHBondContact O-N 3.17Å; E91-A94 PolarHBondContact O-N 2.69Å; E91-A95 VanDerWaalsContact O-CB 3.24Å; E91-A95 WeakPolarHBondContact O-CB 3.33Å; E91-A95 PolarHBondContact O-N 3.08Å
92	Q	43.3	Very low	46	Very low	122 Å²	122	101.8 Å²	101.8	57%	0.57	51%	0.508	S	S	*	.	H	α-helix	trans	-62.4	-31.2	175.9	-75	173.5	-15	0	0	113.2	K88 A94	K88-Q92 VanDerWaalsContact O-CB 3.31Å; K88-Q92 WeakPolarHBondContact O-CB 3.48Å; K88-Q92 VanDerWaalsContact O-CG 3.23Å; K88-Q92 WeakPolarHBondContact O-CG 3.43Å; K88-Q92 PolarHBondContact O-N 3.26Å; Q92-A94 VanDerWaalsContact C-N 3.31Å
93	S	36.9	Very low	43.9	Very low	64 Å²	64	107.9 Å²	107.9	45%	0.448	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.1	-16.5	173.2	-60	0	0	0	0	113.7	R89 E91	R89-S93 PolarHBondContact O-OG 3.35Å; E91-S93 VanDerWaalsContact C-N 3.26Å; E91-S93 PolarHBondContact O-N 3.17Å
94	A	36.8	Very low	41.9	Very low	69 Å²	69	110.7 Å²	110.7	57%	0.57	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	-28.5	-179.1	0	0	0	0	0	113.5	E91 Q92 K96	E91-A94 PolarHBondContact O-N 2.69Å; Q92-A94 VanDerWaalsContact C-N 3.31Å; A94-K96 PolarHBondContact O-N 3.4Å
95	A	36.5	Very low	40	Very low	71 Å²	71	115.3 Å²	115.3	59%	0.587	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-1.9	-167.4	0	0	0	0	0	115.8	E91 Y97	E91-A95 VanDerWaalsContact O-CB 3.24Å; E91-A95 WeakPolarHBondContact O-CB 3.33Å; E91-A95 PolarHBondContact O-N 3.08Å; A95-Y97 PolarHBondContact O-N 3.41Å
96	K	31	Very low	38.4	Very low	181 Å²	181	121 Å²	121	79%	0.787	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	8.4	-177.7	-130.1	176.8	-174.8	177.6	0	115	A94	A94-K96 PolarHBondContact O-N 3.4Å
97	Y	32	Very low	37.1	Very low	210 Å²	210	124.2 Å²	124.2	82%	0.824	65%	0.648	S	S	*	*	S	Bend	trans	-104.9	35.7	175.5	-67.2	-79.2	0	0	0	113	A95	A95-Y97 PolarHBondContact O-N 3.41Å
98	L	27.6	Very low	35.8	Very low	145 Å²	145	130.4 Å²	130.4	76%	0.759	68%	0.682	S	S	*	*	S	Bend	trans	-164.6	115.9	162.1	-153.7	57.1	0	0	0	111.5
99	L	30.1	Very low	34.8	Very low	169 Å²	169	129.8 Å²	129.8	89%	0.885	68%	0.683	S	S	*	*			trans	77.6	145.6	163.4	-65.7	163.6	0	0	0	120.3
100	Q	24.1	Very low	33.9	Very low	173 Å²	173	133.6 Å²	133.6	81%	0.808	70%	0.703	S	S	*	*			trans	-92.2	153.8	-165.6	-165.1	173.6	-21.8	0	0	109.9
101	E	26	Very low	33.1	Very low	169 Å²	169	133.9 Å²	133.9	79%	0.79	71%	0.712	S	S	*	*			trans	103.7	130.9	163.3	-55.3	-168.2	160.4	0	0	119.6
102	E	28.3	Very low	32.4	Very low	176 Å²	176	136.1 Å²	136.1	82%	0.822	73%	0.726	S	S	*	*			trans	71.5	92.6	166.1	-59.2	-170.8	170	0	0	120	V104	E102-V104 PolarHBondContact O-N 2.95Å
103	S	25.8	Very low	31.9	Very low	130 Å²	130	136.5 Å²	136.5	91%	0.909	73%	0.732	S	S	*	*			trans	-63.3	106.6	162.7	51.8	0	0	0	0	111.5
104	V	30.8	Very low	31.6	Very low	116 Å²	116	137.6 Å²	137.6	70%	0.703	74%	0.74	S	S	*	*			trans	-112.6	113.8	167.3	-179.4	0	0	0	0	109.4	E102	E102-V104 PolarHBondContact O-N 2.95Å
105	S	28.6	Very low	31.5	Very low	111 Å²	111	143.3 Å²	143.3	78%	0.776	76%	0.755	S	S	*	*			trans	-71.5	133.1	172.6	51.5	0	0	0	0	111.1
106	Q	32.3	Very low	31.7	Very low	155 Å²	155	144.5 Å²	144.5	72%	0.724	75%	0.75	S	S	*	*			trans	-127.3	120.7	167.1	-78	-175.6	-15.2	0	0	111.2
107	S	34.5	Very low	31.8	Very low	97 Å²	97	142.2 Å²	142.2	68%	0.678	75%	0.747	S	S	*	*			trans	-79.6	122.3	171.3	49.1	0	0	0	0	110.3	D109	S107-D109 PolarHBondContact O-N 3.24Å
108	D	34.7	Very low	31.8	Very low	157 Å²	157	141.7 Å²	141.7	84%	0.84	75%	0.752	S	S	*	*			trans	-88.2	84.9	164.5	-78	-20.3	0	0	0	108.6
109	D	37.1	Very low	31.9	Very low	76 Å²	76	140.2 Å²	140.2	41%	0.406	75%	0.749	S	S	.	*			trans	-133.6	130.1	161.4	-108	-21.4	0	0	0	108.9	S107	S107-D109 PolarHBondContact O-N 3.24Å
110	E	35.8	Very low	32.1	Very low	149 Å²	149	136.7 Å²	136.7	70%	0.696	74%	0.744	S	S	*	*			trans	59.4	100.4	152.4	-56.4	-173.3	168.5	0	0	119.2
111	L	34.4	Very low	32.6	Very low	171 Å²	171	134.1 Å²	134.1	90%	0.895	75%	0.745	S	S	*	*			trans	-151.8	117.3	139.4	-100.7	166.1	0	0	0	109.8
112	L	33.1	Very low	32.8	Very low	147 Å²	147	137.6 Å²	137.6	77%	0.77	75%	0.751	S	S	*	*			trans	-65.5	127.1	170.1	-79.5	141.3	0	0	0	109.7
113	D	34.5	Very low	33.1	Very low	130 Å²	130	135 Å²	135	70%	0.695	75%	0.752	S	S	*	*			trans	-99.9	78.9	151.9	-80.7	-24.2	0	0	0	107.2
114	S	30.5	Very low	33.7	Very low	88 Å²	88	133.7 Å²	133.7	62%	0.615	75%	0.749	S	S	*	*			trans	-98	79.8	161.9	53.7	0	0	0	0	107.7
115	E	33.5	Very low	33.8	Very low	188 Å²	188	135.8 Å²	135.8	88%	0.879	76%	0.757	S	S	*	*			trans	-169.8	80.6	167.1	-110.6	170	-147.7	0	0	110.4
116	I	40.7	Very low	34.3	Very low	96 Å²	96	137.5 Å²	137.5	49%	0.492	76%	0.762	S	S	.	*	S	Bend	trans	-145.3	86	151.4	-54.5	-178.9	0	0	0	107.4	R74	R74-I116 PolarHBondContact NH2-O 2.9Å; R74-I116 VanDerWaalsContact NH2-O 3.14Å
117	D	34.3	Very low	34.5	Very low	134 Å²	134	139.1 Å²	139.1	72%	0.717	77%	0.77	S	S	*	*			trans	22.7	111.4	151.6	-118.5	-35	0	0	0	118.9	T119	D117-T119 PolarHBondContact OD1-OG1 3.13Å
118	E	31.6	Very low	34.5	Very low	198 Å²	198	139.6 Å²	139.6	93%	0.925	77%	0.771	S	S	*	*			trans	-87.1	88.5	154.6	-83.1	-165.8	147.8	0	0	108.9
119	T	28.6	Very low	34.6	Very low	115 Å²	115	141.7 Å²	141.7	71%	0.706	78%	0.775	S	S	*	*			trans	-144.2	85.3	163.7	42.9	0	0	0	0	110.5	D117	D117-T119 PolarHBondContact OD1-OG1 3.13Å
120	A	34	Very low	34.3	Very low	95 Å²	95	149.2 Å²	149.2	79%	0.785	80%	0.798	S	S	*	*			trans	-143.5	109.3	161.2	0	0	0	0	0	111.2
121	S	35.5	Very low	34.4	Very low	118 Å²	118	149.9 Å²	149.9	83%	0.825	81%	0.805	S	S	*	*			trans	68.9	86.9	152.7	53.4	0	0	0	0	119.7
122	R	30.8	Very low	34.5	Very low	243 Å²	243	146.8 Å²	146.8	92%	0.917	80%	0.798	S	S	*	*			trans	-69.1	131.9	133.2	-78.1	177.8	168.8	178.1	-3.6	109
123	S	33.6	Very low	34.5	Very low	120 Å²	120	147.5 Å²	147.5	84%	0.839	80%	0.801	S	S	*	*				155.9	113.1	129.7	43.7	0	0	0	0	111.6
124	A	38.1	Very low	34.7	Very low	103 Å²	103	150.8 Å²	150.8	85%	0.851	81%	0.812	S	S	*	*			trans	-173.4	101.6	141.7	0	0	0	0	0	108.3
125	D	34.2	Very low	34.8	Very low	160 Å²	160	154.5 Å²	154.5	86%	0.856	82%	0.82	S	S	*	*			trans	-60.3	131.5	167.7	-59.8	-66.7	0	0	0	111.3
126	V	39.8	Very low	35	Very low	147 Å²	147	151.7 Å²	151.7	89%	0.891	81%	0.81	S	S	*	*			trans	-149.3	121.1	143	-175.9	0	0	0	0	108.5
127	E	35.5	Very low	35.2	Very low	189 Å²	189	155.2 Å²	155.2	88%	0.883	83%	0.825	S	S	*	*			trans	-70.7	166.1	-179.2	-100.1	-149.9	143.6	0	0	114.9
128	P	33.7	Very low	35.6	Very low	108 Å²	108	154.3 Å²	154.3	70%	0.701	83%	0.826	S	S	*	*			trans	-103.1	152.4	-162.1	38.3	-30.1	0	0	0	113.7
129	E	36.7	Very low	37.2	Very low	201 Å²	201	150.8 Å²	150.8	94%	0.939	82%	0.82	S	S	*	*			trans	-133.3	140.3	155	-86.1	-148.2	143.3	0	0	113
130	R	31.7	Very low	38.6	Very low	233 Å²	233	151 Å²	151	88%	0.879	82%	0.824	S	S	*	*			trans	-65.6	157.5	-175.6	-65.1	169	167.9	-169.5	-3.9	111.7
131	L	37.2	Very low	39.2	Very low	163 Å²	163	152 Å²	152	85%	0.853	82%	0.822	S	S	*	*				-176.6	119.9	115.1	-92.4	157	0	0	0	112.6
132	S	36.3	Very low	40.1	Very low	106 Å²	106	152.1 Å²	152.1	74%	0.741	82%	0.82	S	S	*	*			trans	37.9	121.3	143.6	50.3	0	0	0	0	122.3
133	I	34.5	Very low	41.1	Very low	163 Å²	163	146.7 Å²	146.7	84%	0.836	82%	0.816	S	S	*	*			trans	-59.1	131.9	158.4	-64	162.5	0	0	0	110.3
134	E	38.5	Very low	41.2	Very low	199 Å²	199	150 Å²	150	93%	0.93	82%	0.818	S	S	*	*			trans	-130.8	138.5	156.4	-120.7	178.2	165.2	0	0	109.8
135	E	32.7	Very low	41.4	Very low	166 Å²	166	157.2 Å²	157.2	78%	0.776	82%	0.824	S	S	*	*			trans	-94.1	166.8	-167.3	-174.7	177.9	145.6	0	0	110.9
136	L	37.7	Very low	41.7	Very low	129 Å²	129	155.5 Å²	155.5	68%	0.675	82%	0.819	S	S	*	*			trans	98.7	109.3	160.8	-73.3	107.5	0	0	0	120.5
137	Q	43.7	Very low	41.6	Very low	170 Å²	170	152.7 Å²	152.7	79%	0.794	81%	0.805	S	S	*	*				126.8	133.9	113.6	-89.4	175.1	9.3	0	0	117.5
138	P	44.4	Very low	41.8	Very low	115 Å²	115	150.3 Å²	150.3	75%	0.747	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-88.8	155.9	-175.5	36.1	-34	0	0	0	113.2
139	P	63.7	Low	42	Very low	123 Å²	123	151.8 Å²	151.8	80%	0.799	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-81.2	154.5	-179.7	31.3	-33.2	0	0	0	114.1
140	P	57.7	Low	42	Very low	120 Å²	120	149.4 Å²	149.4	78%	0.779	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-86.5	168.1	-172.3	35.6	-35.9	0	0	0	114.6
141	P	46.8	Very low	42.1	Very low	117 Å²	117	147.1 Å²	147.1	76%	0.76	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-86.3	163.3	-171.7	35.6	-34.3	0	0	0	114
142	P	54.7	Low	42	Very low	119 Å²	119	148 Å²	148	77%	0.773	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-85.7	150.9	-169.8	33.8	-33.8	0	0	0	113.6
143	P	51.1	Low	41.9	Very low	129 Å²	129	152 Å²	152	84%	0.838	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-89.8	138.7	177.9	33.6	-30.5	0	0	0	113.1
144	Q	35.9	Very low	42	Very low	189 Å²	189	151.8 Å²	151.8	88%	0.883	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-71.7	145.5	168.4	-68.9	172.5	-32.4	0	0	111.5
145	R	42	Very low	41.7	Very low	256 Å²	256	152.7 Å²	152.7	97%	0.966	79%	0.789	S	S	*	*			trans	-135.8	146.4	153.9	-117.8	-178.1	-168.2	-168.6	3.3	111.7
146	V	42.2	Very low	42	Very low	124 Å²	124	153.6 Å²	153.6	75%	0.752	79%	0.79	S	S	*	*			trans	-96.7	144.9	-155.6	167.3	0	0	0	0	111.9
147	S	37.9	Very low	41.9	Very low	87 Å²	87	153.7 Å²	153.7	61%	0.608	80%	0.796	S	S	*	*			trans	42.7	133.7	149.8	81	0	0	0	0	122.6
148	D	39.5	Very low	41.8	Very low	139 Å²	139	151.3 Å²	151.3	74%	0.743	80%	0.795	S	S	*	*				-176.1	125.4	95.1	-87.4	-19.3	0	0	0	113.1
149	N	37.5	Very low	41.5	Very low	140 Å²	140	151.4 Å²	151.4	75%	0.749	80%	0.796	S	S	*	*			trans	50.5	129.7	137.3	-82.9	-10.7	0	0	0	126
150	E	37.2	Very low	40.3	Very low	151 Å²	151	151.6 Å²	151.6	71%	0.706	80%	0.797	S	S	*	*			trans	97.5	101.1	133.2	-72.1	-174.6	141.6	0	0	122.4
151	K	33.2	Very low	39.4	Very low	185 Å²	185	154 Å²	154	80%	0.804	80%	0.803	S	S	*	*				39.9	118	129.3	-64	175	-178.8	166.3	0	119.7
152	E	35.6	Very low	38.9	Very low	181 Å²	181	153.7 Å²	153.7	85%	0.846	80%	0.801	S	S	*	*				-165.8	138.9	117.9	-122.9	-178.8	158.8	0	0	113.5
153	H	34.5	Very low	37.9	Very low	191 Å²	191	154.1 Å²	154.1	88%	0.884	80%	0.804	S	S	*	*			trans	-78.5	129.2	174.4	-82.7	39.2	0	0	0	110.8
154	Q	36.4	Very low	37.1	Very low	157 Å²	157	154.4 Å²	154.4	73%	0.734	79%	0.792	S	S	*	*			trans	-149	117.3	156.2	-103.2	171.6	35.8	0	0	111.6	K156	Q154-K156 PolarHBondContact O-N 3.5Å
155	K	31.8	Very low	36.9	Very low	218 Å²	218	150.3 Å²	150.3	95%	0.948	78%	0.781	S	S	*	*			trans	-57.9	126.4	167.9	-80.2	172	171.6	175.1	0	109.7
156	K	38.1	Very low	36.5	Very low	185 Å²	185	147 Å²	147	80%	0.804	78%	0.777	S	S	*	*			trans	-129.5	123	165.9	-71.7	-176.8	179.4	177.4	0	109.9	Q154	Q154-K156 PolarHBondContact O-N 3.5Å
157	T	37	Very low	36.1	Very low	132 Å²	132	149.4 Å²	149.4	81%	0.81	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-63.7	151.2	173	38.4	0	0	0	0	111.8
158	P	40.6	Very low	36	Very low	119 Å²	119	151 Å²	151	77%	0.773	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-68.4	148.3	177.3	28.2	-32.2	0	0	0	111.7
159	P	39	Very low	35.9	Very low	117 Å²	117	149.3 Å²	149.3	76%	0.76	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-73.4	163.7	-178.7	31.6	-34.2	0	0	0	112.2
160	P	38.5	Very low	35.7	Very low	127 Å²	127	146.1 Å²	146.1	83%	0.825	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-71.4	147.1	-179.4	3.1	11.3	0	0	0	112.3
161	L	37.8	Very low	35.5	Very low	171 Å²	171	144.7 Å²	144.7	90%	0.895	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-61.9	141.1	178	-75.9	146.7	0	0	0	112.6
162	P	36.3	Very low	35.4	Very low	110 Å²	110	140 Å²	140	71%	0.714	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-70.3	155.6	171.9	29	-33.1	0	0	0	112.4
163	P	34.5	Very low	35.4	Very low	129 Å²	129	137 Å²	137	84%	0.838	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-70.4	138.4	-176.9	27.5	-32.4	0	0	0	112.9
164	K	33.8	Very low	35.3	Very low	135 Å²	135	133.7 Å²	133.7	59%	0.587	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-60.8	143	179.8	-88.2	-177.4	172.9	-175.7	0	113	Q166 E336	K164-Q166 PolarHBondContact O-N 3.31Å; K164-E336 WeakPolarHBondContact CE-O 3.37Å; K164-E336 PolarHBondContact NZ-O 3.3Å; K164-E336 IonicContact NZ-OE2 3.86Å
165	P	31.2	Very low	35.2	Very low	102 Å²	102	134.1 Å²	134.1	66%	0.662	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-64.9	126.7	164.9	-14.5	28	0	0	0	111.1	H167	P165-H167 VanDerWaalsContact C-N 3.26Å; P165-H167 PolarHBondContact O-N 2.94Å
166	Q	33.3	Very low	35.4	Very low	188 Å²	188	129.1 Å²	129.1	88%	0.879	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	6.4	-171.7	-71.2	178.7	-31.4	0	0	115.6	K164	K164-Q166 PolarHBondContact O-N 3.31Å
167	H	35.4	Very low	35.1	Very low	174 Å²	174	127.4 Å²	127.4	81%	0.806	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-3.7	-172.1	-101.9	-82.4	0	0	0	116.3	P165	P165-H167 VanDerWaalsContact C-N 3.26Å; P165-H167 PolarHBondContact O-N 2.94Å
168	L	35.8	Very low	34.7	Very low	121 Å²	121	125.6 Å²	125.6	63%	0.634	70%	0.699	S	S	*	*	S	Bend	trans	-87.7	-2.1	-170.8	-75.7	159.2	0	0	0	115.4
169	F	36.4	Very low	34.2	Very low	103 Å²	103	129.2 Å²	129.2	45%	0.452	70%	0.703	S	S	.	*	S	Bend	trans	-99.3	-11.4	-167	-145.4	-104.7	0	0	0	115.9	R522	F169-R522 VanDerWaalsContact CZ-CZ 3.48Å
170	T	33.6	Very low	33.6	Very low	73 Å²	73	128.6 Å²	128.6	45%	0.448	70%	0.701	S	S	.	*	S	Bend	trans	-104	-28	-163.7	-39.3	0	0	0	0	114.5	Q174	T170-Q174 HydrophobicContact CG2-CG 4.43Å; T170-Q174 VanDerWaalsContact CG2-NE2 3.26Å; T170-Q174 WeakPolarHBondContact O-CB 3.24Å; T170-Q174 VanDerWaalsContact O-CG 3.24Å; T170-Q174 WeakPolarHBondContact O-CG 3.39Å; T170-Q174 PolarHBondContact O-N 3.04Å
171	L	31.9	Very low	33.3	Very low	120 Å²	120	129.7 Å²	129.7	63%	0.628	71%	0.705	S	S	*	*	H	α-helix	trans	-84.9	-30.9	-172.1	-90.6	148.7	0	0	0	114.5
172	A	32.6	Very low	32.9	Very low	87 Å²	87	129.2 Å²	129.2	72%	0.719	70%	0.699	S	S	*	*	H	α-helix	trans	-73.4	-28.4	178.9	0	0	0	0	0	113.1
173	Q	34.4	Very low	32.6	Very low	118 Å²	118	130.1 Å²	130.1	55%	0.551	70%	0.704	S	S	*	*	H	α-helix	trans	-87.7	-30.2	177.3	-77.1	-177.8	-9.5	0	0	113.7	R175 C176	Q173-R175 PolarHBondContact O-N 2.86Å; Q173-C176 PolarHBondContact O-N 2.89Å
174	Q	33	Very low	32.5	Very low	122 Å²	122	131.7 Å²	131.7	57%	0.57	70%	0.704	S	S	*	*	H	α-helix	trans	-73.9	-24.8	-175.1	-77.5	-179.7	-6	0	0	114.3	T170 C176	T170-Q174 HydrophobicContact CG2-CG 4.43Å; T170-Q174 VanDerWaalsContact CG2-NE2 3.26Å; T170-Q174 WeakPolarHBondContact O-CB 3.24Å; T170-Q174 VanDerWaalsContact O-CG 3.24Å; T170-Q174 WeakPolarHBondContact O-CG 3.39Å; T170-Q174 PolarHBondContact O-N 3.04Å; Q174-C176 VanDerWaalsContact C-N 3.33Å; Q174-C176 PolarHBondContact O-N 2.94Å
175	R	35.4	Very low	32.5	Very low	165 Å²	165	131.1 Å²	131.1	62%	0.623	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-12.4	178	-80	178.8	164.7	158.9	-3.2	114.3	Q173	Q173-R175 PolarHBondContact O-N 2.86Å
176	C	35.5	Very low	32.4	Very low	113 Å²	113	131.4 Å²	131.4	76%	0.764	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-8.5	174.7	-76.5	0	0	0	0	114.4	Q173 Q174	Q173-C176 PolarHBondContact O-N 2.89Å; Q174-C176 VanDerWaalsContact C-N 3.33Å; Q174-C176 PolarHBondContact O-N 2.94Å
177	L	30.8	Very low	32.4	Very low	149 Å²	149	127.4 Å²	127.4	78%	0.78	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.8	-5.4	-173.6	-71.7	167.4	0	0	0	115.3	K179	L177-K179 VanDerWaalsContact C-N 3.33Å; L177-K179 PolarHBondContact O-N 3.46Å
178	A	28.8	Very low	32.2	Very low	94 Å²	94	123.9 Å²	123.9	78%	0.777	73%	0.725	S	S	*	*			trans	-86.3	69.8	176.8	0	0	0	0	0	112.1
179	K	29.8	Very low	32.1	Very low	196 Å²	196	121.8 Å²	121.8	85%	0.852	73%	0.725	S	S	*	*			trans	-108.4	109.9	160.2	-77.8	-177.4	178.9	-179.1	0	108	L177	L177-K179 VanDerWaalsContact C-N 3.33Å; L177-K179 PolarHBondContact O-N 3.46Å
180	S	26.6	Very low	32.2	Very low	104 Å²	104	124.7 Å²	124.7	73%	0.727	74%	0.74	S	S	*	*			trans	163.9	104.6	143.7	-171.7	0	0	0	0	108.9
181	V	33.3	Very low	32.2	Very low	149 Å²	149	127.5 Å²	127.5	90%	0.903	75%	0.752	S	S	*	*			trans	-129.3	117.5	158.7	179.5	0	0	0	0	106.3
182	Q	28.7	Very low	32.3	Very low	162 Å²	162	128.2 Å²	128.2	76%	0.757	76%	0.756	S	S	*	*			trans	-71.8	149	-178.9	-62.2	-174.2	-4.9	0	0	111.3
183	P	29.7	Very low	32.5	Very low	129 Å²	129	129.7 Å²	129.7	84%	0.838	75%	0.752	S	S	*	*			trans	-87.6	135.6	173.9	26.5	-16.4	0	0	0	111.6
184	I	33.8	Very low	32.5	Very low	162 Å²	162	129.2 Å²	129.2	83%	0.831	76%	0.758	S	S	*	*			trans	-109.1	139.7	169.7	-59	174.7	0	0	0	108.3
185	P	32.8	Very low	32.8	Very low	123 Å²	123	127.5 Å²	127.5	80%	0.799	76%	0.759	S	S	*	*			trans	-85.7	148.1	-166.7	4.2	14.8	0	0	0	113.6
186	A	29.8	Very low	32.9	Very low	108 Å²	108	127.8 Å²	127.8	89%	0.893	77%	0.767	S	S	*	*			trans	-82.5	140.2	173.7	0	0	0	0	0	112
187	A	33.4	Very low	33	Very low	104 Å²	104	129.8 Å²	129.8	86%	0.86	77%	0.765	S	S	*	*			trans	-130.1	137.5	162.5	0	0	0	0	0	109.5
188	A	30.8	Very low	33.2	Very low	99 Å²	99	129.2 Å²	129.2	82%	0.818	76%	0.762	S	S	*	*			trans	-85.7	158	-169.8	0	0	0	0	0	113.5
189	A	33.7	Very low	33.8	Very low	77 Å²	77	130.6 Å²	130.6	64%	0.636	76%	0.76	S	S	*	*				137.1	143	107.4	0	0	0	0	0	115.8
190	H	37.2	Very low	34.7	Very low	164 Å²	164	126 Å²	126	76%	0.759	75%	0.75	S	S	*	*			trans	86	110.2	154.1	-65.1	-62.1	0	0	0	121.5
191	D	35.3	Very low	35.3	Very low	133 Å²	133	128.7 Å²	128.7	71%	0.711	76%	0.756	S	S	*	*				45.6	138.5	111.4	-51.4	-28	0	0	0	116.7
192	D	34	Very low	35.7	Very low	134 Å²	134	128.7 Å²	128.7	72%	0.717	75%	0.751	S	S	*	*			cis	-173.2	147.7	42	-148	-3.1	0	0	0	110.6
193	N	35.4	Very low	36.7	Very low	119 Å²	119	126.5 Å²	126.5	64%	0.636	75%	0.751	S	S	*	*			trans	83.2	136.3	131.2	-124.8	-26.7	0	0	0	124.9
194	T	34.2	Very low	37.3	Very low	108 Å²	108	125.9 Å²	125.9	66%	0.663	75%	0.747	S	S	*	*			trans	71.7	135	141.5	11.1	0	0	0	0	118.5
195	S	39.4	Very low	37.5	Very low	85 Å²	85	122.5 Å²	122.5	59%	0.594	74%	0.744	S	S	*	*			cis	-179.2	163.1	2.5	-131.8	0	0	0	0	111.5
196	Q	37.7	Very low	38.2	Very low	171 Å²	171	122.4 Å²	122.4	80%	0.799	75%	0.746	S	S	*	*			trans	84.1	142.3	145.7	-70.4	164.7	27.9	0	0	120.9
197	H	37.4	Very low	38.7	Very low	156 Å²	156	122.7 Å²	122.7	72%	0.722	74%	0.739	S	S	*	*			cis	178.9	154.6	-22.5	-146.8	-64.4	0	0	0	107.5
198	I	35.8	Very low	39.1	Very low	137 Å²	137	124.7 Å²	124.7	70%	0.703	74%	0.74	S	S	*	*			trans	80.4	108.8	153.1	-47.4	167.4	0	0	0	116.6
199	V	41.8	Very low	39.8	Very low	123 Å²	123	124.6 Å²	124.6	75%	0.745	74%	0.739	S	S	*	*			cis	76.7	149.1	38.7	-166.6	0	0	0	0	112.2
200	P	48.2	Very low	39.8	Very low	98 Å²	98	128.9 Å²	128.9	64%	0.636	75%	0.751	S	S	*	*				-133.4	-169.8	-55.5	40.2	-21.4	0	0	0	111.3
201	D	38.8	Very low	40.1	Very low	161 Å²	161	128.3 Å²	128.3	86%	0.861	75%	0.753	S	S	*	*				-176.3	131	124.5	-100.7	-19.5	0	0	0	113.8
202	N	42.5	Very low	40.4	Very low	149 Å²	149	127.6 Å²	127.6	80%	0.797	76%	0.756	S	S	*	*			trans	-88.9	167.1	167.1	-121.4	-0.9	0	0	0	108.2
203	P	49.3	Very low	40.5	Very low	116 Å²	116	127.9 Å²	127.9	75%	0.753	76%	0.762	S	S	*	*				-162.3	-156	78.2	40.4	-14.5	0	0	0	114.2
204	P	42.5	Very low	40.9	Very low	117 Å²	117	131.3 Å²	131.3	76%	0.76	77%	0.772	S	S	*	*				-127.7	166.5	-79.8	39.6	-22.1	0	0	0	115.6
205	A	37.8	Very low	40.9	Very low	91 Å²	91	132.4 Å²	132.4	75%	0.752	78%	0.78	S	S	*	*			trans	3.1	145.9	154.2	0	0	0	0	0	123
206	S	48	Very low	40.6	Very low	121 Å²	121	139.7 Å²	139.7	85%	0.846	80%	0.795	S	S	*	*				-168.5	156.6	122.8	-82.8	0	0	0	0	113.8
207	P	39.4	Very low	40.6	Very low	114 Å²	114	143.1 Å²	143.1	74%	0.74	80%	0.8	S	S	*	*			trans	-117.7	156.7	-144.5	39.1	-26.5	0	0	0	114.4
208	V	42.5	Very low	40.4	Very low	146 Å²	146	145 Å²	145	89%	0.885	81%	0.809	S	S	*	*			trans	-145.5	103.2	163.1	-166.1	0	0	0	0	112.7
209	A	44.1	Very low	40.5	Very low	96 Å²	96	143.3 Å²	143.3	79%	0.793	81%	0.81	S	S	*	*			trans	53.7	128	134.5	0	0	0	0	0	123.2
210	D	35	Very low	40.3	Very low	167 Å²	167	146.8 Å²	146.8	89%	0.893	82%	0.815	S	S	*	*			trans	-61.3	144.9	176.1	-65.6	-66.3	0	0	0	116
211	D	42.7	Very low	39.6	Very low	152 Å²	152	147.1 Å²	147.1	81%	0.813	82%	0.817	S	S	*	*			trans	-119.8	142.8	157.1	-119.6	-22.7	0	0	0	109.3
212	P	42	Very low	40	Very low	118 Å²	118	144.5 Å²	144.5	77%	0.766	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-79.7	130.1	-158.9	30.9	-33.4	0	0	0	113.8	K214	P212-K214 PolarHBondContact O-N 2.69Å
213	V	35.4	Very low	40.1	Very low	140 Å²	140	144.7 Å²	144.7	85%	0.848	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-73.1	121.8	178.6	179.8	0	0	0	0	111.6
214	K	44.3	Very low	40.5	Very low	192 Å²	192	143.8 Å²	143.8	84%	0.835	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-84.4	136.2	166.8	-70.1	178.9	-179.1	175.2	0	110.3	P212 R216	P212-K214 PolarHBondContact O-N 2.69Å; K214-R216 PolarHBondContact O-N 2.69Å
215	P	35.2	Very low	41.6	Very low	130 Å²	130	142.4 Å²	142.4	84%	0.844	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-72.5	127.2	-176.5	28.9	-32.2	0	0	0	111.1
216	R	32.3	Very low	43.7	Very low	238 Å²	238	146.4 Å²	146.4	90%	0.898	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-82	124.4	176.3	-169.9	172.7	178.8	170.5	-2.4	110.1	K214 Q218	K214-R216 PolarHBondContact O-N 2.69Å; R216-Q218 PolarHBondContact O-N 3.1Å
217	R	37.1	Very low	45.5	Very low	243 Å²	243	144.2 Å²	144.2	92%	0.917	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-51.8	121.2	170.4	-99.8	176.1	161.4	175.4	-5.2	110.1	S219	R217-S219 PolarHBondContact O-N 2.85Å
218	Q	33.7	Very low	47.7	Very low	195 Å²	195	142.3 Å²	142.3	91%	0.911	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-73.7	117.8	176.6	-68.7	178.9	-5.4	0	0	110.7	R216	R216-Q218 PolarHBondContact O-N 3.1Å
219	S	38.7	Very low	49.9	Very low	102 Å²	102	138.8 Å²	138.8	71%	0.713	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-75.6	135.5	162.1	44.1	0	0	0	0	109.6	R217	R217-S219 PolarHBondContact O-N 2.85Å
220	K	36.3	Very low	52	Low	197 Å²	197	134.3 Å²	134.3	86%	0.857	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-66.7	133.1	-180	-65.1	179.4	178.8	-178.9	0	110.7
221	P	34.4	Very low	54.5	Low	104 Å²	104	127.9 Å²	127.9	68%	0.675	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-69.5	142.4	175.9	24.1	-25.8	0	0	0	111.1	L223	P221-L223 PolarHBondContact O-N 3.49Å
222	V	46	Very low	56.8	Low	107 Å²	107	125.7 Å²	125.7	65%	0.648	64%	0.636	S	S	*	*			trans	-75.7	103.8	176.2	177.9	0	0	0	0	107.9	T224	V222-T224 PolarHBondContact O-N 2.93Å
223	L	45	Very low	59.1	Low	153 Å²	153	123.4 Å²	123.4	80%	0.801	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-69.7	125.7	178.2	-69.1	167	0	0	0	110.3	P221 L225	P221-L223 PolarHBondContact O-N 3.49Å; L223-L225 PolarHBondContact O-N 3.06Å
224	T	58.1	Low	61.7	Low	97 Å²	97	116.7 Å²	116.7	60%	0.595	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-59.7	124.1	166	48.7	0	0	0	0	109.3	V222	V222-T224 PolarHBondContact O-N 2.93Å
225	L	66.6	Low	64	Low	88 Å²	88	112 Å²	112	46%	0.461	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-61.3	139.7	177	-67.2	175.9	0	0	0	110.4	L223 E229 I230 L290	L223-L225 PolarHBondContact O-N 3.06Å; L225-E229 WeakPolarHBondContact CA-OE2 3.25Å; L225-E229 HydrophobicContact CB-CB 4.25Å; L225-E229 HydrophobicContact CD2-CB 4.21Å; L225-E229 WeakPolarHBondContact CD2-OE2 3.49Å; L225-I230 HydrophobicContact CB-CD1 4.19Å; L225-I230 HydrophobicContact CB-CG1 3.65Å; L225-I230 HydrophobicContact CD1-CG1 4.33Å; L225-L290 HydrophobicContact CD1-CD1 4.35Å
226	R	80.8	Confident	66.7	Low	175 Å²	175	110.6 Å²	110.6	66%	0.66	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-69.9	153.1	172	-69.5	-178.8	-100.9	-163.2	-10	110.1	S228 E229 I230	R226-S228 PolarHBondContact O-N 3.26Å; R226-E229 HydrophobicContact CB-CG 4.3Å; R226-E229 PolarHBondContact N-OE2 3.27Å; R226-E229 IonicContact NE-OE1 2.73Å; R226-E229 PolarHBondContact NE-OE1 3.29Å; R226-E229 IonicContact NH2-OE1 3.73Å; R226-E229 WeakPolarHBondContact O-CA 3.49Å; R226-E229 WeakPolarHBondContact O-CB 3.24Å; R226-E229 PolarHBondContact O-N 3.06Å; R226-I230 WeakPolarHBondContact O-CG1 3.42Å; R226-I230 PolarHBondContact O-N 3.16Å
227	D	85.2	Confident	69.5	Low	74 Å²	74	100.3 Å²	100.3	40%	0.396	51%	0.506	S	S	.	.	H	α-helix	trans	-48	-40.7	177.8	-75.1	-5.9	0	0	0	113	I230 L231 F280 K286	D227-I230 PolarHBondContact O-N 3.49Å; D227-L231 WeakPolarHBondContact O-CG 3.27Å; D227-L231 PolarHBondContact O-N 3.46Å; D227-F280 HydrophobicContact CB-CE1 4.24Å; D227-F280 HydrophobicContact CB-CZ 4.43Å; D227-K286 WeakPolarHBondContact OD1-CD 3.49Å; D227-K286 IonicContact OD1-NZ 3.47Å; D227-K286 PolarHBondContact OD1-NZ 2.98Å; D227-K286 IonicContact OD2-NZ 3.68Å; D227-K286 PolarHBondContact OD2-NZ 3.26Å
228	S	86	Confident	72.2	Confident	74 Å²	74	89.4 Å²	89.4	52%	0.517	47%	0.466	S	S	.	.	H	α-helix	trans	-64.4	-41	177.3	55.6	0	0	0	0	113	R226 I230 L231 E232	R226-S228 PolarHBondContact O-N 3.26Å; S228-I230 VanDerWaalsContact C-N 3.32Å; S228-L231 PolarHBondContact O-N 2.69Å; S228-E232 WeakPolarHBondContact O-CG 3.46Å; S228-E232 PolarHBondContact O-N 3.07Å
229	E	89.1	Confident	75	Confident	73 Å²	73	81.5 Å²	81.5	34%	0.341	43%	0.432	S	S	.	.	H	α-helix	trans	-68.3	-36.4	178.6	-63.2	164.6	173	0	0	110.4	L225 R226 E233	L225-E229 WeakPolarHBondContact CA-OE2 3.25Å; L225-E229 HydrophobicContact CB-CB 4.25Å; L225-E229 HydrophobicContact CD2-CB 4.21Å; L225-E229 WeakPolarHBondContact CD2-OE2 3.49Å; R226-E229 HydrophobicContact CB-CG 4.3Å; R226-E229 PolarHBondContact N-OE2 3.27Å; R226-E229 IonicContact NE-OE1 2.73Å; R226-E229 PolarHBondContact NE-OE1 3.29Å; R226-E229 IonicContact NH2-OE1 3.73Å; R226-E229 WeakPolarHBondContact O-CA 3.49Å; R226-E229 WeakPolarHBondContact O-CB 3.24Å; R226-E229 PolarHBondContact O-N 3.06Å; E229-E233 WeakPolarHBondContact O-CB 3.05Å; E229-E233 PolarHBondContact O-N 2.96Å
230	I	87.3	Confident	77.6	Confident	2 Å²	2	83.9 Å²	83.9	1%	0.01	44%	0.437	C	S	.	.	H	α-helix	trans	-66.6	-43.8	175.6	-60.9	170.8	0	0	0	110.9	L225 R226 D227 S228 E233 L234 F280 K286 E287 L290	L225-I230 HydrophobicContact CB-CD1 4.19Å; L225-I230 HydrophobicContact CB-CG1 3.65Å; L225-I230 HydrophobicContact CD1-CG1 4.33Å; R226-I230 WeakPolarHBondContact O-CG1 3.42Å; R226-I230 PolarHBondContact O-N 3.16Å; D227-I230 PolarHBondContact O-N 3.49Å; S228-I230 VanDerWaalsContact C-N 3.32Å; I230-E233 PolarHBondContact O-N 3.19Å; I230-L234 HydrophobicContact CG2-CD1 4.26Å; I230-L234 WeakPolarHBondContact O-CB 3.4Å; I230-L234 WeakPolarHBondContact O-CG 3.47Å; I230-L234 PolarHBondContact O-N 3.45Å; I230-F280 HydrophobicContact CB-CE2 4.35Å; I230-F280 HydrophobicContact CB-CZ 4.22Å; I230-F280 HydrophobicContact CG2-CE2 3.68Å; I230-F280 HydrophobicContact CG2-CZ 4.05Å; I230-K286 HydrophobicContact CD1-CB 3.83Å; I230-K286 HydrophobicContact CG2-CB 4.29Å; I230-E287 HydrophobicContact CD1-CB 4.16Å; I230-L290 HydrophobicContact CB-CD1 4.26Å; I230-L290 HydrophobicContact CG1-CD1 4.32Å; I230-L290 HydrophobicContact CG2-CD1 3.76Å; I230-L290 HydrophobicContact CG2-CG 3.91Å
231	L	88.6	Confident	80.3	Confident	32 Å²	32	76.5 Å²	76.5	17%	0.168	41%	0.413	C	S	.	.	H	α-helix	trans	-64.5	-42.3	176.5	-76.4	172.4	0	0	0	112.3	D227 S228 E233 L234 K235 F280 L312	D227-L231 WeakPolarHBondContact O-CG 3.27Å; D227-L231 PolarHBondContact O-N 3.46Å; S228-L231 PolarHBondContact O-N 2.69Å; L231-E233 VanDerWaalsContact C-N 3.34Å; L231-L234 HydrophobicContact CD2-CD1 4.37Å; L231-L234 WeakPolarHBondContact O-CB 3.17Å; L231-L234 PolarHBondContact O-N 3.46Å; L231-K235 WeakPolarHBondContact O-CG 3.36Å; L231-K235 PolarHBondContact O-N 3.18Å; L231-F280 HydrophobicContact CD1-CD1 4.23Å; L231-F280 HydrophobicContact CD1-CE1 3.73Å; L231-F280 HydrophobicContact CD1-CZ 4.17Å; L231-F280 HydrophobicContact CD2-CD1 3.82Å; L231-F280 HydrophobicContact CD2-CD2 3.82Å; L231-F280 HydrophobicContact CD2-CE1 3.72Å; L231-F280 HydrophobicContact CD2-CE2 3.73Å; L231-F280 HydrophobicContact CD2-CG 3.88Å; L231-F280 HydrophobicContact CD2-CZ 3.69Å; L231-F280 HydrophobicContact CG-CD1 4.13Å; L231-F280 HydrophobicContact CG-CE1 3.53Å; L231-F280 HydrophobicContact CG-CE2 3.99Å; L231-F280 HydrophobicContact CG-CZ 3.47Å; L231-F280 VanDerWaalsContact CG-CZ 3.47Å; L231-L312 HydrophobicContact CD2-CD1 4.3Å; L231-L312 HydrophobicContact CD2-CD2 4.4Å
232	E	90	Very high	83.1	Confident	105 Å²	105	74.7 Å²	74.7	49%	0.491	40%	0.398	S	S	.	.	H	α-helix	trans	-62.1	-43.6	175.4	-73.1	-53.6	133.5	0	0	111.2	S228 L234 K235 T236	S228-E232 WeakPolarHBondContact O-CG 3.46Å; S228-E232 PolarHBondContact O-N 3.07Å; E232-L234 VanDerWaalsContact C-N 3.33Å; E232-L234 PolarHBondContact O-N 3.46Å; E232-K235 WeakPolarHBondContact O-CB 2.79Å; E232-K235 PolarHBondContact O-N 3.11Å; E232-K235 IonicContact OE1-NZ 3.35Å; E232-K235 PolarHBondContact OE1-NZ 3.12Å; E232-T236 WeakPolarHBondContact O-CG2 3.27Å; E232-T236 PolarHBondContact O-N 2.85Å
233	E	90.2	Very high	85.4	Confident	70 Å²	70	69.8 Å²	69.8	33%	0.327	37%	0.368	S	S	.	.	H	α-helix	trans	-66.1	-34.2	174.6	-174.7	70.7	175	0	0	112.4	E229 I230 L231 T236 I237 L290 K294	E229-E233 WeakPolarHBondContact O-CB 3.05Å; E229-E233 PolarHBondContact O-N 2.96Å; I230-E233 PolarHBondContact O-N 3.19Å; L231-E233 VanDerWaalsContact C-N 3.34Å; E233-T236 PolarHBondContact O-N 2.8Å; E233-T236 PolarHBondContact O-OG1 3.37Å; E233-I237 PolarHBondContact O-N 3.21Å; E233-L290 HydrophobicContact CB-CD1 4.06Å; E233-L290 HydrophobicContact CB-CD2 3.85Å; E233-L290 HydrophobicContact CG-CD1 3.93Å; E233-L290 HydrophobicContact CG-CD2 3.54Å; E233-L290 HydrophobicContact CG-CG 4.39Å; E233-K294 WeakPolarHBondContact OE1-CE 3.46Å; E233-K294 IonicContact OE1-NZ 3.01Å; E233-K294 PolarHBondContact OE1-NZ 3.05Å
234	L	90.7	Very high	87.7	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-62.4	-45.4	173.1	-81.2	168.5	0	0	0	110.5	I230 L231 E232 T236 I237 V238 F280 L290 I293 L318	I230-L234 HydrophobicContact CG2-CD1 4.26Å; I230-L234 WeakPolarHBondContact O-CB 3.4Å; I230-L234 WeakPolarHBondContact O-CG 3.47Å; I230-L234 PolarHBondContact O-N 3.45Å; L231-L234 HydrophobicContact CD2-CD1 4.37Å; L231-L234 WeakPolarHBondContact O-CB 3.17Å; L231-L234 PolarHBondContact O-N 3.46Å; E232-L234 VanDerWaalsContact C-N 3.33Å; E232-L234 PolarHBondContact O-N 3.46Å; L234-T236 PolarHBondContact O-N 2.79Å; L234-I237 HydrophobicContact CD2-CD1 4.23Å; L234-I237 VanDerWaalsContact O-CG1 3.3Å; L234-I237 WeakPolarHBondContact O-CG1 3.24Å; L234-I237 PolarHBondContact O-N 2.98Å; L234-V238 WeakPolarHBondContact O-CG1 3.39Å; L234-V238 VanDerWaalsContact O-CG2 3.27Å; L234-V238 WeakPolarHBondContact O-CG2 3.46Å; L234-V238 PolarHBondContact O-N 2.97Å; L234-F280 HydrophobicContact CD1-CD2 3.92Å; L234-F280 HydrophobicContact CD1-CE2 3.8Å; L234-L290 HydrophobicContact CB-CD2 4.38Å; L234-L290 HydrophobicContact CD2-CD2 3.74Å; L234-L290 HydrophobicContact CD2-CG 4.37Å; L234-L290 HydrophobicContact CG-CD2 3.63Å; L234-L290 HydrophobicContact CG-CG 4.24Å; L234-I293 HydrophobicContact CD2-CG1 4.42Å; L234-L318 HydrophobicContact CD2-CD1 4.36Å; L234-L318 HydrophobicContact CD2-CD2 4.12Å
235	K	91.7	Very high	89.5	Confident	94 Å²	94	68.6 Å²	68.6	41%	0.409	36%	0.358	S	S	.	.	H	α-helix	trans	-58.2	-31	177.4	-70.7	171.8	-171.3	171.8	0	112.8	L231 E232 L312	L231-K235 WeakPolarHBondContact O-CG 3.36Å; L231-K235 PolarHBondContact O-N 3.18Å; E232-K235 WeakPolarHBondContact O-CB 2.79Å; E232-K235 PolarHBondContact O-N 3.11Å; E232-K235 IonicContact OE1-NZ 3.35Å; E232-K235 PolarHBondContact OE1-NZ 3.12Å; K235-L312 HydrophobicContact CG-CD2 3.91Å
236	T	92.2	Very high	90.9	Very high	99 Å²	99	68 Å²	68	61%	0.607	35%	0.351	S	S	*	.	H	α-helix	trans	-75.9	-22.2	177.9	69.4	0	0	0	0	113.5	E232 E233 L234	E232-T236 WeakPolarHBondContact O-CG2 3.27Å; E232-T236 PolarHBondContact O-N 2.85Å; E233-T236 PolarHBondContact O-N 2.8Å; E233-T236 PolarHBondContact O-OG1 3.37Å; L234-T236 PolarHBondContact O-N 2.79Å
237	I	91.4	Very high	91.7	Very high	22 Å²	22	60.3 Å²	60.3	11%	0.113	32%	0.322	C	S	.	.	H	α-helix	trans	-105.9	-23.8	-174.7	66.8	177.8	0	0	0	114.4	E233 L234 L290 I293 K294 K297	E233-I237 PolarHBondContact O-N 3.21Å; L234-I237 HydrophobicContact CD2-CD1 4.23Å; L234-I237 VanDerWaalsContact O-CG1 3.3Å; L234-I237 WeakPolarHBondContact O-CG1 3.24Å; L234-I237 PolarHBondContact O-N 2.98Å; I237-L290 HydrophobicContact CD1-CD2 3.79Å; I237-I293 HydrophobicContact CD1-CB 3.81Å; I237-I293 HydrophobicContact CD1-CG2 3.61Å; I237-I293 HydrophobicContact CG1-CG2 4.01Å; I237-K294 HydrophobicContact CD1-CG 4.18Å; I237-K297 PolarHBondContact O-NZ 2.9Å
238	V	93.6	Very high	92.3	Very high	15 Å²	15	61.4 Å²	61.4	9%	0.091	33%	0.325	C	S	.	.	S	Bend	trans	-85.2	166.6	177.6	-56.4	0	0	0	0	111.8	L234 L312 L318	L234-V238 WeakPolarHBondContact O-CG1 3.39Å; L234-V238 VanDerWaalsContact O-CG2 3.27Å; L234-V238 WeakPolarHBondContact O-CG2 3.46Å; L234-V238 PolarHBondContact O-N 2.97Å; V238-L312 HydrophobicContact CG2-CB 4.13Å; V238-L318 HydrophobicContact CG1-CD1 3.9Å
239	S	94.1	Very high	92.8	Very high	28 Å²	28	61 Å²	61	20%	0.196	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-78.1	138.9	174.6	-168.6	0	0	0	0	111	A241 E309 S310	S239-A241 VanDerWaalsContact C-N 3.29Å; S239-E309 WeakPolarHBondContact CB-OE1 3.36Å; S239-E309 PolarHBondContact OG-OE1 3.25Å; S239-S310 WeakPolarHBondContact CB-O 3.47Å; S239-S310 PolarHBondContact N-O 3.48Å
240	N	92.5	Very high	93.1	Very high	152 Å²	152	61.5 Å²	61.5	81%	0.813	32%	0.321	S	S	*	.			trans	-82.7	-3.6	177.4	-67	-26.4	0	0	0	113.4
241	A	93	Very high	93.4	Very high	43 Å²	43	64.4 Å²	64.4	36%	0.355	34%	0.342	S	S	.	.	S	Bend	trans	-74.5	155.7	179.5	0	0	0	0	0	111.6	S239 P243 K246 F311	S239-A241 VanDerWaalsContact C-N 3.29Å; A241-P243 WeakPolarHBondContact O-CD 3.44Å; A241-K246 HydrophobicContact CB-CD 4.33Å; A241-F311 HydrophobicContact CB-CE1 4.19Å; A241-F311 WeakPolarHBondContact O-CD1 3.14Å
242	N	92.5	Very high	93.7	Very high	66 Å²	66	68.3 Å²	68.3	35%	0.353	36%	0.357	S	S	.	.			trans	-77.4	116.5	173.4	-177.4	2	0	0	0	110	T244 E245	N242-T244 PolarHBondContact ND2-OG1 2.93Å; N242-T244 PolarHBondContact O-N 3.45Å; N242-T244 PolarHBondContact OD1-N 2.79Å; N242-T244 PolarHBondContact OD1-OG1 2.54Å; N242-E245 HydrophobicContact CB-CG 4.14Å; N242-E245 PolarHBondContact ND2-OE1 3.26Å; N242-E245 VanDerWaalsContact ND2-OE1 3.11Å; N242-E245 PolarHBondContact O-N 3.26Å
243	P	94.7	Very high	93.8	Very high	4 Å²	4	66.9 Å²	66.9	3%	0.026	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-65.2	-26.4	-176.8	22.2	-29.9	0	0	0	113.5	A241 E245 K246 Y247 F311 V313 W319	A241-P243 WeakPolarHBondContact O-CD 3.44Å; P243-E245 PolarHBondContact O-N 3.05Å; P243-K246 PolarHBondContact O-N 2.8Å; P243-Y247 HydrophobicContact CB-CD2 4.4Å; P243-Y247 PolarHBondContact O-N 2.88Å; P243-F311 HydrophobicContact CB-CB 4.26Å; P243-F311 HydrophobicContact CB-CD1 4.07Å; P243-F311 HydrophobicContact CB-CD2 3.77Å; P243-F311 HydrophobicContact CB-CE1 4.34Å; P243-F311 HydrophobicContact CB-CE2 4.09Å; P243-F311 HydrophobicContact CB-CG 3.75Å; P243-F311 HydrophobicContact CB-CZ 4.36Å; P243-F311 HydrophobicContact CG-CB 3.89Å; P243-F311 HydrophobicContact CG-CD1 4.25Å; P243-F311 HydrophobicContact CG-CD2 4.33Å; P243-F311 HydrophobicContact CG-CG 3.9Å; P243-V313 HydrophobicContact CG-CG2 3.37Å; P243-W319 HydrophobicContact CB-CE3 3.8Å; P243-W319 HydrophobicContact CB-CZ3 3.99Å; P243-W319 HydrophobicContact CG-CD2 4.43Å; P243-W319 HydrophobicContact CG-CE3 3.91Å; P243-W319 HydrophobicContact CG-CZ3 4.13Å
244	T	93.6	Very high	93.5	Very high	84 Å²	84	64.7 Å²	64.7	52%	0.515	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-69.4	-16.9	178.8	63.8	0	0	0	0	113	N242	N242-T244 PolarHBondContact ND2-OG1 2.93Å; N242-T244 PolarHBondContact O-N 3.45Å; N242-T244 PolarHBondContact OD1-N 2.79Å; N242-T244 PolarHBondContact OD1-OG1 2.54Å
245	E	95.4	Very high	93.2	Very high	141 Å²	141	68.4 Å²	68.4	66%	0.659	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-86.2	-13.5	173.3	-67.2	168	-155.6	0	0	112.5	N242 P243 L267	N242-E245 HydrophobicContact CB-CG 4.14Å; N242-E245 PolarHBondContact ND2-OE1 3.26Å; N242-E245 VanDerWaalsContact ND2-OE1 3.11Å; N242-E245 PolarHBondContact O-N 3.26Å; P243-E245 PolarHBondContact O-N 3.05Å; E245-L267 WeakPolarHBondContact O-CD1 3.48Å
246	K	96.9	Very high	92.3	Very high	76 Å²	76	66.4 Å²	66.4	33%	0.33	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-29.5	-178.9	-73	-179.1	130.3	-175.6	0	113.2	A241 P243 L267 E309 F311	A241-K246 HydrophobicContact CB-CD 4.33Å; P243-K246 PolarHBondContact O-N 2.8Å; K246-L267 PolarHBondContact O-N 2.74Å; K246-E309 IonicContact NZ-OE1 2.65Å; K246-E309 PolarHBondContact NZ-OE1 3.4Å; K246-E309 IonicContact NZ-OE2 3.78Å; K246-E309 PolarHBondContact NZ-OE2 3.2Å; K246-F311 HydrophobicContact CD-CE1 4.36Å; K246-F311 HydrophobicContact CD-CZ 4.14Å
247	Y	97.6	Very high	91.2	Very high	12 Å²	12	66.4 Å²	66.4	5%	0.047	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	134.6	-171.7	-56.1	-80.3	0	0	0	111.9	P243 K265 M266 V273 I275 F311 V321	P243-Y247 HydrophobicContact CB-CD2 4.4Å; P243-Y247 PolarHBondContact O-N 2.88Å; Y247-K265 WeakPolarHBondContact CA-O 3.38Å; Y247-M266 HydrophobicContact CD1-CB 4.11Å; Y247-M266 HydrophobicContact CD1-CG 4.41Å; Y247-M266 HydrophobicContact CE1-CB 3.98Å; Y247-M266 HydrophobicContact CE1-CE 3.73Å; Y247-M266 HydrophobicContact CE1-CG 3.99Å; Y247-V273 HydrophobicContact CD1-CG2 3.78Å; Y247-V273 HydrophobicContact CE1-CG2 3.96Å; Y247-I275 HydrophobicContact CD1-CD1 4.37Å; Y247-I275 HydrophobicContact CD2-CD1 4.42Å; Y247-I275 HydrophobicContact CG-CD1 3.96Å; Y247-F311 HydrophobicContact CD2-CE2 4.33Å; Y247-F311 AromaticContact CE2-CE2 3.68Å; Y247-F311 HydrophobicContact CE2-CE2 3.68Å; Y247-F311 AromaticContact CE2-CZ 3.8Å; Y247-F311 HydrophobicContact CE2-CZ 3.8Å; Y247-V321 HydrophobicContact CD1-CG1 4.41Å; Y247-V321 HydrophobicContact CD2-CG2 4.36Å; Y247-V321 HydrophobicContact CE1-CG1 3.75Å; Y247-V321 HydrophobicContact CE2-CG1 4.44Å; Y247-V321 HydrophobicContact CE2-CG2 3.93Å
248	E	97	Very high	90.4	Very high	97 Å²	97	66 Å²	66	45%	0.453	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	114.5	168.1	-177.3	-177.5	-172.6	0	0	109	L250 A264 K265 L267	E248-L250 HydrophobicContact CG-CD2 4.22Å; E248-L250 PolarHBondContact O-N 2.83Å; E248-A264 CarbonylContact O-C 3.48Å; E248-A264 WeakPolarHBondContact O-CA 3.18Å; E248-A264 VanDerWaalsContact O-CB 3.29Å; E248-A264 WeakPolarHBondContact O-CB 3.48Å; E248-K265 PolarHBondContact N-O 2.83Å; E248-K265 PolarHBondContact O-N 2.84Å; E248-L267 HydrophobicContact CB-CD2 3.97Å
249	L	96	Very high	90	Very high	66 Å²	66	66.2 Å²	66.2	35%	0.346	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	125.6	172.1	-69.6	-179	0	0	0	109.6	F262 A264 I275 W319	L249-F262 HydrophobicContact CD2-CB 3.8Å; L249-F262 HydrophobicContact CD2-CG 4.28Å; L249-A264 HydrophobicContact CD2-CB 4.09Å; L249-I275 HydrophobicContact CD2-CB 4.22Å; L249-I275 HydrophobicContact CD2-CD1 3.89Å; L249-I275 HydrophobicContact CD2-CG1 4.42Å; L249-W319 HydrophobicContact CD1-CH2 3.55Å; L249-W319 HydrophobicContact CD1-CZ2 4.08Å; L249-W319 HydrophobicContact CD1-CZ3 4.17Å; L249-W319 HydrophobicContact CD2-CH2 4.5Å; L249-W319 HydrophobicContact CD2-CZ3 4.32Å; L249-W319 HydrophobicContact CG-CH2 4.09Å; L249-W319 HydrophobicContact CG-CZ3 4.25Å
250	L	95.8	Very high	89.8	Confident	84 Å²	84	70.3 Å²	70.3	44%	0.44	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-94.4	179.7	-57.1	176.5	0	0	0	110	E248 L263 K265	E248-L250 HydrophobicContact CG-CD2 4.22Å; E248-L250 PolarHBondContact O-N 2.83Å; L250-L263 WeakPolarHBondContact CA-O 3.48Å; L250-L263 HydrophobicContact CB-CB 4.42Å; L250-L263 WeakPolarHBondContact CB-O 3.4Å; L250-L263 HydrophobicContact CD1-CD2 4.12Å; L250-L263 HydrophobicContact CD1-CG 4.19Å; L250-L263 PolarHBondContact N-O 3.08Å; L250-K265 HydrophobicContact CD1-CB 4.37Å
251	S	95.1	Very high	89.8	Confident	62 Å²	62	64.6 Å²	64.6	43%	0.434	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	148.3	-176.1	60.8	0	0	0	0	111.7	I253 F262 L263	S251-I253 PolarHBondContact O-N 3.21Å; S251-F262 WeakPolarHBondContact O-CA 3.5Å; S251-L263 PolarHBondContact O-N 3.33Å
252	K	94.6	Very high	90	Very high	115 Å²	115	64.8 Å²	64.8	50%	0.5	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	124.4	169.4	-174.3	-175.9	175.6	-167.9	0	110.2	G254 S255 F262	K252-G254 WeakPolarHBondContact CE-O 3.27Å; K252-S255 WeakPolarHBondContact CE-OG 3.47Å; K252-S255 PolarHBondContact NZ-OG 3.33Å; K252-F262 HydrophobicContact CB-CD1 3.91Å; K252-F262 HydrophobicContact CB-CE1 3.77Å; K252-F262 HydrophobicContact CG-CD1 4.46Å; K252-F262 HydrophobicContact CG-CE1 4.2Å; K252-F262 HydrophobicContact CG-CZ 4.5Å
253	I	91	Very high	90.2	Very high	74 Å²	74	63 Å²	63	38%	0.379	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	-18	-179.1	58.6	172.8	0	0	0	113.5	S251 V261 L263 A274 Y324	S251-I253 PolarHBondContact O-N 3.21Å; I253-V261 HydrophobicContact CD1-CG1 3.89Å; I253-V261 HydrophobicContact CG1-CB 4.15Å; I253-V261 HydrophobicContact CG1-CG1 3.82Å; I253-V261 WeakPolarHBondContact CG1-O 3.46Å; I253-V261 PolarHBondContact N-O 3.44Å; I253-L263 HydrophobicContact CG2-CB 3.79Å; I253-A274 HydrophobicContact CD1-CB 4.42Å; I253-Y324 HydrophobicContact CD1-CD2 4.04Å; I253-Y324 HydrophobicContact CD1-CE2 3.74Å
254	G	84.8	Confident	90.4	Very high	25 Å²	25	62.8 Å²	62.8	26%	0.258	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	167	-178.1	0	0	0	0	0	114.7	K252 V261	K252-G254 WeakPolarHBondContact CE-O 3.27Å; G254-V261 PolarHBondContact N-O 2.98Å; G254-V261 VanDerWaalsContact N-O 3.12Å; G254-V261 PolarHBondContact O-N 3.44Å
255	S	83.6	Confident	90.6	Very high	78 Å²	78	61.6 Å²	61.6	55%	0.545	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	128	168.3	-66.6	0	0	0	0	109	K252	K252-S255 WeakPolarHBondContact CE-OG 3.47Å; K252-S255 PolarHBondContact NZ-OG 3.33Å
256	G	73.6	Confident	90.7	Very high	52 Å²	52	56.2 Å²	56.2	54%	0.536	32%	0.324	S	S	.	.			trans	-122.9	-176	175.9	0	0	0	0	0	111.2	S258 G259	G256-S258 PolarHBondContact O-N 3.33Å; G256-G259 PolarHBondContact N-O 3.2Å; G256-G259 PolarHBondContact O-N 3.26Å
257	A	69.6	Low	90.7	Very high	99 Å²	99	56.9 Å²	56.9	82%	0.818	33%	0.331	S	S	*	.	S	Bend	trans	-60.1	-34.5	176.6	0	0	0	0	0	112.4
258	S	74.3	Confident	90.6	Very high	13 Å²	13	61.1 Å²	61.1	9%	0.091	36%	0.363	C	S	.	.	S	Bend	trans	-82.5	-23.8	-177	-38.9	0	0	0	0	113.6	G256 M278 Q283	G256-S258 PolarHBondContact O-N 3.33Å; S258-M278 WeakPolarHBondContact O-CB 3.46Å; S258-M278 VanDerWaalsContact O-CG 3.29Å; S258-M278 WeakPolarHBondContact O-CG 3.34Å; S258-Q283 PolarHBondContact O-NE2 3.12Å
259	G	83.5	Confident	90.5	Very high	19 Å²	19	60.5 Å²	60.5	20%	0.196	37%	0.366	C	S	.	.			trans	163.2	-165.3	-174.5	0	0	0	0	0	115.5	G256 C277	G256-G259 PolarHBondContact N-O 3.2Å; G256-G259 PolarHBondContact O-N 3.26Å; G259-C277 WeakPolarHBondContact CA-O 3.47Å
260	K	90.9	Very high	90.5	Very high	114 Å²	114	62.1 Å²	62.1	50%	0.496	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	143.1	-179.5	-62	169.7	-169.6	165.5	0	109.6	F262 K276 C277	K260-F262 HydrophobicContact CB-CD2 4.34Å; K260-F262 HydrophobicContact CB-CE2 3.61Å; K260-F262 HydrophobicContact CB-CZ 4.2Å; K260-F262 HydrophobicContact CD-CE2 4.35Å; K260-F262 HydrophobicContact CD-CZ 4.28Å; K260-K276 CarbonylContact O-C 3.56Å; K260-K276 WeakPolarHBondContact O-CA 3.26Å; K260-C277 PolarHBondContact N-O 2.82Å; K260-C277 PolarHBondContact O-N 2.81Å
261	V	93.5	Very high	90.5	Very high	33 Å²	33	63 Å²	63	20%	0.2	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.2	175.5	-171.1	0	0	0	0	109.3	I253 G254 A274 I275 K276	I253-V261 HydrophobicContact CD1-CG1 3.89Å; I253-V261 HydrophobicContact CG1-CB 4.15Å; I253-V261 HydrophobicContact CG1-CG1 3.82Å; I253-V261 WeakPolarHBondContact CG1-O 3.46Å; I253-V261 PolarHBondContact N-O 3.44Å; G254-V261 PolarHBondContact N-O 2.98Å; G254-V261 VanDerWaalsContact N-O 3.12Å; G254-V261 PolarHBondContact O-N 3.44Å; V261-A274 HydrophobicContact CG1-CB 4.26Å; V261-I275 CarbonylContact C-O 3.58Å; V261-I275 WeakPolarHBondContact CA-O 3.41Å; V261-K276 HydrophobicContact CG2-CB 4.28Å; V261-K276 HydrophobicContact CG2-CG 4.19Å
262	F	96.6	Very high	90.6	Very high	46 Å²	46	62.9 Å²	62.9	20%	0.202	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	143	179.4	-65.9	-93.9	0	0	0	110.7	L249 S251 K252 K260 A274 I275 C277	L249-F262 HydrophobicContact CD2-CB 3.8Å; L249-F262 HydrophobicContact CD2-CG 4.28Å; S251-F262 WeakPolarHBondContact O-CA 3.5Å; K252-F262 HydrophobicContact CB-CD1 3.91Å; K252-F262 HydrophobicContact CB-CE1 3.77Å; K252-F262 HydrophobicContact CG-CD1 4.46Å; K252-F262 HydrophobicContact CG-CE1 4.2Å; K252-F262 HydrophobicContact CG-CZ 4.5Å; K260-F262 HydrophobicContact CB-CD2 4.34Å; K260-F262 HydrophobicContact CB-CE2 3.61Å; K260-F262 HydrophobicContact CB-CZ 4.2Å; K260-F262 HydrophobicContact CD-CE2 4.35Å; K260-F262 HydrophobicContact CD-CZ 4.28Å; F262-A274 CarbonylContact O-C 3.52Å; F262-A274 WeakPolarHBondContact O-CA 3.31Å; F262-I275 PolarHBondContact N-O 2.97Å; F262-I275 PolarHBondContact O-N 2.94Å; F262-C277 HydrophobicContact CE2-CB 4.33Å
263	L	97.2	Very high	90.7	Very high	29 Å²	29	57.4 Å²	57.4	15%	0.152	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	137.1	160.3	-167.8	69	0	0	0	108	L250 S251 I253 T272 Y324	L250-L263 WeakPolarHBondContact CA-O 3.48Å; L250-L263 HydrophobicContact CB-CB 4.42Å; L250-L263 WeakPolarHBondContact CB-O 3.4Å; L250-L263 HydrophobicContact CD1-CD2 4.12Å; L250-L263 HydrophobicContact CD1-CG 4.19Å; L250-L263 PolarHBondContact N-O 3.08Å; S251-L263 PolarHBondContact O-N 3.33Å; I253-L263 HydrophobicContact CG2-CB 3.79Å; L263-T272 HydrophobicContact CD1-CG2 3.32Å; L263-T272 HydrophobicContact CD2-CG2 4.46Å; L263-T272 HydrophobicContact CG-CG2 3.94Å; L263-Y324 HydrophobicContact CD1-CD1 3.47Å; L263-Y324 VanDerWaalsContact CD1-CD1 3.47Å; L263-Y324 HydrophobicContact CD1-CD2 3.81Å; L263-Y324 HydrophobicContact CD1-CE1 3.42Å; L263-Y324 VanDerWaalsContact CD1-CE1 3.42Å; L263-Y324 HydrophobicContact CD1-CE2 3.83Å; L263-Y324 HydrophobicContact CD1-CG 3.65Å
264	A	97.9	Very high	91	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	159.9	177.5	0	0	0	0	0	111.1	E248 L249 T272 V273 I275	E248-A264 CarbonylContact O-C 3.48Å; E248-A264 WeakPolarHBondContact O-CA 3.18Å; E248-A264 VanDerWaalsContact O-CB 3.29Å; E248-A264 WeakPolarHBondContact O-CB 3.48Å; L249-A264 HydrophobicContact CD2-CB 4.09Å; A264-T272 WeakPolarHBondContact O-CA 3.45Å; A264-V273 HydrophobicContact CB-CG2 3.9Å; A264-V273 PolarHBondContact N-O 2.77Å; A264-V273 PolarHBondContact O-N 3.38Å; A264-I275 HydrophobicContact CB-CD1 3.53Å; A264-I275 HydrophobicContact CB-CG1 3.79Å
265	K	97.8	Very high	91.6	Very high	58 Å²	58	53 Å²	53	25%	0.252	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	131.1	172.5	-165.1	160.6	84.6	163.5	0	110.5	Y247 E248 L250 L267 D270	Y247-K265 WeakPolarHBondContact CA-O 3.38Å; E248-K265 PolarHBondContact N-O 2.83Å; E248-K265 PolarHBondContact O-N 2.84Å; L250-K265 HydrophobicContact CD1-CB 4.37Å; K265-L267 PolarHBondContact O-N 2.93Å; K265-D270 HydrophobicContact CD-CB 4.4Å; K265-D270 WeakPolarHBondContact CD-OD1 3.32Å; K265-D270 VanDerWaalsContact CE-CG 3.49Å; K265-D270 WeakPolarHBondContact CE-OD1 3.09Å; K265-D270 IonicContact NZ-OD1 2.87Å; K265-D270 PolarHBondContact NZ-OD1 3.14Å; K265-D270 IonicContact NZ-OD2 2.68Å; K265-D270 PolarHBondContact NZ-OD2 3.3Å
266	M	97.3	Very high	92	Very high	28 Å²	28	50 Å²	50	14%	0.138	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	119.2	171.1	-175.1	-177.8	-68	0	0	109.2	Y247 S268 T269 D270 Q271 V273	Y247-M266 HydrophobicContact CD1-CB 4.11Å; Y247-M266 HydrophobicContact CD1-CG 4.41Å; Y247-M266 HydrophobicContact CE1-CB 3.98Å; Y247-M266 HydrophobicContact CE1-CE 3.73Å; Y247-M266 HydrophobicContact CE1-CG 3.99Å; M266-S268 VanDerWaalsContact C-N 3.26Å; M266-S268 WeakPolarHBondContact CG-OG 3.36Å; M266-S268 PolarHBondContact O-N 2.85Å; M266-T269 PolarHBondContact O-N 3.42Å; M266-T269 HydrophobicContact SD-CG2 4.03Å; M266-T269 PolarHBondContact SD-OG1 3.32Å; M266-D270 WeakPolarHBondContact O-CA 3.4Å; M266-D270 PolarHBondContact O-N 2.85Å; M266-Q271 HydrophobicContact CB-CB 4.36Å; M266-Q271 PolarHBondContact N-O 2.81Å; M266-V273 HydrophobicContact CE-CG1 4.47Å
267	L	96.8	Very high	92.9	Very high	90 Å²	90	48.5 Å²	48.5	47%	0.471	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-25.6	-171.5	-67.5	177	0	0	0	113.7	E245 K246 E248 K265	E245-L267 WeakPolarHBondContact O-CD1 3.48Å; K246-L267 PolarHBondContact O-N 2.74Å; E248-L267 HydrophobicContact CB-CD2 3.97Å; K265-L267 PolarHBondContact O-N 2.93Å
268	S	95.7	Very high	93.9	Very high	102 Å²	102	43.8 Å²	43.8	71%	0.713	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-25.9	-178.4	54.6	0	0	0	0	114.5	M266	M266-S268 VanDerWaalsContact C-N 3.26Å; M266-S268 WeakPolarHBondContact CG-OG 3.36Å; M266-S268 PolarHBondContact O-N 2.85Å
269	T	95.9	Very high	94.6	Very high	83 Å²	83	46 Å²	46	51%	0.509	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128	-6.8	-169.9	59.3	0	0	0	0	114.1	M266 Q271	M266-T269 PolarHBondContact O-N 3.42Å; M266-T269 HydrophobicContact SD-CG2 4.03Å; M266-T269 PolarHBondContact SD-OG1 3.32Å; T269-Q271 PolarHBondContact O-N 3.25Å; T269-Q271 VanDerWaalsContact O-N 3.16Å; T269-Q271 VanDerWaalsContact OG1-CB 3.25Å; T269-Q271 WeakPolarHBondContact OG1-CB 3.45Å; T269-Q271 PolarHBondContact OG1-N 3.33Å
270	D	94.8	Very high	94.8	Very high	100 Å²	100	45.3 Å²	45.3	54%	0.535	24%	0.243	S	C	.	.			trans	62.6	8.5	-168.7	-127.8	53.9	0	0	0	114.5	K265 M266 T272	K265-D270 HydrophobicContact CD-CB 4.4Å; K265-D270 WeakPolarHBondContact CD-OD1 3.32Å; K265-D270 VanDerWaalsContact CE-CG 3.49Å; K265-D270 WeakPolarHBondContact CE-OD1 3.09Å; K265-D270 IonicContact NZ-OD1 2.87Å; K265-D270 PolarHBondContact NZ-OD1 3.14Å; K265-D270 IonicContact NZ-OD2 2.68Å; K265-D270 PolarHBondContact NZ-OD2 3.3Å; M266-D270 WeakPolarHBondContact O-CA 3.4Å; M266-D270 PolarHBondContact O-N 2.85Å; D270-T272 PolarHBondContact O-N 2.92Å
271	Q	95.8	Very high	94.4	Very high	103 Å²	103	46 Å²	46	48%	0.481	25%	0.246	S	C	.	.			trans	-68.5	131.6	-178.6	-173.2	177.5	24.5	0	0	110.7	M266 T269 V273	M266-Q271 HydrophobicContact CB-CB 4.36Å; M266-Q271 PolarHBondContact N-O 2.81Å; T269-Q271 PolarHBondContact O-N 3.25Å; T269-Q271 VanDerWaalsContact O-N 3.16Å; T269-Q271 VanDerWaalsContact OG1-CB 3.25Å; T269-Q271 WeakPolarHBondContact OG1-CB 3.45Å; T269-Q271 PolarHBondContact OG1-N 3.33Å; Q271-V273 HydrophobicContact CG-CG1 4.46Å
272	T	97.2	Very high	93.9	Very high	59 Å²	59	47.7 Å²	47.7	36%	0.362	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	131.9	172.8	-58.2	0	0	0	0	110.5	L263 A264 D270 Y324	L263-T272 HydrophobicContact CD1-CG2 3.32Å; L263-T272 HydrophobicContact CD2-CG2 4.46Å; L263-T272 HydrophobicContact CG-CG2 3.94Å; A264-T272 WeakPolarHBondContact O-CA 3.45Å; D270-T272 PolarHBondContact O-N 2.92Å; T272-Y324 HydrophobicContact CG2-CD1 3.54Å; T272-Y324 HydrophobicContact CG2-CE1 4.22Å; T272-Y324 HydrophobicContact CG2-CG 4.16Å
273	V	97.7	Very high	93.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	163.4	-178.3	-58.7	0	0	0	0	110.6	Y247 A264 M266 Q271 I275 L308 V321 M322	Y247-V273 HydrophobicContact CD1-CG2 3.78Å; Y247-V273 HydrophobicContact CE1-CG2 3.96Å; A264-V273 HydrophobicContact CB-CG2 3.9Å; A264-V273 PolarHBondContact N-O 2.77Å; A264-V273 PolarHBondContact O-N 3.38Å; M266-V273 HydrophobicContact CE-CG1 4.47Å; Q271-V273 HydrophobicContact CG-CG1 4.46Å; V273-I275 HydrophobicContact CG2-CG1 4.27Å; V273-L308 HydrophobicContact CB-CD1 4.37Å; V273-L308 HydrophobicContact CG1-CD1 3.65Å; V273-V321 HydrophobicContact CB-CG1 4Å; V273-V321 HydrophobicContact CG1-CG1 4.43Å; V273-V321 HydrophobicContact CG2-CG1 3.82Å; V273-M322 WeakPolarHBondContact CB-O 3.14Å
274	A	97.1	Very high	91.9	Very high	6 Å²	6	48.4 Å²	48.4	5%	0.05	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	136.4	170.4	0	0	0	0	0	109.9	I253 V261 F262 V321 M322 Y324	I253-A274 HydrophobicContact CD1-CB 4.42Å; V261-A274 HydrophobicContact CG1-CB 4.26Å; F262-A274 CarbonylContact O-C 3.52Å; F262-A274 WeakPolarHBondContact O-CA 3.31Å; A274-V321 WeakPolarHBondContact O-CA 3.26Å; A274-M322 HydrophobicContact CB-CG 3.83Å; A274-M322 PolarHBondContact N-O 2.57Å; A274-M322 PolarHBondContact O-N 2.99Å; A274-Y324 HydrophobicContact CB-CD2 4.31Å
275	I	96	Very high	91	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	113.9	178.2	-54.7	-170.4	0	0	0	109	Y247 L249 V261 F262 A264 V273 W319 V320 V321	Y247-I275 HydrophobicContact CD1-CD1 4.37Å; Y247-I275 HydrophobicContact CD2-CD1 4.42Å; Y247-I275 HydrophobicContact CG-CD1 3.96Å; L249-I275 HydrophobicContact CD2-CB 4.22Å; L249-I275 HydrophobicContact CD2-CD1 3.89Å; L249-I275 HydrophobicContact CD2-CG1 4.42Å; V261-I275 CarbonylContact C-O 3.58Å; V261-I275 WeakPolarHBondContact CA-O 3.41Å; F262-I275 PolarHBondContact N-O 2.97Å; F262-I275 PolarHBondContact O-N 2.94Å; A264-I275 HydrophobicContact CB-CD1 3.53Å; A264-I275 HydrophobicContact CB-CG1 3.79Å; V273-I275 HydrophobicContact CG2-CG1 4.27Å; I275-W319 HydrophobicContact CD1-CE3 4.4Å; I275-W319 HydrophobicContact CG2-CB 4.09Å; I275-W319 HydrophobicContact CG2-CD2 4.06Å; I275-W319 HydrophobicContact CG2-CE3 3.82Å; I275-W319 HydrophobicContact CG2-CG 4.2Å; I275-V320 WeakPolarHBondContact CA-O 3.36Å; I275-V321 HydrophobicContact CD1-CG2 4.1Å; I275-V321 HydrophobicContact CG1-CG1 4.25Å; I275-V321 HydrophobicContact CG1-CG2 4.07Å
276	K	93.1	Very high	90.3	Very high	17 Å²	17	51 Å²	51	7%	0.074	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	112.1	172.4	-175.5	178.9	-178.9	-171.8	0	108.4	K260 V261 M278 E292 W319 V320 M322 D385	K260-K276 CarbonylContact O-C 3.56Å; K260-K276 WeakPolarHBondContact O-CA 3.26Å; V261-K276 HydrophobicContact CG2-CB 4.28Å; V261-K276 HydrophobicContact CG2-CG 4.19Å; K276-M278 HydrophobicContact CD-CE 4.41Å; K276-M278 HydrophobicContact CD-CG 4.5Å; K276-M278 HydrophobicContact CD-SD 4.04Å; K276-M278 HydrophobicContact CG-CE 4.4Å; K276-M278 HydrophobicContact CG-CG 4Å; K276-M278 HydrophobicContact CG-SD 4.17Å; K276-E292 IonicContact NZ-OE1 2.77Å; K276-E292 PolarHBondContact NZ-OE1 3.36Å; K276-E292 IonicContact NZ-OE2 2.69Å; K276-W319 WeakPolarHBondContact O-CA 3.43Å; K276-V320 HydrophobicContact CB-CB 4.45Å; K276-V320 PolarHBondContact N-O 3.38Å; K276-V320 PolarHBondContact O-N 2.92Å; K276-M322 HydrophobicContact CB-CE 3.49Å; K276-M322 VanDerWaalsContact CB-CE 3.49Å; K276-M322 HydrophobicContact CD-CE 4.34Å; K276-D385 IonicContact NZ-OD1 3.38Å; K276-D385 PolarHBondContact NZ-OD1 3.02Å
277	C	92.8	Very high	89.6	Confident	19 Å²	19	53.3 Å²	53.3	13%	0.128	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	119.3	178.2	-57.1	0	0	0	0	109.2	G259 K260 F262	G259-C277 WeakPolarHBondContact CA-O 3.47Å; K260-C277 PolarHBondContact N-O 2.82Å; K260-C277 PolarHBondContact O-N 2.81Å; F262-C277 HydrophobicContact CE2-CB 4.33Å
278	M	90.3	Very high	88.9	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	120.3	-176	-59	175.8	-79.6	0	0	109.3	S258 K276 F280 L289 L318 V320	S258-M278 WeakPolarHBondContact O-CB 3.46Å; S258-M278 VanDerWaalsContact O-CG 3.29Å; S258-M278 WeakPolarHBondContact O-CG 3.34Å; K276-M278 HydrophobicContact CD-CE 4.41Å; K276-M278 HydrophobicContact CD-CG 4.5Å; K276-M278 HydrophobicContact CD-SD 4.04Å; K276-M278 HydrophobicContact CG-CE 4.4Å; K276-M278 HydrophobicContact CG-CG 4Å; K276-M278 HydrophobicContact CG-SD 4.17Å; M278-F280 PolarHBondContact O-N 3.44Å; M278-L289 HydrophobicContact CB-CD2 4.48Å; M278-L289 HydrophobicContact CE-CD2 4.33Å; M278-L289 HydrophobicContact SD-CD2 3.83Å; M278-L318 HydrophobicContact CE-CD2 3.86Å; M278-L318 HydrophobicContact CE-CG 4.04Å; M278-L318 PolarHBondContact N-O 3.05Å; M278-L318 PolarHBondContact O-N 3.17Å; M278-V320 HydrophobicContact CE-CB 4.32Å; M278-V320 HydrophobicContact CE-CG2 3.37Å
279	D	88.9	Confident	88.4	Confident	60 Å²	60	45.9 Å²	45.9	32%	0.321	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	117	174.4	172	-13.4	0	0	0	108.3	K281 V282 Q283	D279-K281 VanDerWaalsContact C-N 3.33Å; D279-K281 PolarHBondContact O-N 3.08Å; D279-K281 WeakPolarHBondContact OD1-CB 3.32Å; D279-K281 PolarHBondContact OD1-N 3.2Å; D279-V282 HydrophobicContact CB-CG2 3.64Å; D279-V282 VanDerWaalsContact O-CG2 3.29Å; D279-V282 WeakPolarHBondContact O-CG2 3.48Å; D279-V282 PolarHBondContact OD1-N 3.47Å; D279-V282 WeakPolarHBondContact OD2-CG1 3.35Å; D279-Q283 WeakPolarHBondContact O-CG 3.28Å; D279-Q283 PolarHBondContact O-NE2 3.41Å
280	F	86.6	Confident	88	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.018	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-39.8	-178.4	179.5	-97.2	0	0	0	112	D227 I230 L231 L234 M278 V282 Q283 K286 L289 D316	D227-F280 HydrophobicContact CB-CE1 4.24Å; D227-F280 HydrophobicContact CB-CZ 4.43Å; I230-F280 HydrophobicContact CB-CE2 4.35Å; I230-F280 HydrophobicContact CB-CZ 4.22Å; I230-F280 HydrophobicContact CG2-CE2 3.68Å; I230-F280 HydrophobicContact CG2-CZ 4.05Å; L231-F280 HydrophobicContact CD1-CD1 4.23Å; L231-F280 HydrophobicContact CD1-CE1 3.73Å; L231-F280 HydrophobicContact CD1-CZ 4.17Å; L231-F280 HydrophobicContact CD2-CD1 3.82Å; L231-F280 HydrophobicContact CD2-CD2 3.82Å; L231-F280 HydrophobicContact CD2-CE1 3.72Å; L231-F280 HydrophobicContact CD2-CE2 3.73Å; L231-F280 HydrophobicContact CD2-CG 3.88Å; L231-F280 HydrophobicContact CD2-CZ 3.69Å; L231-F280 HydrophobicContact CG-CD1 4.13Å; L231-F280 HydrophobicContact CG-CE1 3.53Å; L231-F280 HydrophobicContact CG-CE2 3.99Å; L231-F280 HydrophobicContact CG-CZ 3.47Å; L231-F280 VanDerWaalsContact CG-CZ 3.47Å; L234-F280 HydrophobicContact CD1-CD2 3.92Å; L234-F280 HydrophobicContact CD1-CE2 3.8Å; M278-F280 PolarHBondContact O-N 3.44Å; F280-V282 VanDerWaalsContact C-N 3.32Å; F280-V282 PolarHBondContact O-N 3.31Å; F280-Q283 PolarHBondContact O-N 3.2Å; F280-K286 HydrophobicContact CD1-CD 3.63Å; F280-K286 HydrophobicContact CD2-CB 4.49Å; F280-K286 HydrophobicContact CD2-CD 4.08Å; F280-K286 HydrophobicContact CE1-CD 3.2Å; F280-K286 HydrophobicContact CE2-CB 3.83Å; F280-K286 HydrophobicContact CE2-CD 3.7Å; F280-K286 HydrophobicContact CE2-CG 4.34Å; F280-K286 HydrophobicContact CG-CD 4.03Å; F280-K286 HydrophobicContact CZ-CB 3.96Å; F280-K286 HydrophobicContact CZ-CD 3.22Å; F280-K286 HydrophobicContact CZ-CG 4.22Å; F280-K286 VanDerWaalsContact O-CD 3.26Å; F280-K286 WeakPolarHBondContact O-CD 3.24Å; F280-K286 WeakPolarHBondContact O-CE 3.3Å; F280-L289 HydrophobicContact CD2-CD1 3.71Å; F280-L289 HydrophobicContact CE2-CD1 4.39Å; F280-D316 WeakPolarHBondContact CA-O 3.26Å; F280-D316 HydrophobicContact CB-CB 4.37Å; F280-D316 WeakPolarHBondContact CB-O 3.4Å; F280-D316 PolarHBondContact N-O 2.99Å
281	K	84.2	Confident	87.3	Confident	128 Å²	128	39.6 Å²	39.6	56%	0.557	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-33.6	-173.5	-76.3	171.3	162.6	158.6	0	112.4	D279 D316	D279-K281 VanDerWaalsContact C-N 3.33Å; D279-K281 PolarHBondContact O-N 3.08Å; D279-K281 WeakPolarHBondContact OD1-CB 3.32Å; D279-K281 PolarHBondContact OD1-N 3.2Å; K281-D316 HydrophobicContact CD-CB 4.15Å; K281-D316 WeakPolarHBondContact CE-OD1 3.33Å; K281-D316 WeakPolarHBondContact CE-OD2 3.41Å; K281-D316 HydrophobicContact CG-CB 4.19Å; K281-D316 IonicContact NZ-OD1 2.78Å; K281-D316 IonicContact NZ-OD2 2.71Å; K281-D316 PolarHBondContact NZ-OD2 3.38Å
282	V	81.8	Confident	86.8	Confident	70 Å²	70	35 Å²	35	42%	0.424	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-8.7	-178	-56.7	0	0	0	0	113.4	D279 F280	D279-V282 HydrophobicContact CB-CG2 3.64Å; D279-V282 VanDerWaalsContact O-CG2 3.29Å; D279-V282 WeakPolarHBondContact O-CG2 3.48Å; D279-V282 PolarHBondContact OD1-N 3.47Å; D279-V282 WeakPolarHBondContact OD2-CG1 3.35Å; F280-V282 VanDerWaalsContact C-N 3.32Å; F280-V282 PolarHBondContact O-N 3.31Å
283	Q	80.2	Confident	86.4	Confident	24 Å²	24	32.1 Å²	32.1	11%	0.112	17%	0.165	C	C	.	.			trans	-68.8	127	177.6	-62.8	-47.4	-54	0	0	110.8	S258 D279 F280 K285 K286 L289	S258-Q283 PolarHBondContact O-NE2 3.12Å; D279-Q283 WeakPolarHBondContact O-CG 3.28Å; D279-Q283 PolarHBondContact O-NE2 3.41Å; F280-Q283 PolarHBondContact O-N 3.2Å; Q283-K285 VanDerWaalsContact C-N 3.31Å; Q283-K285 PolarHBondContact O-N 3.09Å; Q283-K286 HydrophobicContact CB-CG 4.26Å; Q283-L289 HydrophobicContact CG-CD1 3.81Å; Q283-L289 HydrophobicContact CG-CD2 4.06Å; Q283-L289 HydrophobicContact CG-CG 4.09Å
284	P	72.7	Confident	86	Confident	66 Å²	66	36.1 Å²	36.1	43%	0.429	18%	0.182	S	C	.	.	S	Bend	trans	-70.7	-27	-179.1	27.2	-34.4	0	0	0	113
285	K	78	Confident	85.5	Confident	87 Å²	87	36.1 Å²	36.1	38%	0.378	18%	0.182	S	C	.	.			trans	-133.9	83.8	179.1	-67.3	-165.8	175.7	-163.2	0	109.6	Q283 E287 M288	Q283-K285 VanDerWaalsContact C-N 3.31Å; Q283-K285 PolarHBondContact O-N 3.09Å; K285-E287 WeakPolarHBondContact CA-OE2 3.36Å; K285-E287 PolarHBondContact O-N 3.14Å; K285-M288 HydrophobicContact CB-CB 4.5Å; K285-M288 HydrophobicContact CB-CG 3.68Å; K285-M288 VanDerWaalsContact O-CB 3.27Å; K285-M288 WeakPolarHBondContact O-CB 3.18Å; K285-M288 PolarHBondContact O-N 3.04Å
286	K	83.7	Confident	85.1	Confident	24 Å²	24	36.6 Å²	36.6	10%	0.104	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.9	-171.5	-52.3	-156.1	-174.2	76.2	0	112.5	D227 I230 F280 Q283 M288 L289	D227-K286 WeakPolarHBondContact OD1-CD 3.49Å; D227-K286 IonicContact OD1-NZ 3.47Å; D227-K286 PolarHBondContact OD1-NZ 2.98Å; D227-K286 IonicContact OD2-NZ 3.68Å; D227-K286 PolarHBondContact OD2-NZ 3.26Å; I230-K286 HydrophobicContact CD1-CB 3.83Å; I230-K286 HydrophobicContact CG2-CB 4.29Å; F280-K286 HydrophobicContact CD1-CD 3.63Å; F280-K286 HydrophobicContact CD2-CB 4.49Å; F280-K286 HydrophobicContact CD2-CD 4.08Å; F280-K286 HydrophobicContact CE1-CD 3.2Å; F280-K286 HydrophobicContact CE2-CB 3.83Å; F280-K286 HydrophobicContact CE2-CD 3.7Å; F280-K286 HydrophobicContact CE2-CG 4.34Å; F280-K286 HydrophobicContact CG-CD 4.03Å; F280-K286 HydrophobicContact CZ-CB 3.96Å; F280-K286 HydrophobicContact CZ-CD 3.22Å; F280-K286 HydrophobicContact CZ-CG 4.22Å; F280-K286 VanDerWaalsContact O-CD 3.26Å; F280-K286 WeakPolarHBondContact O-CD 3.24Å; F280-K286 WeakPolarHBondContact O-CE 3.3Å; Q283-K286 HydrophobicContact CB-CG 4.26Å; K286-M288 PolarHBondContact O-N 3.33Å; K286-L289 WeakPolarHBondContact O-CB 3.27Å; K286-L289 PolarHBondContact O-N 3.12Å; K286-L289 VanDerWaalsContact O-N 3.1Å
287	E	82.7	Confident	85	Confident	78 Å²	78	40.7 Å²	40.7	36%	0.364	20%	0.202	S	C	.	.	H	α-helix	trans	-63.1	-22.4	174.6	69.6	-81.8	-167.1	0	0	113.3	I230 K285 L289 L290 T291	I230-E287 HydrophobicContact CD1-CB 4.16Å; K285-E287 WeakPolarHBondContact CA-OE2 3.36Å; K285-E287 PolarHBondContact O-N 3.14Å; E287-L289 VanDerWaalsContact C-N 3.3Å; E287-L289 PolarHBondContact O-N 3.07Å; E287-L290 PolarHBondContact O-N 3.39Å; E287-T291 PolarHBondContact O-N 3.25Å; E287-T291 PolarHBondContact O-OG1 3.2Å
288	M	81.1	Confident	84.9	Confident	32 Å²	32	45.8 Å²	45.8	16%	0.158	22%	0.224	C	C	.	.	H	α-helix	trans	-69	-29.5	174.8	-64	-64	-55.7	0	0	111.8	K285 K286 T291 E292 G387	K285-M288 HydrophobicContact CB-CB 4.5Å; K285-M288 HydrophobicContact CB-CG 3.68Å; K285-M288 VanDerWaalsContact O-CB 3.27Å; K285-M288 WeakPolarHBondContact O-CB 3.18Å; K285-M288 PolarHBondContact O-N 3.04Å; K286-M288 PolarHBondContact O-N 3.33Å; M288-T291 WeakPolarHBondContact O-CB 3.42Å; M288-T291 PolarHBondContact O-N 2.68Å; M288-E292 PolarHBondContact O-N 3.03Å; M288-G387 WeakPolarHBondContact CE-O 3.23Å
289	L	86.1	Confident	85	Confident	4 Å²	4	47 Å²	47	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-63.3	-42.8	176	-63.4	179.6	0	0	0	111.4	M278 F280 Q283 K286 E287 T291 E292 I293 L318	M278-L289 HydrophobicContact CB-CD2 4.48Å; M278-L289 HydrophobicContact CE-CD2 4.33Å; M278-L289 HydrophobicContact SD-CD2 3.83Å; F280-L289 HydrophobicContact CD2-CD1 3.71Å; F280-L289 HydrophobicContact CE2-CD1 4.39Å; Q283-L289 HydrophobicContact CG-CD1 3.81Å; Q283-L289 HydrophobicContact CG-CD2 4.06Å; Q283-L289 HydrophobicContact CG-CG 4.09Å; K286-L289 WeakPolarHBondContact O-CB 3.27Å; K286-L289 PolarHBondContact O-N 3.12Å; K286-L289 VanDerWaalsContact O-N 3.1Å; E287-L289 VanDerWaalsContact C-N 3.3Å; E287-L289 PolarHBondContact O-N 3.07Å; L289-T291 VanDerWaalsContact C-N 3.28Å; L289-T291 PolarHBondContact O-N 3.05Å; L289-E292 PolarHBondContact O-N 3.46Å; L289-I293 WeakPolarHBondContact O-CG1 3.48Å; L289-I293 PolarHBondContact O-N 3.34Å; L289-L318 HydrophobicContact CB-CD2 3.96Å; L289-L318 HydrophobicContact CD1-CD2 4.16Å; L289-L318 HydrophobicContact CD2-CD2 4.2Å; L289-L318 HydrophobicContact CG-CD2 4.34Å
290	L	86.3	Confident	85.2	Confident	11 Å²	11	51.3 Å²	51.3	6%	0.058	24%	0.24	C	C	.	.	H	α-helix	trans	-59	-42.8	174.1	-75.8	173.8	0	0	0	111.5	L225 I230 E233 L234 I237 E287 K294	L225-L290 HydrophobicContact CD1-CD1 4.35Å; I230-L290 HydrophobicContact CB-CD1 4.26Å; I230-L290 HydrophobicContact CG1-CD1 4.32Å; I230-L290 HydrophobicContact CG2-CD1 3.76Å; I230-L290 HydrophobicContact CG2-CG 3.91Å; E233-L290 HydrophobicContact CB-CD1 4.06Å; E233-L290 HydrophobicContact CB-CD2 3.85Å; E233-L290 HydrophobicContact CG-CD1 3.93Å; E233-L290 HydrophobicContact CG-CD2 3.54Å; E233-L290 HydrophobicContact CG-CG 4.39Å; L234-L290 HydrophobicContact CB-CD2 4.38Å; L234-L290 HydrophobicContact CD2-CD2 3.74Å; L234-L290 HydrophobicContact CD2-CG 4.37Å; L234-L290 HydrophobicContact CG-CD2 3.63Å; L234-L290 HydrophobicContact CG-CG 4.24Å; I237-L290 HydrophobicContact CD1-CD2 3.79Å; E287-L290 PolarHBondContact O-N 3.39Å; L290-K294 VanDerWaalsContact O-CB 3.3Å; L290-K294 WeakPolarHBondContact O-CB 3.14Å; L290-K294 VanDerWaalsContact O-CG 3.23Å; L290-K294 WeakPolarHBondContact O-CG 3.42Å; L290-K294 PolarHBondContact O-N 2.92Å
291	T	81	Confident	85.7	Confident	40 Å²	40	53.7 Å²	53.7	25%	0.245	25%	0.251	C	S	.	.	H	α-helix	trans	-63.8	-45.6	179	-55.6	0	0	0	0	110.8	E287 M288 L289 K294 V295	E287-T291 PolarHBondContact O-N 3.25Å; E287-T291 PolarHBondContact O-OG1 3.2Å; M288-T291 WeakPolarHBondContact O-CB 3.42Å; M288-T291 PolarHBondContact O-N 2.68Å; L289-T291 VanDerWaalsContact C-N 3.28Å; L289-T291 PolarHBondContact O-N 3.05Å; T291-K294 PolarHBondContact O-N 3.18Å; T291-V295 HydrophobicContact CG2-CG2 4.24Å; T291-V295 WeakPolarHBondContact O-CB 3.27Å; T291-V295 VanDerWaalsContact O-CG2 3.27Å; T291-V295 WeakPolarHBondContact O-CG2 3.09Å; T291-V295 PolarHBondContact O-N 2.99Å
292	E	84.2	Confident	86.3	Confident	5 Å²	5	53.7 Å²	53.7	2%	0.023	25%	0.251	C	S	.	.	H	α-helix	trans	-57.8	-50.9	178.2	-172.3	170.8	179.4	0	0	111.3	K276 M288 L289 V295 M296 F386 G387	K276-E292 IonicContact NZ-OE1 2.77Å; K276-E292 PolarHBondContact NZ-OE1 3.36Å; K276-E292 IonicContact NZ-OE2 2.69Å; M288-E292 PolarHBondContact O-N 3.03Å; L289-E292 PolarHBondContact O-N 3.46Å; E292-V295 PolarHBondContact O-N 2.89Å; E292-M296 HydrophobicContact CG-SD 3.99Å; E292-M296 WeakPolarHBondContact O-CB 3.28Å; E292-M296 VanDerWaalsContact O-CG 3.28Å; E292-M296 WeakPolarHBondContact O-CG 3.32Å; E292-M296 PolarHBondContact O-N 2.86Å; E292-F386 HydrophobicContact CG-CB 4.48Å; E292-G387 WeakPolarHBondContact OE2-CA 3.26Å
293	I	88.8	Confident	87	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.4	-46.1	179.3	-58.3	-57.6	0	0	0	111.8	L234 I237 L289 V295 M296 K297 L318 V320	L234-I293 HydrophobicContact CD2-CG1 4.42Å; I237-I293 HydrophobicContact CD1-CB 3.81Å; I237-I293 HydrophobicContact CD1-CG2 3.61Å; I237-I293 HydrophobicContact CG1-CG2 4.01Å; L289-I293 WeakPolarHBondContact O-CG1 3.48Å; L289-I293 PolarHBondContact O-N 3.34Å; I293-V295 PolarHBondContact O-N 2.9Å; I293-M296 PolarHBondContact O-N 2.85Å; I293-K297 WeakPolarHBondContact O-CB 3.34Å; I293-K297 PolarHBondContact O-N 2.75Å; I293-L318 HydrophobicContact CD1-CD1 4.45Å; I293-L318 HydrophobicContact CD1-CD2 4.16Å; I293-L318 HydrophobicContact CG1-CD2 4.09Å; I293-V320 HydrophobicContact CD1-CB 4.46Å; I293-V320 HydrophobicContact CD1-CG1 4.34Å; I293-V320 HydrophobicContact CD1-CG2 3.32Å
294	K	89.7	Confident	87.8	Confident	84 Å²	84	49.7 Å²	49.7	37%	0.365	23%	0.228	S	C	.	.	H	α-helix	trans	-61.3	-45.2	-179.2	-75.1	177.5	178.3	-175.8	0	111.1	E233 I237 L290 T291 Q298	E233-K294 WeakPolarHBondContact OE1-CE 3.46Å; E233-K294 IonicContact OE1-NZ 3.01Å; E233-K294 PolarHBondContact OE1-NZ 3.05Å; I237-K294 HydrophobicContact CD1-CG 4.18Å; L290-K294 VanDerWaalsContact O-CB 3.3Å; L290-K294 WeakPolarHBondContact O-CB 3.14Å; L290-K294 VanDerWaalsContact O-CG 3.23Å; L290-K294 WeakPolarHBondContact O-CG 3.42Å; L290-K294 PolarHBondContact O-N 2.92Å; T291-K294 PolarHBondContact O-N 3.18Å; K294-Q298 WeakPolarHBondContact O-CB 3.1Å; K294-Q298 PolarHBondContact O-N 2.69Å
295	V	87	Confident	88.9	Confident	6 Å²	6	46.9 Å²	46.9	4%	0.036	21%	0.21	C	C	.	.	H	α-helix	trans	-63.6	-52.2	178.5	169.1	0	0	0	0	110.8	T291 E292 I293 K297 Q298 Y299 I363 F386 C389	T291-V295 HydrophobicContact CG2-CG2 4.24Å; T291-V295 WeakPolarHBondContact O-CB 3.27Å; T291-V295 VanDerWaalsContact O-CG2 3.27Å; T291-V295 WeakPolarHBondContact O-CG2 3.09Å; T291-V295 PolarHBondContact O-N 2.99Å; E292-V295 PolarHBondContact O-N 2.89Å; I293-V295 PolarHBondContact O-N 2.9Å; V295-K297 VanDerWaalsContact C-N 3.32Å; V295-K297 PolarHBondContact O-N 2.75Å; V295-Q298 PolarHBondContact O-N 2.87Å; V295-Y299 HydrophobicContact CB-CD2 4.42Å; V295-Y299 HydrophobicContact CG1-CD2 4.16Å; V295-Y299 WeakPolarHBondContact O-CB 3.42Å; V295-Y299 WeakPolarHBondContact O-CD2 3.46Å; V295-Y299 PolarHBondContact O-N 2.79Å; V295-I363 HydrophobicContact CG1-CD1 4.24Å; V295-I363 HydrophobicContact CG1-CG2 4.41Å; V295-F386 HydrophobicContact CG1-CB 4.38Å; V295-F386 HydrophobicContact CG1-CD1 4.26Å; V295-F386 HydrophobicContact CG1-CG 4.38Å; V295-C389 HydrophobicContact CG2-CB 4.37Å
296	M	88	Confident	89.7	Confident	9 Å²	9	45.5 Å²	45.5	4%	0.044	21%	0.206	C	C	.	.	H	α-helix	trans	-63.2	-36	-177.9	-73.9	-175.4	75.5	0	0	113.1	E292 I293 Y307 V320 F386	E292-M296 HydrophobicContact CG-SD 3.99Å; E292-M296 WeakPolarHBondContact O-CB 3.28Å; E292-M296 VanDerWaalsContact O-CG 3.28Å; E292-M296 WeakPolarHBondContact O-CG 3.32Å; E292-M296 PolarHBondContact O-N 2.86Å; I293-M296 PolarHBondContact O-N 2.85Å; M296-Y307 HydrophobicContact CB-CD2 4.04Å; M296-Y307 HydrophobicContact CB-CG 4.14Å; M296-Y307 HydrophobicContact CE-CD2 4.41Å; M296-Y307 WeakPolarHBondContact O-CB 3.48Å; M296-V320 HydrophobicContact CE-CG1 4.28Å; M296-V320 HydrophobicContact SD-CG1 4.39Å; M296-F386 HydrophobicContact CE-CD2 4.43Å; M296-F386 HydrophobicContact CG-CB 4.26Å; M296-F386 HydrophobicContact CG-CD2 3.46Å; M296-F386 VanDerWaalsContact CG-CD2 3.46Å; M296-F386 HydrophobicContact CG-CE2 4.15Å; M296-F386 HydrophobicContact CG-CG 4.12Å; M296-F386 HydrophobicContact SD-CD2 3.93Å
297	K	90.9	Very high	90.2	Very high	104 Å²	104	44.8 Å²	44.8	45%	0.452	20%	0.203	S	C	.	.	H	α-helix	trans	-73.6	-37.6	178.7	-171.3	175.3	-176	179.2	0	112.4	I237 I293 V295 Y307	I237-K297 PolarHBondContact O-NZ 2.9Å; I293-K297 WeakPolarHBondContact O-CB 3.34Å; I293-K297 PolarHBondContact O-N 2.75Å; V295-K297 VanDerWaalsContact C-N 3.32Å; V295-K297 PolarHBondContact O-N 2.75Å; K297-Y307 HydrophobicContact CB-CD1 4.19Å; K297-Y307 HydrophobicContact CB-CE1 3.93Å; K297-Y307 HydrophobicContact CD-CE1 4.43Å; K297-Y307 HydrophobicContact CG-CD1 4.41Å; K297-Y307 HydrophobicContact CG-CE1 3.88Å
298	Q	91.3	Very high	90.8	Very high	126 Å²	126	43.4 Å²	43.4	59%	0.589	20%	0.198	S	C	*	.	H	α-helix	trans	-85.6	-37.7	-174.9	-176.7	172.9	-7.2	0	0	113.4	K294 V295	K294-Q298 WeakPolarHBondContact O-CB 3.1Å; K294-Q298 PolarHBondContact O-N 2.69Å; V295-Q298 PolarHBondContact O-N 2.87Å
299	Y	91.6	Very high	91.4	Very high	24 Å²	24	44 Å²	44	9%	0.094	20%	0.2	C	C	.	.			trans	-110.8	100.3	-168.5	-58.8	-75.6	0	0	0	111.2	V295 H361 I363 Q391	V295-Y299 HydrophobicContact CB-CD2 4.42Å; V295-Y299 HydrophobicContact CG1-CD2 4.16Å; V295-Y299 WeakPolarHBondContact O-CB 3.42Å; V295-Y299 WeakPolarHBondContact O-CD2 3.46Å; V295-Y299 PolarHBondContact O-N 2.79Å; Y299-H361 HydrophobicContact CD1-CB 4.1Å; Y299-H361 AromaticContact CD1-CD2 3.96Å; Y299-H361 AromaticContact CD1-CG 3.86Å; Y299-H361 HydrophobicContact CE1-CB 3.64Å; Y299-H361 AromaticContact CE1-CD2 3.52Å; Y299-H361 AromaticContact CE1-CG 3.61Å; Y299-I363 HydrophobicContact CD1-CD1 4.01Å; Y299-I363 HydrophobicContact CD2-CD1 3.29Å; Y299-I363 HydrophobicContact CE1-CD1 4.03Å; Y299-I363 HydrophobicContact CE2-CD1 3.33Å; Y299-I363 HydrophobicContact CE2-CG1 4.33Å; Y299-I363 HydrophobicContact CG-CD1 3.65Å; Y299-Q391 PolarHBondContact OH-NE2 2.8Å
300	R	93.3	Very high	91.9	Very high	152 Å²	152	43.8 Å²	43.8	57%	0.574	20%	0.199	S	C	*	.			trans	-106	132.3	178.1	-69.7	-177.7	167.3	172	-5.6	111.1	Y307	R300-Y307 PolarHBondContact NH2-O 3.23Å; R300-Y307 VanDerWaalsContact NH2-O 3.14Å
301	H	96.3	Very high	92.3	Very high	53 Å²	53	43.3 Å²	43.3	25%	0.245	20%	0.197	C	C	.	.			trans	-152.3	150.3	178	179.2	-99.7	0	0	0	110.3	N303 L304 F357	H301-N303 PolarHBondContact CE1-OD1 3.36Å; H301-N303 VanDerWaalsContact CE1-OD1 3.31Å; H301-N303 PolarHBondContact ND1-N 3.36Å; H301-N303 PolarHBondContact O-N 2.66Å; H301-N303 VanDerWaalsContact O-N 3.09Å; H301-L304 HydrophobicContact CB-CB 4.45Å; H301-L304 HydrophobicContact CB-CD1 3.9Å; H301-L304 HydrophobicContact CB-CG 3.92Å; H301-L304 PolarHBondContact O-N 2.89Å; H301-F357 HydrophobicContact CB-CD1 3.62Å; H301-F357 HydrophobicContact CB-CD2 4.49Å; H301-F357 HydrophobicContact CB-CE1 3.69Å; H301-F357 HydrophobicContact CB-CG 4.03Å; H301-F357 HydrophobicContact CB-CZ 4.19Å; H301-F357 AromaticContact CD2-CG 3.95Å
302	K	97	Very high	92.9	Very high	129 Å²	129	43.1 Å²	43.1	56%	0.561	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-26.6	-174.6	71.1	-179.9	-177.2	176.5	0	114	K382	K302-K382 VanDerWaalsContact O-CE 3.27Å; K302-K382 WeakPolarHBondContact O-CE 3.41Å
303	N	97.7	Very high	93.2	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.021	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	14.1	-180	-59.4	114.7	0	0	0	113.3	H301 E350 A354 V381 K382 L383	H301-N303 PolarHBondContact CE1-OD1 3.36Å; H301-N303 VanDerWaalsContact CE1-OD1 3.31Å; H301-N303 PolarHBondContact ND1-N 3.36Å; H301-N303 PolarHBondContact O-N 2.66Å; H301-N303 VanDerWaalsContact O-N 3.09Å; N303-E350 WeakPolarHBondContact CB-O 3.27Å; N303-E350 PolarHBondContact ND2-OE2 3.41Å; N303-A354 HydrophobicContact CB-CB 3.82Å; N303-V381 PolarHBondContact ND2-O 2.9Å; N303-V381 VanDerWaalsContact ND2-O 3.08Å; N303-K382 CarbonylContact O-C 3.42Å; N303-K382 VanDerWaalsContact O-CA 3.32Å; N303-K382 WeakPolarHBondContact O-CA 3.46Å; N303-L383 PolarHBondContact O-N 3.12Å
304	L	96.5	Very high	93	Very high	6 Å²	6	47.3 Å²	47.3	3%	0.031	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-113.6	143.1	168.6	-58	-180	0	0	0	108.4	H301 N306 A354 F357 L358 L383 F386	H301-L304 HydrophobicContact CB-CB 4.45Å; H301-L304 HydrophobicContact CB-CD1 3.9Å; H301-L304 HydrophobicContact CB-CG 3.92Å; H301-L304 PolarHBondContact O-N 2.89Å; L304-N306 PolarHBondContact O-N 2.93Å; L304-A354 HydrophobicContact CD2-CB 3.62Å; L304-A354 HydrophobicContact CG-CB 4.45Å; L304-F357 HydrophobicContact CD1-CD1 3.91Å; L304-F357 HydrophobicContact CD1-CE1 3.95Å; L304-L358 HydrophobicContact CD1-CD2 3.91Å; L304-L358 HydrophobicContact CD1-CG 4.34Å; L304-L358 HydrophobicContact CD2-CD1 4.07Å; L304-L358 HydrophobicContact CD2-CG 4.37Å; L304-L383 HydrophobicContact CD2-CB 4.02Å; L304-F386 HydrophobicContact CB-CZ 4.06Å; L304-F386 HydrophobicContact CD1-CE1 4.47Å; L304-F386 HydrophobicContact CD1-CZ 4.33Å; L304-F386 HydrophobicContact CD2-CE1 3.92Å; L304-F386 HydrophobicContact CD2-CZ 3.75Å; L304-F386 HydrophobicContact CG-CZ 4.24Å
305	V	95.5	Very high	92.1	Very high	6 Å²	6	49.7 Å²	49.7	4%	0.036	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-61.7	123.8	175.6	174.8	0	0	0	0	109.9	Y307 M322 E323 L325 L374 K382 L383	V305-Y307 PolarHBondContact O-N 3.27Å; V305-M322 HydrophobicContact CG1-CB 4.02Å; V305-M322 HydrophobicContact CG1-CG 4.09Å; V305-M322 HydrophobicContact CG1-SD 3.92Å; V305-E323 HydrophobicContact CG1-CG 3.87Å; V305-L325 HydrophobicContact CB-CD1 4.47Å; V305-L325 HydrophobicContact CG1-CD1 4.23Å; V305-L325 HydrophobicContact CG2-CD1 3.61Å; V305-L374 HydrophobicContact CG2-CD1 4.01Å; V305-L374 HydrophobicContact CG2-CG 4.45Å; V305-K382 HydrophobicContact CG2-CB 3.91Å; V305-L383 WeakPolarHBondContact CG2-O 3.41Å; V305-L383 PolarHBondContact N-O 3.26Å
306	N	94.4	Very high	91.8	Very high	58 Å²	58	51 Å²	51	31%	0.31	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-71.2	118.5	-173.6	-175.8	41.6	0	0	0	111.6	L304 L308 M322 E323	L304-N306 PolarHBondContact O-N 2.93Å; N306-L308 WeakPolarHBondContact ND2-CD2 3.37Å; N306-M322 VanDerWaalsContact O-CA 3.31Å; N306-M322 WeakPolarHBondContact O-CA 3.29Å; N306-M322 WeakPolarHBondContact O-CB 3.33Å; N306-E323 HydrophobicContact CB-CB 4.26Å; N306-E323 HydrophobicContact CB-CG 3.94Å; N306-E323 WeakPolarHBondContact CB-OE1 2.96Å; N306-E323 PolarHBondContact N-OE1 2.97Å; N306-E323 PolarHBondContact O-N 2.94Å
307	Y	94.5	Very high	91.8	Very high	10 Å²	10	53.9 Å²	53.9	4%	0.039	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	129.2	168.9	170.9	-91.1	0	0	0	111.5	M296 K297 R300 V305 E309 S310 V320	M296-Y307 HydrophobicContact CB-CD2 4.04Å; M296-Y307 HydrophobicContact CB-CG 4.14Å; M296-Y307 HydrophobicContact CE-CD2 4.41Å; M296-Y307 WeakPolarHBondContact O-CB 3.48Å; K297-Y307 HydrophobicContact CB-CD1 4.19Å; K297-Y307 HydrophobicContact CB-CE1 3.93Å; K297-Y307 HydrophobicContact CD-CE1 4.43Å; K297-Y307 HydrophobicContact CG-CD1 4.41Å; K297-Y307 HydrophobicContact CG-CE1 3.88Å; R300-Y307 PolarHBondContact NH2-O 3.23Å; R300-Y307 VanDerWaalsContact NH2-O 3.14Å; V305-Y307 PolarHBondContact O-N 3.27Å; Y307-E309 VanDerWaalsContact OH-C 3.29Å; Y307-S310 WeakPolarHBondContact OH-CB 3.43Å; Y307-S310 PolarHBondContact OH-N 3.03Å; Y307-S310 PolarHBondContact OH-OG 2.93Å; Y307-V320 HydrophobicContact CD2-CG1 3.98Å; Y307-V320 HydrophobicContact CE2-CG1 4.1Å
308	L	94.7	Very high	91.9	Very high	48 Å²	48	49 Å²	49	25%	0.251	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-62.4	177.3	-58.5	-179.6	0	0	0	110.7	V273 N306 V321	V273-L308 HydrophobicContact CB-CD1 4.37Å; V273-L308 HydrophobicContact CG1-CD1 3.65Å; N306-L308 WeakPolarHBondContact ND2-CD2 3.37Å; L308-V321 HydrophobicContact CB-CB 4.43Å; L308-V321 HydrophobicContact CB-CG1 4.27Å; L308-V321 WeakPolarHBondContact CB-O 3.47Å; L308-V321 HydrophobicContact CD1-CG1 4.15Å; L308-V321 PolarHBondContact N-O 3.21Å
309	E	95.3	Very high	92	Very high	44 Å²	44	44.2 Å²	44.2	21%	0.206	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	166.4	-175.7	-156.5	166.6	-159.9	0	0	110.1	S239 K246 Y307 F311 V321	S239-E309 WeakPolarHBondContact CB-OE1 3.36Å; S239-E309 PolarHBondContact OG-OE1 3.25Å; K246-E309 IonicContact NZ-OE1 2.65Å; K246-E309 PolarHBondContact NZ-OE1 3.4Å; K246-E309 IonicContact NZ-OE2 3.78Å; K246-E309 PolarHBondContact NZ-OE2 3.2Å; Y307-E309 VanDerWaalsContact OH-C 3.29Å; E309-F311 HydrophobicContact CB-CE2 4.06Å; E309-F311 HydrophobicContact CB-CZ 4.15Å; E309-F311 HydrophobicContact CG-CE1 4.37Å; E309-F311 HydrophobicContact CG-CE2 4.1Å; E309-F311 HydrophobicContact CG-CZ 3.8Å; E309-F311 VanDerWaalsContact OE2-CZ 3.27Å; E309-F311 WeakPolarHBondContact OE2-CZ 3.3Å; E309-V321 PolarHBondContact N-O 2.88Å; E309-V321 WeakPolarHBondContact O-CA 3.46Å; E309-V321 WeakPolarHBondContact O-CB 3.36Å; E309-V321 PolarHBondContact O-N 3.12Å
310	S	95.6	Very high	92.2	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	156.3	173.2	51.2	0	0	0	0	110.3	S239 Y307 W319	S239-S310 WeakPolarHBondContact CB-O 3.47Å; S239-S310 PolarHBondContact N-O 3.48Å; Y307-S310 WeakPolarHBondContact OH-CB 3.43Å; Y307-S310 PolarHBondContact OH-N 3.03Å; Y307-S310 PolarHBondContact OH-OG 2.93Å; S310-W319 CarbonylContact C-O 3.52Å; S310-W319 WeakPolarHBondContact CA-O 3.09Å; S310-W319 VanDerWaalsContact CB-O 3.27Å; S310-W319 WeakPolarHBondContact CB-O 3.08Å
311	F	95.4	Very high	92.3	Very high	1 Å²	1	35.8 Å²	35.8	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	144	-173.6	-54.9	-89.6	0	0	0	110	A241 P243 K246 Y247 E309 V313 W319 V321	A241-F311 HydrophobicContact CB-CE1 4.19Å; A241-F311 WeakPolarHBondContact O-CD1 3.14Å; P243-F311 HydrophobicContact CB-CB 4.26Å; P243-F311 HydrophobicContact CB-CD1 4.07Å; P243-F311 HydrophobicContact CB-CD2 3.77Å; P243-F311 HydrophobicContact CB-CE1 4.34Å; P243-F311 HydrophobicContact CB-CE2 4.09Å; P243-F311 HydrophobicContact CB-CG 3.75Å; P243-F311 HydrophobicContact CB-CZ 4.36Å; P243-F311 HydrophobicContact CG-CB 3.89Å; P243-F311 HydrophobicContact CG-CD1 4.25Å; P243-F311 HydrophobicContact CG-CD2 4.33Å; P243-F311 HydrophobicContact CG-CG 3.9Å; K246-F311 HydrophobicContact CD-CE1 4.36Å; K246-F311 HydrophobicContact CD-CZ 4.14Å; Y247-F311 HydrophobicContact CD2-CE2 4.33Å; Y247-F311 AromaticContact CE2-CE2 3.68Å; Y247-F311 HydrophobicContact CE2-CE2 3.68Å; Y247-F311 AromaticContact CE2-CZ 3.8Å; Y247-F311 HydrophobicContact CE2-CZ 3.8Å; E309-F311 HydrophobicContact CB-CE2 4.06Å; E309-F311 HydrophobicContact CB-CZ 4.15Å; E309-F311 HydrophobicContact CG-CE1 4.37Å; E309-F311 HydrophobicContact CG-CE2 4.1Å; E309-F311 HydrophobicContact CG-CZ 3.8Å; E309-F311 VanDerWaalsContact OE2-CZ 3.27Å; E309-F311 WeakPolarHBondContact OE2-CZ 3.3Å; F311-V313 HydrophobicContact CB-CG2 4.16Å; F311-W319 HydrophobicContact CB-CB 4.33Å; F311-W319 PolarHBondContact N-O 3.26Å; F311-W319 PolarHBondContact O-N 3.35Å; F311-V321 HydrophobicContact CD2-CG2 4.09Å; F311-V321 HydrophobicContact CE2-CG2 3.7Å
312	L	93	Very high	92.3	Very high	36 Å²	36	33.9 Å²	33.9	19%	0.188	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	111.2	162.7	-168.4	69.3	0	0	0	107.6	L231 K235 V238	L231-L312 HydrophobicContact CD2-CD1 4.3Å; L231-L312 HydrophobicContact CD2-CD2 4.4Å; K235-L312 HydrophobicContact CG-CD2 3.91Å; V238-L312 HydrophobicContact CG2-CB 4.13Å
313	V	90.1	Very high	92.3	Very high	32 Å²	32	29.6 Å²	29.6	19%	0.194	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	122.4	-177.2	-175.2	0	0	0	0	109.2	P243 F311 D317 W319	P243-V313 HydrophobicContact CG-CG2 3.37Å; F311-V313 HydrophobicContact CB-CG2 4.16Å; V313-D317 HydrophobicContact CB-CB 4.15Å; V313-D317 PolarHBondContact N-O 3.04Å; V313-D317 PolarHBondContact O-N 2.74Å; V313-D317 VanDerWaalsContact O-N 3.13Å; V313-W319 HydrophobicContact CG1-CZ2 4.45Å; V313-W319 HydrophobicContact CG2-CB 4.25Å; V313-W319 HydrophobicContact CG2-CD2 3.69Å; V313-W319 HydrophobicContact CG2-CE3 4.32Å; V313-W319 HydrophobicContact CG2-CG 3.64Å; V313-W319 HydrophobicContact CG2-CZ2 4.44Å
314	G	84.2	Confident	92.2	Very high	62 Å²	62	32.8 Å²	32.8	64%	0.639	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	60	-138.5	-168.4	0	0	0	0	0	110.7
315	N	71.9	Confident	92.2	Very high	133 Å²	133	33 Å²	33	71%	0.711	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99	-12.2	-178	-68.3	-20.3	0	0	0	113.9
316	D	80.4	Confident	92.1	Very high	35 Å²	35	37 Å²	37	19%	0.187	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-145.9	-6.7	-164.6	-56.1	-68.3	0	0	0	115.3	F280 K281	F280-D316 WeakPolarHBondContact CA-O 3.26Å; F280-D316 HydrophobicContact CB-CB 4.37Å; F280-D316 WeakPolarHBondContact CB-O 3.4Å; F280-D316 PolarHBondContact N-O 2.99Å; K281-D316 HydrophobicContact CD-CB 4.15Å; K281-D316 WeakPolarHBondContact CE-OD1 3.33Å; K281-D316 WeakPolarHBondContact CE-OD2 3.41Å; K281-D316 HydrophobicContact CG-CB 4.19Å; K281-D316 IonicContact NZ-OD1 2.78Å; K281-D316 IonicContact NZ-OD2 2.71Å; K281-D316 PolarHBondContact NZ-OD2 3.38Å
317	D	88.2	Confident	92.2	Very high	69 Å²	69	34.7 Å²	34.7	37%	0.369	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	114.9	-178.7	-73.8	-40.8	0	0	0	111.2	V313	V313-D317 HydrophobicContact CB-CB 4.15Å; V313-D317 PolarHBondContact N-O 3.04Å; V313-D317 PolarHBondContact O-N 2.74Å; V313-D317 VanDerWaalsContact O-N 3.13Å
318	L	92.4	Very high	92.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	118.1	172.1	-179.5	62	0	0	0	109.6	L234 V238 M278 L289 I293 V320	L234-L318 HydrophobicContact CD2-CD1 4.36Å; L234-L318 HydrophobicContact CD2-CD2 4.12Å; V238-L318 HydrophobicContact CG1-CD1 3.9Å; M278-L318 HydrophobicContact CE-CD2 3.86Å; M278-L318 HydrophobicContact CE-CG 4.04Å; M278-L318 PolarHBondContact N-O 3.05Å; M278-L318 PolarHBondContact O-N 3.17Å; L289-L318 HydrophobicContact CB-CD2 3.96Å; L289-L318 HydrophobicContact CD1-CD2 4.16Å; L289-L318 HydrophobicContact CD2-CD2 4.2Å; L289-L318 HydrophobicContact CG-CD2 4.34Å; I293-L318 HydrophobicContact CD1-CD1 4.45Å; I293-L318 HydrophobicContact CD1-CD2 4.16Å; I293-L318 HydrophobicContact CG1-CD2 4.09Å; L318-V320 HydrophobicContact CG-CG2 4.25Å
319	W	94.9	Very high	92.2	Very high	26 Å²	26	33.9 Å²	33.9	10%	0.098	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	129.1	173.8	-73.1	28.9	0	0	0	109.6	P243 L249 I275 K276 S310 F311 V313	P243-W319 HydrophobicContact CB-CE3 3.8Å; P243-W319 HydrophobicContact CB-CZ3 3.99Å; P243-W319 HydrophobicContact CG-CD2 4.43Å; P243-W319 HydrophobicContact CG-CE3 3.91Å; P243-W319 HydrophobicContact CG-CZ3 4.13Å; L249-W319 HydrophobicContact CD1-CH2 3.55Å; L249-W319 HydrophobicContact CD1-CZ2 4.08Å; L249-W319 HydrophobicContact CD1-CZ3 4.17Å; L249-W319 HydrophobicContact CD2-CH2 4.5Å; L249-W319 HydrophobicContact CD2-CZ3 4.32Å; L249-W319 HydrophobicContact CG-CH2 4.09Å; L249-W319 HydrophobicContact CG-CZ3 4.25Å; I275-W319 HydrophobicContact CD1-CE3 4.4Å; I275-W319 HydrophobicContact CG2-CB 4.09Å; I275-W319 HydrophobicContact CG2-CD2 4.06Å; I275-W319 HydrophobicContact CG2-CE3 3.82Å; I275-W319 HydrophobicContact CG2-CG 4.2Å; K276-W319 WeakPolarHBondContact O-CA 3.43Å; S310-W319 CarbonylContact C-O 3.52Å; S310-W319 WeakPolarHBondContact CA-O 3.09Å; S310-W319 VanDerWaalsContact CB-O 3.27Å; S310-W319 WeakPolarHBondContact CB-O 3.08Å; F311-W319 HydrophobicContact CB-CB 4.33Å; F311-W319 PolarHBondContact N-O 3.26Å; F311-W319 PolarHBondContact O-N 3.35Å; V313-W319 HydrophobicContact CG1-CZ2 4.45Å; V313-W319 HydrophobicContact CG2-CB 4.25Å; V313-W319 HydrophobicContact CG2-CD2 3.69Å; V313-W319 HydrophobicContact CG2-CE3 4.32Å; V313-W319 HydrophobicContact CG2-CG 3.64Å; V313-W319 HydrophobicContact CG2-CZ2 4.44Å
320	V	94.3	Very high	92.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	114.5	176	-176.1	0	0	0	0	109	I275 K276 M278 I293 M296 Y307 L318	I275-V320 WeakPolarHBondContact CA-O 3.36Å; K276-V320 HydrophobicContact CB-CB 4.45Å; K276-V320 PolarHBondContact N-O 3.38Å; K276-V320 PolarHBondContact O-N 2.92Å; M278-V320 HydrophobicContact CE-CB 4.32Å; M278-V320 HydrophobicContact CE-CG2 3.37Å; I293-V320 HydrophobicContact CD1-CB 4.46Å; I293-V320 HydrophobicContact CD1-CG1 4.34Å; I293-V320 HydrophobicContact CD1-CG2 3.32Å; M296-V320 HydrophobicContact CE-CG1 4.28Å; M296-V320 HydrophobicContact SD-CG1 4.39Å; Y307-V320 HydrophobicContact CD2-CG1 3.98Å; Y307-V320 HydrophobicContact CE2-CG1 4.1Å; L318-V320 HydrophobicContact CG-CG2 4.25Å
321	V	96.3	Very high	92.3	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	127.4	179.9	-169.4	0	0	0	0	109.3	Y247 V273 A274 I275 L308 E309 F311	Y247-V321 HydrophobicContact CD1-CG1 4.41Å; Y247-V321 HydrophobicContact CD2-CG2 4.36Å; Y247-V321 HydrophobicContact CE1-CG1 3.75Å; Y247-V321 HydrophobicContact CE2-CG1 4.44Å; Y247-V321 HydrophobicContact CE2-CG2 3.93Å; V273-V321 HydrophobicContact CB-CG1 4Å; V273-V321 HydrophobicContact CG1-CG1 4.43Å; V273-V321 HydrophobicContact CG2-CG1 3.82Å; A274-V321 WeakPolarHBondContact O-CA 3.26Å; I275-V321 HydrophobicContact CD1-CG2 4.1Å; I275-V321 HydrophobicContact CG1-CG1 4.25Å; I275-V321 HydrophobicContact CG1-CG2 4.07Å; L308-V321 HydrophobicContact CB-CB 4.43Å; L308-V321 HydrophobicContact CB-CG1 4.27Å; L308-V321 WeakPolarHBondContact CB-O 3.47Å; L308-V321 HydrophobicContact CD1-CG1 4.15Å; L308-V321 PolarHBondContact N-O 3.21Å; E309-V321 PolarHBondContact N-O 2.88Å; E309-V321 WeakPolarHBondContact O-CA 3.46Å; E309-V321 WeakPolarHBondContact O-CB 3.36Å; E309-V321 PolarHBondContact O-N 3.12Å; F311-V321 HydrophobicContact CD2-CG2 4.09Å; F311-V321 HydrophobicContact CE2-CG2 3.7Å
322	M	95.8	Very high	92.2	Very high	12 Å²	12	35.2 Å²	35.2	6%	0.059	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	166	-177.4	68.1	-169.8	99.4	0	0	111.3	V273 A274 K276 V305 N306	V273-M322 WeakPolarHBondContact CB-O 3.14Å; A274-M322 HydrophobicContact CB-CG 3.83Å; A274-M322 PolarHBondContact N-O 2.57Å; A274-M322 PolarHBondContact O-N 2.99Å; K276-M322 HydrophobicContact CB-CE 3.49Å; K276-M322 VanDerWaalsContact CB-CE 3.49Å; K276-M322 HydrophobicContact CD-CE 4.34Å; V305-M322 HydrophobicContact CG1-CB 4.02Å; V305-M322 HydrophobicContact CG1-CG 4.09Å; V305-M322 HydrophobicContact CG1-SD 3.92Å; N306-M322 VanDerWaalsContact O-CA 3.31Å; N306-M322 WeakPolarHBondContact O-CA 3.29Å; N306-M322 WeakPolarHBondContact O-CB 3.33Å
323	E	96.2	Very high	92.3	Very high	39 Å²	39	33.7 Å²	33.7	18%	0.182	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	144.8	171.1	68.8	177	128.2	0	0	111.3	V305 N306 L325 K382	V305-E323 HydrophobicContact CG1-CG 3.87Å; N306-E323 HydrophobicContact CB-CB 4.26Å; N306-E323 HydrophobicContact CB-CG 3.94Å; N306-E323 WeakPolarHBondContact CB-OE1 2.96Å; N306-E323 PolarHBondContact N-OE1 2.97Å; N306-E323 PolarHBondContact O-N 2.94Å; E323-L325 HydrophobicContact CG-CD1 4.01Å; E323-K382 WeakPolarHBondContact OE1-CD 3.45Å; E323-K382 IonicContact OE1-NZ 2.68Å; E323-K382 PolarHBondContact OE1-NZ 3.46Å; E323-K382 IonicContact OE2-NZ 3.81Å; E323-K382 PolarHBondContact OE2-NZ 2.97Å
324	Y	96.7	Very high	92.5	Very high	71 Å²	71	32.5 Å²	32.5	28%	0.278	19%	0.185	S	C	.	.			trans	-94.6	123.8	173.9	177.1	-125.5	0	0	0	110.7	I253 L263 T272 A274 E326	I253-Y324 HydrophobicContact CD1-CD2 4.04Å; I253-Y324 HydrophobicContact CD1-CE2 3.74Å; L263-Y324 HydrophobicContact CD1-CD1 3.47Å; L263-Y324 VanDerWaalsContact CD1-CD1 3.47Å; L263-Y324 HydrophobicContact CD1-CD2 3.81Å; L263-Y324 HydrophobicContact CD1-CE1 3.42Å; L263-Y324 VanDerWaalsContact CD1-CE1 3.42Å; L263-Y324 HydrophobicContact CD1-CE2 3.83Å; L263-Y324 HydrophobicContact CD1-CG 3.65Å; T272-Y324 HydrophobicContact CG2-CD1 3.54Å; T272-Y324 HydrophobicContact CG2-CE1 4.22Å; T272-Y324 HydrophobicContact CG2-CG 4.16Å; A274-Y324 HydrophobicContact CB-CD2 4.31Å; Y324-E326 HydrophobicContact CD1-CG 3.72Å; Y324-E326 HydrophobicContact CE1-CB 4.23Å; Y324-E326 HydrophobicContact CE1-CG 3.36Å
325	L	96.4	Very high	93	Very high	10 Å²	10	33.1 Å²	33.1	5%	0.052	18%	0.177	C	C	.	.			trans	-100.2	101.3	174	-76.2	117.5	0	0	0	110.3	V305 E323 G327 G328 L374 L375 K382	V305-L325 HydrophobicContact CB-CD1 4.47Å; V305-L325 HydrophobicContact CG1-CD1 4.23Å; V305-L325 HydrophobicContact CG2-CD1 3.61Å; E323-L325 HydrophobicContact CG-CD1 4.01Å; L325-G327 PolarHBondContact O-N 3.48Å; L325-G327 VanDerWaalsContact O-N 3.13Å; L325-G328 PolarHBondContact O-N 3.26Å; L325-L374 HydrophobicContact CB-CB 3.91Å; L325-L374 HydrophobicContact CB-CD1 4.33Å; L325-L374 HydrophobicContact CD1-CB 3.86Å; L325-L374 HydrophobicContact CD1-CD1 3.91Å; L325-L374 HydrophobicContact CD2-CB 4.33Å; L325-L374 HydrophobicContact CG-CB 4.25Å; L325-L375 WeakPolarHBondContact CB-O 3.45Å; L325-K382 HydrophobicContact CD1-CB 4.5Å; L325-K382 HydrophobicContact CD1-CD 4.23Å; L325-K382 HydrophobicContact CD2-CB 4.38Å; L325-K382 HydrophobicContact CD2-CD 3.99Å; L325-K382 HydrophobicContact CD2-CG 4.1Å
326	E	94.5	Very high	94	Very high	91 Å²	91	28.2 Å²	28.2	43%	0.425	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-13.7	-173.2	-84.7	-170.4	-124.2	0	0	116.4	Y324 G328 L377 K516	Y324-E326 HydrophobicContact CD1-CG 3.72Å; Y324-E326 HydrophobicContact CE1-CB 4.23Å; Y324-E326 HydrophobicContact CE1-CG 3.36Å; E326-G328 VanDerWaalsContact C-N 3.35Å; E326-L377 HydrophobicContact CB-CD1 3.98Å; E326-L377 HydrophobicContact CB-CD2 4.39Å; E326-L377 HydrophobicContact CB-CG 3.68Å; E326-L377 WeakPolarHBondContact OE2-CD1 3.38Å; E326-K516 PolarHBondContact O-NZ 3.44Å; E326-K516 IonicContact OE2-NZ 3.2Å; E326-K516 PolarHBondContact OE2-NZ 3.18Å
327	G	95.3	Very high	94.6	Very high	9 Å²	9	27.8 Å²	27.8	9%	0.093	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-8	179.7	0	0	0	0	0	114.1	L325 L375	L325-G327 PolarHBondContact O-N 3.48Å; L325-G327 VanDerWaalsContact O-N 3.13Å; G327-L375 CarbonylContact C-O 3.46Å; G327-L375 WeakPolarHBondContact CA-O 3.47Å; G327-L375 PolarHBondContact N-O 3.24Å
328	G	94.2	Very high	94.9	Very high	19 Å²	19	31.1 Å²	31.1	20%	0.196	17%	0.165	C	C	.	.			trans	79.5	-168.1	-179.8	0	0	0	0	0	113.1	L325 E326 L374 L375	L325-G328 PolarHBondContact O-N 3.26Å; E326-G328 VanDerWaalsContact C-N 3.35Å; G328-L374 WeakPolarHBondContact O-CA 3.31Å; G328-L375 PolarHBondContact O-N 3.44Å
329	C	94.9	Very high	95.1	Very high	22 Å²	22	31.6 Å²	31.6	15%	0.149	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-85.3	157.6	175.1	64	0	0	0	0	112.2	T331 E332 V373 L374	C329-T331 PolarHBondContact O-N 2.82Å; C329-E332 PolarHBondContact O-N 3.41Å; C329-V373 CarbonylContact C-O 3.44Å; C329-V373 VanDerWaalsContact CA-O 3.25Å; C329-V373 WeakPolarHBondContact CA-O 3.28Å; C329-L374 HydrophobicContact CB-CD2 3.91Å
330	L	97.4	Very high	95.1	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-61.5	-30.8	179.2	179.9	65.2	0	0	0	112.2	E332 V333 V334 V347 S370 V373 L375 M431 M435	L330-E332 PolarHBondContact O-N 3.47Å; L330-E332 VanDerWaalsContact O-N 3.13Å; L330-V333 HydrophobicContact CD1-CB 4.49Å; L330-V333 PolarHBondContact O-N 2.98Å; L330-V334 HydrophobicContact CD1-CG1 4Å; L330-V334 HydrophobicContact CG-CG1 3.94Å; L330-V334 PolarHBondContact O-N 3.35Å; L330-V347 HydrophobicContact CD2-CG1 3.81Å; L330-S370 WeakPolarHBondContact CB-O 3.44Å; L330-S370 PolarHBondContact N-O 3.43Å; L330-V373 HydrophobicContact CB-CB 3.88Å; L330-V373 HydrophobicContact CB-CG1 4.21Å; L330-V373 HydrophobicContact CD2-CB 4.16Å; L330-V373 HydrophobicContact CD2-CG1 4.25Å; L330-V373 HydrophobicContact CD2-CG2 4.36Å; L330-V373 PolarHBondContact N-O 2.89Å; L330-L375 HydrophobicContact CD1-CD1 4.24Å; L330-M431 HydrophobicContact CD2-SD 4.37Å; L330-M435 HydrophobicContact CD2-CG 4.13Å; L330-M435 HydrophobicContact CD2-SD 3.96Å
331	T	95.3	Very high	95.3	Very high	26 Å²	26	35.9 Å²	35.9	16%	0.16	19%	0.19	C	C	.	.	H	α-helix	trans	-48.8	-41.5	175.7	-36.3	0	0	0	0	111.8	C329 V333 V334 T335 S370 D371	C329-T331 PolarHBondContact O-N 2.82Å; T331-V333 VanDerWaalsContact C-N 3.3Å; T331-V333 PolarHBondContact O-N 2.92Å; T331-V334 WeakPolarHBondContact O-CG2 3.29Å; T331-V334 PolarHBondContact O-N 3.28Å; T331-T335 HydrophobicContact CG2-CG2 4.27Å; T331-T335 WeakPolarHBondContact O-CB 3.33Å; T331-T335 VanDerWaalsContact O-CG2 3.24Å; T331-T335 WeakPolarHBondContact O-CG2 3.47Å; T331-T335 PolarHBondContact O-N 3.22Å; T331-T335 VanDerWaalsContact O-N 3.08Å; T331-T335 PolarHBondContact O-OG1 2.96Å; T331-S370 WeakPolarHBondContact CA-OG 3.36Å; T331-S370 WeakPolarHBondContact CB-OG 3.24Å; T331-S370 VanDerWaalsContact OG1-C 3.28Å; T331-S370 PolarHBondContact OG1-OG 3.01Å; T331-D371 WeakPolarHBondContact OG1-CA 3.47Å; T331-D371 VanDerWaalsContact OG1-CG 3.29Å; T331-D371 PolarHBondContact OG1-N 3.25Å; T331-D371 PolarHBondContact OG1-OD1 3.31Å
332	E	93.4	Very high	95.4	Very high	47 Å²	47	42.3 Å²	42.3	22%	0.22	21%	0.214	C	C	.	.	H	α-helix	trans	-68.8	-31.9	-176.8	-58	172.4	179	0	0	112	C329 L330 E336 V515 K519	C329-E332 PolarHBondContact O-N 3.41Å; L330-E332 PolarHBondContact O-N 3.47Å; L330-E332 VanDerWaalsContact O-N 3.13Å; E332-E336 WeakPolarHBondContact O-CB 3.4Å; E332-E336 WeakPolarHBondContact O-CG 3.35Å; E332-V515 HydrophobicContact CB-CG1 3.74Å; E332-V515 WeakPolarHBondContact O-CG1 3.26Å; E332-K519 VanDerWaalsContact CD-CE 3.42Å; E332-K519 IonicContact OE1-NZ 2.69Å; E332-K519 PolarHBondContact OE1-NZ 3.47Å; E332-K519 WeakPolarHBondContact OE2-CE 3.49Å; E332-K519 IonicContact OE2-NZ 2.84Å; E332-K519 PolarHBondContact OE2-NZ 2.99Å
333	V	96.2	Very high	95.5	Very high	4 Å²	4	42 Å²	42	2%	0.024	21%	0.213	C	C	.	.	H	α-helix	trans	-75.9	-48.6	177.4	177.5	0	0	0	0	110.3	L330 T331 T335 E336 T337 L339 L375 I512 V515	L330-V333 HydrophobicContact CD1-CB 4.49Å; L330-V333 PolarHBondContact O-N 2.98Å; T331-V333 VanDerWaalsContact C-N 3.3Å; T331-V333 PolarHBondContact O-N 2.92Å; V333-T335 VanDerWaalsContact C-N 3.31Å; V333-T335 PolarHBondContact O-N 3.02Å; V333-E336 PolarHBondContact O-N 3.2Å; V333-T337 WeakPolarHBondContact CG1-OG1 3.5Å; V333-T337 WeakPolarHBondContact O-CA 3.27Å; V333-T337 WeakPolarHBondContact O-CB 3.3Å; V333-T337 PolarHBondContact O-N 2.95Å; V333-T337 PolarHBondContact O-OG1 3.45Å; V333-L339 HydrophobicContact CG1-CD1 4.47Å; V333-L339 HydrophobicContact CG1-CD2 4.06Å; V333-L375 HydrophobicContact CB-CD1 4.48Å; V333-L375 HydrophobicContact CG2-CD1 3.63Å; V333-I512 HydrophobicContact CG2-CG1 4.34Å; V333-V515 HydrophobicContact CG2-CG2 4.3Å
334	V	94.6	Very high	95.5	Very high	6 Å²	6	40.2 Å²	40.2	4%	0.036	21%	0.205	C	C	.	.	H	α-helix	trans	-70.9	-26	-174.6	-56.7	0	0	0	0	113.2	L330 T331 L339 E434 M435	L330-V334 HydrophobicContact CD1-CG1 4Å; L330-V334 HydrophobicContact CG-CG1 3.94Å; L330-V334 PolarHBondContact O-N 3.35Å; T331-V334 WeakPolarHBondContact O-CG2 3.29Å; T331-V334 PolarHBondContact O-N 3.28Å; V334-L339 HydrophobicContact CG1-CD1 4.34Å; V334-E434 HydrophobicContact CG2-CG 4.29Å; V334-M435 HydrophobicContact CG1-CB 4.15Å; V334-M435 HydrophobicContact CG1-CG 3.64Å
335	T	93	Very high	95.6	Very high	76 Å²	76	36.9 Å²	36.9	47%	0.466	19%	0.192	S	C	.	.	H	α-helix	trans	-82.5	-27.2	176.8	52.9	0	0	0	0	113.1	T331 V333	T331-T335 HydrophobicContact CG2-CG2 4.27Å; T331-T335 WeakPolarHBondContact O-CB 3.33Å; T331-T335 VanDerWaalsContact O-CG2 3.24Å; T331-T335 WeakPolarHBondContact O-CG2 3.47Å; T331-T335 PolarHBondContact O-N 3.22Å; T331-T335 VanDerWaalsContact O-N 3.08Å; T331-T335 PolarHBondContact O-OG1 2.96Å; V333-T335 VanDerWaalsContact C-N 3.31Å; V333-T335 PolarHBondContact O-N 3.02Å
336	E	92.8	Very high	95.7	Very high	30 Å²	30	36.6 Å²	36.6	14%	0.14	19%	0.19	C	C	.	.	H	α-helix	trans	-103.5	-17.7	-175.7	-65.8	-67.1	173.7	0	0	113.7	K164 E332 V333 V515 R522	K164-E336 WeakPolarHBondContact CE-O 3.37Å; K164-E336 PolarHBondContact NZ-O 3.3Å; K164-E336 IonicContact NZ-OE2 3.86Å; E332-E336 WeakPolarHBondContact O-CB 3.4Å; E332-E336 WeakPolarHBondContact O-CG 3.35Å; V333-E336 PolarHBondContact O-N 3.2Å; E336-V515 HydrophobicContact CB-CG2 3.99Å; E336-R522 VanDerWaalsContact CD-NH2 3.32Å; E336-R522 IonicContact OE1-CZ 2.94Å; E336-R522 VanDerWaalsContact OE1-CZ 3.23Å; E336-R522 IonicContact OE1-NH1 3.1Å; E336-R522 PolarHBondContact OE1-NH1 3.41Å; E336-R522 IonicContact OE1-NH2 3.23Å; E336-R522 PolarHBondContact OE1-NH2 3.46Å; E336-R522 IonicContact OE2-NH2 2.6Å; E336-R522 PolarHBondContact OE2-NH2 2.9Å; E336-R522 VanDerWaalsContact OE2-NH2 3.1Å
337	T	94.4	Very high	95.9	Very high	25 Å²	25	32.2 Å²	32.2	15%	0.153	17%	0.17	C	C	.	.	S	Bend	trans	-137.5	164.6	-174.8	74.7	0	0	0	0	111.4	V333 Y511 V515	V333-T337 WeakPolarHBondContact CG1-OG1 3.5Å; V333-T337 WeakPolarHBondContact O-CA 3.27Å; V333-T337 WeakPolarHBondContact O-CB 3.3Å; V333-T337 PolarHBondContact O-N 2.95Å; V333-T337 PolarHBondContact O-OG1 3.45Å; T337-Y511 HydrophobicContact CG2-CD1 4.07Å; T337-Y511 WeakPolarHBondContact OG1-CD1 3.48Å; T337-V515 HydrophobicContact CG2-CG2 3.77Å
338	I	94.6	Very high	96.1	Very high	140 Å²	140	31.8 Å²	31.8	72%	0.718	17%	0.166	S	C	*	.			trans	-111.7	122.6	175.7	-58.5	173.3	0	0	0	107.6	Y511	I338-Y511 WeakPolarHBondContact O-CE1 3.22Å
339	L	95.7	Very high	96.3	Very high	9 Å²	9	31.9 Å²	31.9	5%	0.047	16%	0.162	C	C	.	.			trans	-91.2	140.4	175.9	-60.6	-179	0	0	0	110	V333 V334 Q343 I344 M435 Y511	V333-L339 HydrophobicContact CG1-CD1 4.47Å; V333-L339 HydrophobicContact CG1-CD2 4.06Å; V334-L339 HydrophobicContact CG1-CD1 4.34Å; L339-Q343 HydrophobicContact CB-CB 4.13Å; L339-Q343 HydrophobicContact CD2-CB 4.27Å; L339-I344 HydrophobicContact CB-CG1 3.91Å; L339-M435 HydrophobicContact CD1-CG 4.46Å; L339-M435 HydrophobicContact CD1-SD 4.38Å; L339-Y511 HydrophobicContact CD2-CD1 3.87Å; L339-Y511 HydrophobicContact CD2-CE1 4.14Å; L339-Y511 HydrophobicContact CD2-CG 4.19Å
340	D	95.7	Very high	96.5	Very high	71 Å²	71	32 Å²	32	38%	0.38	16%	0.16	S	C	.	.			trans	-78.9	164.2	168.3	72.9	28.3	0	0	0	111.4	R342 Q343 I344	D340-R342 PolarHBondContact O-N 3.47Å; D340-R342 VanDerWaalsContact O-N 3.1Å; D340-R342 WeakPolarHBondContact OD1-CA 3.49Å; D340-R342 WeakPolarHBondContact OD1-CB 3.35Å; D340-R342 PolarHBondContact OD1-N 3.13Å; D340-Q343 WeakPolarHBondContact O-CB 3.13Å; D340-Q343 PolarHBondContact O-N 2.8Å; D340-Q343 WeakPolarHBondContact OD1-CG 3.41Å; D340-Q343 PolarHBondContact OD1-N 3.38Å; D340-I344 WeakPolarHBondContact O-CG1 3.34Å; D340-I344 PolarHBondContact O-N 3.24Å
341	E	97.5	Very high	96.5	Very high	45 Å²	45	32 Å²	32	21%	0.21	16%	0.16	C	C	.	.	H	α-helix	trans	-56	-31	-178.9	-72.5	-167.2	-173	0	0	113.8	I344 A345 L468 S469 F472 F498	E341-I344 PolarHBondContact O-N 2.77Å; E341-A345 VanDerWaalsContact O-CB 3.27Å; E341-A345 WeakPolarHBondContact O-CB 3.43Å; E341-A345 PolarHBondContact O-N 3.45Å; E341-L468 WeakPolarHBondContact OE1-CA 3.08Å; E341-S469 PolarHBondContact OE1-N 3.04Å; E341-S469 WeakPolarHBondContact OE2-CB 3.38Å; E341-S469 PolarHBondContact OE2-OG 2.86Å; E341-F472 HydrophobicContact CG-CD1 3.72Å; E341-F472 HydrophobicContact CG-CE1 4.32Å; E341-F472 HydrophobicContact CG-CG 4.4Å; E341-F498 HydrophobicContact CB-CE2 4.12Å
342	R	97.8	Very high	96.7	Very high	135 Å²	135	30.7 Å²	30.7	51%	0.509	15%	0.153	S	C	.	.	H	α-helix	trans	-74.1	-35.1	-179.7	-62.1	175.7	160.9	-102.7	5.9	111.3	D340 C346 C501 A503	D340-R342 PolarHBondContact O-N 3.47Å; D340-R342 VanDerWaalsContact O-N 3.1Å; D340-R342 WeakPolarHBondContact OD1-CA 3.49Å; D340-R342 WeakPolarHBondContact OD1-CB 3.35Å; D340-R342 PolarHBondContact OD1-N 3.13Å; R342-C346 PolarHBondContact O-N 3.48Å; R342-C346 VanDerWaalsContact O-N 3.16Å; R342-C501 HydrophobicContact CG-CB 4.5Å; R342-C501 WeakPolarHBondContact CG-O 3.45Å; R342-C501 PolarHBondContact NH1-O 3.13Å; R342-A503 HydrophobicContact CB-CB 4.08Å; R342-A503 PolarHBondContact O-N 2.97Å
343	Q	97.9	Very high	96.9	Very high	7 Å²	7	31.4 Å²	31.4	3%	0.033	16%	0.155	C	C	.	.	H	α-helix	trans	-70.4	-42.3	172.6	-69.6	162	-23	0	0	110.8	L339 D340 A345 C346 V347 L508 Y511	L339-Q343 HydrophobicContact CB-CB 4.13Å; L339-Q343 HydrophobicContact CD2-CB 4.27Å; D340-Q343 WeakPolarHBondContact O-CB 3.13Å; D340-Q343 PolarHBondContact O-N 2.8Å; D340-Q343 WeakPolarHBondContact OD1-CG 3.41Å; D340-Q343 PolarHBondContact OD1-N 3.38Å; Q343-A345 PolarHBondContact O-N 3.32Å; Q343-C346 PolarHBondContact O-N 2.93Å; Q343-C346 PolarHBondContact O-SG 2.93Å; Q343-V347 PolarHBondContact O-N 3.19Å; Q343-L508 HydrophobicContact CB-CD2 4.06Å; Q343-L508 HydrophobicContact CG-CD2 4.36Å; Q343-Y511 PolarHBondContact NE2-OH 3.48Å; Q343-Y511 VanDerWaalsContact NE2-OH 3.1Å; Q343-Y511 PolarHBondContact OE1-OH 3.34Å
344	I	98.2	Very high	97	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-58.3	-49.4	172.7	-64.6	177.3	0	0	0	109.8	L339 D340 E341 C346 V347 L348 M435 F472	L339-I344 HydrophobicContact CB-CG1 3.91Å; D340-I344 WeakPolarHBondContact O-CG1 3.34Å; D340-I344 PolarHBondContact O-N 3.24Å; E341-I344 PolarHBondContact O-N 2.77Å; I344-C346 VanDerWaalsContact C-N 3.3Å; I344-C346 PolarHBondContact O-N 2.84Å; I344-V347 PolarHBondContact O-N 3.04Å; I344-L348 HydrophobicContact CG2-CD1 3.7Å; I344-L348 HydrophobicContact CG2-CG 4.28Å; I344-L348 WeakPolarHBondContact O-CG 3.43Å; I344-L348 PolarHBondContact O-N 3.24Å; I344-M435 HydrophobicContact CD1-CB 4.13Å; I344-M435 HydrophobicContact CG1-CB 3.97Å; I344-M435 HydrophobicContact CG1-SD 4.45Å; I344-M435 HydrophobicContact CG2-CB 4.42Å; I344-M435 HydrophobicContact CG2-CE 3.9Å; I344-M435 HydrophobicContact CG2-SD 4.2Å; I344-F472 HydrophobicContact CD1-CE1 4.21Å; I344-F472 HydrophobicContact CD1-CZ 4.29Å; I344-F472 HydrophobicContact CG2-CE2 4.18Å; I344-F472 HydrophobicContact CG2-CZ 3.84Å
345	A	98.6	Very high	97.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57.2	-39.6	178.4	0	0	0	0	0	112.6	E341 Q343 L348 V349 F498 L499 A502	E341-A345 VanDerWaalsContact O-CB 3.27Å; E341-A345 WeakPolarHBondContact O-CB 3.43Å; E341-A345 PolarHBondContact O-N 3.45Å; Q343-A345 PolarHBondContact O-N 3.32Å; A345-L348 PolarHBondContact O-N 2.78Å; A345-V349 VanDerWaalsContact O-CG2 3.28Å; A345-V349 WeakPolarHBondContact O-CG2 3.49Å; A345-V349 PolarHBondContact O-N 3.19Å; A345-F498 HydrophobicContact CB-CD1 4.42Å; A345-F498 HydrophobicContact CB-CE1 3.86Å; A345-F498 HydrophobicContact CB-CE2 4.3Å; A345-F498 HydrophobicContact CB-CZ 3.78Å; A345-L499 HydrophobicContact CB-CD2 4.37Å; A345-A502 HydrophobicContact CB-CB 3.99Å
346	C	98	Very high	97.4	Very high	4 Å²	4	30.1 Å²	30.1	3%	0.027	15%	0.145	C	C	.	.	H	α-helix	trans	-68.9	-34.8	179.8	82.6	0	0	0	0	113.3	R342 Q343 I344 E350 A502 A503 L505	R342-C346 PolarHBondContact O-N 3.48Å; R342-C346 VanDerWaalsContact O-N 3.16Å; Q343-C346 PolarHBondContact O-N 2.93Å; Q343-C346 PolarHBondContact O-SG 2.93Å; I344-C346 VanDerWaalsContact C-N 3.3Å; I344-C346 PolarHBondContact O-N 2.84Å; C346-E350 PolarHBondContact O-N 3.37Å; C346-A502 HydrophobicContact CB-CB 4.09Å; C346-A503 WeakPolarHBondContact CB-O 3.19Å; C346-L505 HydrophobicContact CB-CD2 4.2Å
347	V	98.6	Very high	97.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.8	-47.5	171.9	175.9	0	0	0	0	110.2	L330 Q343 I344 V349 E350 C351 V381 M435 L508	L330-V347 HydrophobicContact CD2-CG1 3.81Å; Q343-V347 PolarHBondContact O-N 3.19Å; I344-V347 PolarHBondContact O-N 3.04Å; V347-V349 VanDerWaalsContact C-N 3.34Å; V347-V349 PolarHBondContact O-N 3.21Å; V347-E350 PolarHBondContact O-N 2.82Å; V347-E350 VanDerWaalsContact O-N 3.17Å; V347-C351 PolarHBondContact O-N 2.66Å; V347-C351 PolarHBondContact O-SG 2.88Å; V347-C351 VanDerWaalsContact O-SG 3.42Å; V347-V381 HydrophobicContact CG1-CG1 4.13Å; V347-V381 HydrophobicContact CG2-CG2 4.46Å; V347-M435 HydrophobicContact CB-CE 4.45Å; V347-M435 HydrophobicContact CB-SD 3.95Å; V347-M435 HydrophobicContact CG1-CE 4.2Å; V347-M435 HydrophobicContact CG1-SD 3.87Å; V347-M435 HydrophobicContact CG2-SD 4.32Å; V347-L508 HydrophobicContact CG2-CD1 3.84Å; V347-L508 HydrophobicContact CG2-CD2 4.25Å
348	L	98.8	Very high	97.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.5	-38.8	-179.6	-68	170.8	0	0	0	112.7	I344 A345 E350 C351 L352 L428 M431 A432 M435 F475 F498 L499	I344-L348 HydrophobicContact CG2-CD1 3.7Å; I344-L348 HydrophobicContact CG2-CG 4.28Å; I344-L348 WeakPolarHBondContact O-CG 3.43Å; I344-L348 PolarHBondContact O-N 3.24Å; A345-L348 PolarHBondContact O-N 2.78Å; L348-E350 VanDerWaalsContact C-N 3.34Å; L348-E350 PolarHBondContact O-N 2.99Å; L348-C351 PolarHBondContact O-N 3.1Å; L348-L352 VanDerWaalsContact O-CB 3.26Å; L348-L352 WeakPolarHBondContact O-CB 3.38Å; L348-L352 VanDerWaalsContact O-CG 3.3Å; L348-L352 WeakPolarHBondContact O-CG 3.5Å; L348-L352 PolarHBondContact O-N 3.35Å; L348-L428 HydrophobicContact CD2-CD1 3.84Å; L348-L428 HydrophobicContact CD2-CD2 4.3Å; L348-L428 HydrophobicContact CD2-CG 3.86Å; L348-M431 HydrophobicContact CD2-CE 4.28Å; L348-A432 HydrophobicContact CD1-CB 4.18Å; L348-A432 HydrophobicContact CD2-CB 4.14Å; L348-M435 HydrophobicContact CD1-CE 4.48Å; L348-M435 HydrophobicContact CD2-CE 3.67Å; L348-M435 HydrophobicContact CG-CE 3.84Å; L348-F475 HydrophobicContact CB-CZ 4.48Å; L348-F475 HydrophobicContact CD1-CD1 4.32Å; L348-F475 HydrophobicContact CD1-CE1 3.64Å; L348-F475 HydrophobicContact CD1-CZ 4.07Å; L348-F498 HydrophobicContact CD1-CE1 3.84Å; L348-L499 HydrophobicContact CB-CD2 4.18Å
349	V	98.7	Very high	97.8	Very high	21 Å²	21	23.5 Å²	23.5	13%	0.127	11%	0.109	C	C	.	.	H	α-helix	trans	-56.7	-47.1	174.4	166	0	0	0	0	111.2	A345 V347 L352 K353 L499 A502	A345-V349 VanDerWaalsContact O-CG2 3.28Å; A345-V349 WeakPolarHBondContact O-CG2 3.49Å; A345-V349 PolarHBondContact O-N 3.19Å; V347-V349 VanDerWaalsContact C-N 3.34Å; V347-V349 PolarHBondContact O-N 3.21Å; V349-L352 PolarHBondContact O-N 3.42Å; V349-K353 HydrophobicContact CG1-CD 4.24Å; V349-K353 VanDerWaalsContact CG1-CE 3.46Å; V349-K353 VanDerWaalsContact O-CG 3.3Å; V349-K353 WeakPolarHBondContact O-CG 3.33Å; V349-K353 PolarHBondContact O-N 3.04Å; V349-L499 HydrophobicContact CG2-CB 3.73Å; V349-L499 HydrophobicContact CG2-CD1 3.93Å; V349-L499 HydrophobicContact CG2-CD2 4.03Å; V349-L499 HydrophobicContact CG2-CG 4.1Å; V349-A502 HydrophobicContact CG2-CB 4.15Å
350	E	98.6	Very high	97.8	Very high	23 Å²	23	27 Å²	27	11%	0.107	13%	0.134	C	C	.	.	H	α-helix	trans	-71.6	-38.6	-177.7	-62.7	-54.6	104.2	0	0	112	N303 C346 V347 L348 K353 A354 V381 L505	N303-E350 WeakPolarHBondContact CB-O 3.27Å; N303-E350 PolarHBondContact ND2-OE2 3.41Å; C346-E350 PolarHBondContact O-N 3.37Å; V347-E350 PolarHBondContact O-N 2.82Å; V347-E350 VanDerWaalsContact O-N 3.17Å; L348-E350 VanDerWaalsContact C-N 3.34Å; L348-E350 PolarHBondContact O-N 2.99Å; E350-K353 PolarHBondContact O-N 3.4Å; E350-K353 IonicContact OE1-NZ 2.57Å; E350-K353 PolarHBondContact OE1-NZ 3.46Å; E350-A354 PolarHBondContact O-N 3.28Å; E350-V381 HydrophobicContact CB-CB 3.73Å; E350-V381 HydrophobicContact CB-CG1 4.06Å; E350-V381 HydrophobicContact CB-CG2 4.46Å; E350-V381 HydrophobicContact CG-CB 4.09Å; E350-V381 HydrophobicContact CG-CG2 4.41Å; E350-L505 HydrophobicContact CG-CD1 4.15Å; E350-L505 HydrophobicContact CG-CD2 3.96Å
351	C	98.7	Very high	97.7	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.007	13%	0.132	C	C	.	.	H	α-helix	trans	-63.6	-41.9	172.6	-67	0	0	0	0	112	V347 L348 A354 L355 L383 L428 M431	V347-C351 PolarHBondContact O-N 2.66Å; V347-C351 PolarHBondContact O-SG 2.88Å; V347-C351 VanDerWaalsContact O-SG 3.42Å; L348-C351 PolarHBondContact O-N 3.1Å; C351-A354 WeakPolarHBondContact O-CB 3.35Å; C351-A354 PolarHBondContact O-N 3.47Å; C351-L355 WeakPolarHBondContact O-CG 3.39Å; C351-L355 PolarHBondContact O-N 2.76Å; C351-L383 HydrophobicContact CB-CD2 4.3Å; C351-L428 HydrophobicContact CB-CD1 3.72Å; C351-M431 HydrophobicContact CB-CE 4.4Å
352	L	98.8	Very high	97.4	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-66.6	-38.2	177.9	-80.3	167.5	0	0	0	112.5	L348 V349 A354 L355 D356 I425 L428 F475 A490 L493 L494 L499	L348-L352 VanDerWaalsContact O-CB 3.26Å; L348-L352 WeakPolarHBondContact O-CB 3.38Å; L348-L352 VanDerWaalsContact O-CG 3.3Å; L348-L352 WeakPolarHBondContact O-CG 3.5Å; L348-L352 PolarHBondContact O-N 3.35Å; V349-L352 PolarHBondContact O-N 3.42Å; L352-A354 VanDerWaalsContact C-N 3.28Å; L352-A354 PolarHBondContact O-N 2.98Å; L352-L355 PolarHBondContact O-N 3.33Å; L352-D356 VanDerWaalsContact O-CB 3.26Å; L352-D356 WeakPolarHBondContact O-CB 3.44Å; L352-D356 PolarHBondContact O-N 2.97Å; L352-I425 HydrophobicContact CD2-CD1 4.27Å; L352-L428 HydrophobicContact CD1-CD2 4.26Å; L352-L428 HydrophobicContact CD2-CD2 3.51Å; L352-L428 HydrophobicContact CG-CD2 3.69Å; L352-F475 HydrophobicContact CD1-CE2 4.12Å; L352-F475 HydrophobicContact CD1-CZ 3.99Å; L352-A490 HydrophobicContact CD2-CB 4.12Å; L352-L493 HydrophobicContact CD1-CB 3.78Å; L352-L493 HydrophobicContact CD2-CB 3.84Å; L352-L493 HydrophobicContact CD2-CD1 3.95Å; L352-L494 HydrophobicContact CB-CD2 3.63Å; L352-L494 HydrophobicContact CB-CG 3.9Å; L352-L499 HydrophobicContact CD1-CD1 3.52Å
353	K	98.6	Very high	97.1	Very high	61 Å²	61	21.2 Å²	21.2	27%	0.265	12%	0.116	S	C	.	.	H	α-helix	trans	-59.9	-40.3	172.5	-72.7	167.7	-174.7	161.1	0	111.7	V349 E350 F357 L494	V349-K353 HydrophobicContact CG1-CD 4.24Å; V349-K353 VanDerWaalsContact CG1-CE 3.46Å; V349-K353 VanDerWaalsContact O-CG 3.3Å; V349-K353 WeakPolarHBondContact O-CG 3.33Å; V349-K353 PolarHBondContact O-N 3.04Å; E350-K353 PolarHBondContact O-N 3.4Å; E350-K353 IonicContact OE1-NZ 2.57Å; E350-K353 PolarHBondContact OE1-NZ 3.46Å; K353-F357 WeakPolarHBondContact O-CB 3.18Å; K353-F357 PolarHBondContact O-N 2.89Å; K353-L494 HydrophobicContact CG-CD2 4Å
354	A	97.9	Very high	96.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-66.1	-46.1	174.9	0	0	0	0	0	112.3	N303 L304 E350 C351 L352 F357 L358 L383	N303-A354 HydrophobicContact CB-CB 3.82Å; L304-A354 HydrophobicContact CD2-CB 3.62Å; L304-A354 HydrophobicContact CG-CB 4.45Å; E350-A354 PolarHBondContact O-N 3.28Å; C351-A354 WeakPolarHBondContact O-CB 3.35Å; C351-A354 PolarHBondContact O-N 3.47Å; L352-A354 VanDerWaalsContact C-N 3.28Å; L352-A354 PolarHBondContact O-N 2.98Å; A354-F357 PolarHBondContact O-N 3.49Å; A354-L358 WeakPolarHBondContact O-CG 3.27Å; A354-L358 PolarHBondContact O-N 3.39Å; A354-L383 HydrophobicContact CB-CD1 3.54Å; A354-L383 HydrophobicContact CB-CG 3.86Å
355	L	98.2	Very high	96.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.5	-44.8	178.7	-72.2	178.3	0	0	0	112.2	C351 L352 F357 L358 H359 H365 I368 L383 D424 I425 L428 A490	C351-L355 WeakPolarHBondContact O-CG 3.39Å; C351-L355 PolarHBondContact O-N 2.76Å; L352-L355 PolarHBondContact O-N 3.33Å; L355-F357 VanDerWaalsContact C-N 3.3Å; L355-F357 PolarHBondContact O-N 3Å; L355-L358 PolarHBondContact O-N 2.99Å; L355-L358 VanDerWaalsContact O-N 3.11Å; L355-H359 VanDerWaalsContact O-CB 3.27Å; L355-H359 WeakPolarHBondContact O-CB 3.44Å; L355-H359 PolarHBondContact O-CD2 3.34Å; L355-H359 VanDerWaalsContact O-CD2 3.23Å; L355-H359 PolarHBondContact O-N 3.02Å; L355-H365 HydrophobicContact CD2-CB 4.46Å; L355-I368 HydrophobicContact CD2-CD1 3.83Å; L355-I368 HydrophobicContact CD2-CG1 4.08Å; L355-L383 HydrophobicContact CD2-CD1 4.15Å; L355-L383 HydrophobicContact CG-CD1 4.21Å; L355-D424 HydrophobicContact CD1-CB 4.27Å; L355-D424 HydrophobicContact CD2-CB 3.82Å; L355-I425 HydrophobicContact CD1-CD1 4.31Å; L355-L428 HydrophobicContact CD1-CB 4.45Å; L355-L428 HydrophobicContact CD1-CD1 4.25Å; L355-A490 HydrophobicContact CB-CB 4.17Å
356	D	98.3	Very high	96.2	Very high	59 Å²	59	21.4 Å²	21.4	32%	0.316	12%	0.117	S	C	.	.	H	α-helix	trans	-56.7	-45.3	176.7	-172.6	51.3	0	0	0	111.2	L352 H359 S360 A490 A491 L494	L352-D356 VanDerWaalsContact O-CB 3.26Å; L352-D356 WeakPolarHBondContact O-CB 3.44Å; L352-D356 PolarHBondContact O-N 2.97Å; D356-H359 PolarHBondContact O-N 3.03Å; D356-S360 WeakPolarHBondContact O-CB 3.38Å; D356-S360 PolarHBondContact O-N 3.36Å; D356-A490 HydrophobicContact CB-CB 3.8Å; D356-A491 WeakPolarHBondContact OD1-CB 3.06Å; D356-A491 PolarHBondContact OD1-N 3.2Å; D356-L494 HydrophobicContact CB-CD1 3.86Å
357	F	97.5	Very high	95.9	Very high	42 Å²	42	21.4 Å²	21.4	18%	0.184	12%	0.116	C	C	.	.	H	α-helix	trans	-61.9	-43.6	174	174.6	-100.4	0	0	0	113	H301 L304 K353 A354 L355 S360 H361	H301-F357 HydrophobicContact CB-CD1 3.62Å; H301-F357 HydrophobicContact CB-CD2 4.49Å; H301-F357 HydrophobicContact CB-CE1 3.69Å; H301-F357 HydrophobicContact CB-CG 4.03Å; H301-F357 HydrophobicContact CB-CZ 4.19Å; H301-F357 AromaticContact CD2-CG 3.95Å; L304-F357 HydrophobicContact CD1-CD1 3.91Å; L304-F357 HydrophobicContact CD1-CE1 3.95Å; K353-F357 WeakPolarHBondContact O-CB 3.18Å; K353-F357 PolarHBondContact O-N 2.89Å; A354-F357 PolarHBondContact O-N 3.49Å; L355-F357 VanDerWaalsContact C-N 3.3Å; L355-F357 PolarHBondContact O-N 3Å; F357-S360 PolarHBondContact O-OG 2.93Å; F357-H361 AromaticContact CD2-CE1 3.7Å; F357-H361 AromaticContact CD2-ND1 3.97Å; F357-H361 AromaticContact CE2-CE1 3.36Å; F357-H361 WeakPolarHBondContact CE2-CE1 3.06Å; F357-H361 AromaticContact CE2-ND1 3.87Å; F357-H361 AromaticContact CZ-CE1 3.88Å; F357-H361 PolarHBondContact O-ND1 2.85Å
358	L	95.6	Very high	95.8	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-67	-44.8	177.9	-69.5	172	0	0	0	111.4	L304 A354 L355 S360 H361 S362 I363 F386	L304-L358 HydrophobicContact CD1-CD2 3.91Å; L304-L358 HydrophobicContact CD1-CG 4.34Å; L304-L358 HydrophobicContact CD2-CD1 4.07Å; L304-L358 HydrophobicContact CD2-CG 4.37Å; A354-L358 WeakPolarHBondContact O-CG 3.27Å; A354-L358 PolarHBondContact O-N 3.39Å; L355-L358 PolarHBondContact O-N 2.99Å; L355-L358 VanDerWaalsContact O-N 3.11Å; L358-S360 VanDerWaalsContact C-N 3.34Å; L358-S360 PolarHBondContact O-N 3.09Å; L358-H361 CarbonylContact O-C 3.48Å; L358-H361 WeakPolarHBondContact O-CA 3.26Å; L358-H361 PolarHBondContact O-N 3.32Å; L358-S362 PolarHBondContact O-N 3.39Å; L358-I363 CarbonylContact C-O 3.59Å; L358-I363 HydrophobicContact CB-CB 4.16Å; L358-I363 HydrophobicContact CD2-CB 4.27Å; L358-I363 HydrophobicContact CD2-CD1 4.04Å; L358-I363 HydrophobicContact CD2-CG2 4.13Å; L358-I363 WeakPolarHBondContact O-CB 3.18Å; L358-I363 PolarHBondContact O-N 3.28Å; L358-F386 HydrophobicContact CD1-CE1 4.08Å; L358-F386 HydrophobicContact CD2-CE1 4.4Å
359	H	96	Very high	95.7	Very high	15 Å²	15	22.6 Å²	22.6	7%	0.069	12%	0.122	C	C	.	.	H	α-helix	trans	-65.7	-37.5	-177.7	-65.3	-176.5	0	0	0	111.1	L355 D356 H361 S362 I363 Y421 D424	L355-H359 VanDerWaalsContact O-CB 3.27Å; L355-H359 WeakPolarHBondContact O-CB 3.44Å; L355-H359 PolarHBondContact O-CD2 3.34Å; L355-H359 VanDerWaalsContact O-CD2 3.23Å; L355-H359 PolarHBondContact O-N 3.02Å; D356-H359 PolarHBondContact O-N 3.03Å; H359-H361 PolarHBondContact O-N 2.54Å; H359-S362 PolarHBondContact O-N 2.96Å; H359-I363 PolarHBondContact CD2-O 3.35Å; H359-Y421 HydrophobicContact CB-CD2 4.1Å; H359-Y421 HydrophobicContact CB-CG 4.1Å; H359-Y421 AromaticContact CE1-CD2 3.91Å; H359-Y421 PolarHBondContact CE1-O 2.83Å; H359-Y421 VanDerWaalsContact CE1-O 3.24Å; H359-Y421 AromaticContact CG-CD2 3.76Å; H359-Y421 AromaticContact CG-CG 3.85Å; H359-Y421 AromaticContact ND1-CD2 3.35Å; H359-Y421 VanDerWaalsContact ND1-CD2 3.35Å; H359-Y421 WeakPolarHBondContact ND1-CD2 3.4Å; H359-Y421 AromaticContact ND1-CG 3.89Å; H359-Y421 PolarHBondContact NE2-O 3.42Å; H359-D424 IonicContact CD2-OD2 3.78Å; H359-D424 IonicContact CE1-OD2 3.27Å; H359-D424 IonicContact NE2-OD2 2.91Å; H359-D424 PolarHBondContact NE2-OD2 3.22Å
360	S	95.8	Very high	95.5	Very high	81 Å²	81	21.6 Å²	21.6	57%	0.566	12%	0.116	S	C	*	.	H	α-helix	trans	-63.7	-21.1	173.6	80.5	0	0	0	0	113.3	D356 F357 L358	D356-S360 WeakPolarHBondContact O-CB 3.38Å; D356-S360 PolarHBondContact O-N 3.36Å; F357-S360 PolarHBondContact O-OG 2.93Å; L358-S360 VanDerWaalsContact C-N 3.34Å; L358-S360 PolarHBondContact O-N 3.09Å
361	H	93.1	Very high	95.3	Very high	74 Å²	74	23.8 Å²	23.8	34%	0.343	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	15.2	174.1	-65.3	91.6	0	0	0	112.8	Y299 F357 L358 H359 I363	Y299-H361 HydrophobicContact CD1-CB 4.1Å; Y299-H361 AromaticContact CD1-CD2 3.96Å; Y299-H361 AromaticContact CD1-CG 3.86Å; Y299-H361 HydrophobicContact CE1-CB 3.64Å; Y299-H361 AromaticContact CE1-CD2 3.52Å; Y299-H361 AromaticContact CE1-CG 3.61Å; F357-H361 AromaticContact CD2-CE1 3.7Å; F357-H361 AromaticContact CD2-ND1 3.97Å; F357-H361 AromaticContact CE2-CE1 3.36Å; F357-H361 WeakPolarHBondContact CE2-CE1 3.06Å; F357-H361 AromaticContact CE2-ND1 3.87Å; F357-H361 AromaticContact CZ-CE1 3.88Å; F357-H361 PolarHBondContact O-ND1 2.85Å; L358-H361 CarbonylContact O-C 3.48Å; L358-H361 WeakPolarHBondContact O-CA 3.26Å; L358-H361 PolarHBondContact O-N 3.32Å; H359-H361 PolarHBondContact O-N 2.54Å; H361-I363 HydrophobicContact CB-CD1 4.07Å; H361-I363 HydrophobicContact CB-CG1 4.23Å; H361-I363 PolarHBondContact O-N 2.83Å
362	S	91.7	Very high	95.1	Very high	56 Å²	56	24.2 Å²	24.2	39%	0.392	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	30.2	-179.8	-66.3	0	0	0	0	113.2	L358 H359 Q391 L392	L358-S362 PolarHBondContact O-N 3.39Å; H359-S362 PolarHBondContact O-N 2.96Å; S362-Q391 CarbonylContact O-C 3.53Å; S362-Q391 WeakPolarHBondContact O-CA 3.3Å; S362-L392 PolarHBondContact O-N 2.9Å
363	I	91.7	Very high	95	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	126.1	177.7	-54.8	169.5	0	0	0	109.1	V295 Y299 L358 H359 H361 C389 A390	V295-I363 HydrophobicContact CG1-CD1 4.24Å; V295-I363 HydrophobicContact CG1-CG2 4.41Å; Y299-I363 HydrophobicContact CD1-CD1 4.01Å; Y299-I363 HydrophobicContact CD2-CD1 3.29Å; Y299-I363 HydrophobicContact CE1-CD1 4.03Å; Y299-I363 HydrophobicContact CE2-CD1 3.33Å; Y299-I363 HydrophobicContact CE2-CG1 4.33Å; Y299-I363 HydrophobicContact CG-CD1 3.65Å; L358-I363 CarbonylContact C-O 3.59Å; L358-I363 HydrophobicContact CB-CB 4.16Å; L358-I363 HydrophobicContact CD2-CB 4.27Å; L358-I363 HydrophobicContact CD2-CD1 4.04Å; L358-I363 HydrophobicContact CD2-CG2 4.13Å; L358-I363 WeakPolarHBondContact O-CB 3.18Å; L358-I363 PolarHBondContact O-N 3.28Å; H359-I363 PolarHBondContact CD2-O 3.35Å; H361-I363 HydrophobicContact CB-CD1 4.07Å; H361-I363 HydrophobicContact CB-CG1 4.23Å; H361-I363 PolarHBondContact O-N 2.83Å; I363-C389 HydrophobicContact CG2-CB 4.21Å; I363-A390 CarbonylContact C-O 3.59Å; I363-A390 WeakPolarHBondContact CA-O 3.36Å
364	I	92.8	Very high	95	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	133.6	170.1	-41.5	175.3	0	0	0	108.5	R366 C389 A390 L392 Y419 V423 D424	I364-R366 HydrophobicContact CB-CG 3.88Å; I364-R366 HydrophobicContact CG2-CG 3.4Å; I364-R366 VanDerWaalsContact CG2-CG 3.4Å; I364-C389 CarbonylContact O-C 3.58Å; I364-C389 VanDerWaalsContact O-CA 3.26Å; I364-C389 WeakPolarHBondContact O-CA 3.27Å; I364-A390 HydrophobicContact CB-CB 4.06Å; I364-A390 HydrophobicContact CG1-CB 4.41Å; I364-A390 PolarHBondContact N-O 3.47Å; I364-A390 PolarHBondContact O-N 3.13Å; I364-L392 HydrophobicContact CD1-CD1 4.02Å; I364-L392 HydrophobicContact CD1-CD2 3.79Å; I364-L392 HydrophobicContact CD1-CG 3.95Å; I364-L392 HydrophobicContact CG1-CD1 4.16Å; I364-L392 HydrophobicContact CG1-CG 4.14Å; I364-Y419 HydrophobicContact CD1-CD2 4.34Å; I364-Y419 HydrophobicContact CD1-CE2 4.23Å; I364-V423 HydrophobicContact CG2-CG2 3.6Å; I364-D424 WeakPolarHBondContact CG2-OD2 3.23Å
365	H	92.5	Very high	95	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.127	C	C	.	.			trans	-75.8	-48.3	178.2	-168.1	-57.8	0	0	0	112.5	L355 D367 I368 T384 D385 F388 D424	L355-H365 HydrophobicContact CD2-CB 4.46Å; H365-D367 VanDerWaalsContact C-N 3.27Å; H365-D367 PolarHBondContact ND1-N 3.11Å; H365-D367 PolarHBondContact O-N 3.2Å; H365-I368 HydrophobicContact CB-CD1 3.83Å; H365-I368 HydrophobicContact CB-CG1 4.07Å; H365-I368 VanDerWaalsContact CG-CD1 3.47Å; H365-T384 PolarHBondContact CE1-O 3.02Å; H365-T384 PolarHBondContact NE2-O 2.98Å; H365-D385 PolarHBondContact CE1-O 3.2Å; H365-F388 CarbonylContact O-C 3.53Å; H365-D424 PolarHBondContact N-OD1 3.17Å; H365-D424 PolarHBondContact N-OD2 2.97Å
366	R	91.1	Very high	94.9	Very high	12 Å²	12	23.3 Å²	23.3	5%	0.045	13%	0.13	C	C	.	.			trans	66.2	9.4	177.1	-51.9	-171	-66.9	173.6	1.1	117.2	I364 F388 C389 T401 V403 G404 Y419 D424	I364-R366 HydrophobicContact CB-CG 3.88Å; I364-R366 HydrophobicContact CG2-CG 3.4Å; I364-R366 VanDerWaalsContact CG2-CG 3.4Å; R366-F388 HydrophobicContact CB-CB 4.38Å; R366-F388 PolarHBondContact NE-O 3.43Å; R366-F388 PolarHBondContact NH2-O 3Å; R366-C389 PolarHBondContact NH2-O 3.3Å; R366-T401 PolarHBondContact NH1-OG1 3.1Å; R366-V403 HydrophobicContact CB-CG2 4.02Å; R366-V403 HydrophobicContact CG-CG2 4.5Å; R366-G404 WeakPolarHBondContact O-CA 3.38Å; R366-Y419 WeakPolarHBondContact CD-OH 3.24Å; R366-Y419 HydrophobicContact CG-CE2 4.42Å; R366-Y419 PolarHBondContact NH1-OH 3.49Å; R366-D424 WeakPolarHBondContact CA-OD1 3.47Å; R366-D424 PolarHBondContact N-OD1 3.42Å
367	D	91.3	Very high	94.8	Very high	4 Å²	4	23.3 Å²	23.3	2%	0.021	13%	0.129	C	C	.	.			trans	-151	46.1	175.9	-157.9	39.6	0	0	0	111.3	H365 K369 N372 F388 T405	H365-D367 VanDerWaalsContact C-N 3.27Å; H365-D367 PolarHBondContact ND1-N 3.11Å; H365-D367 PolarHBondContact O-N 3.2Å; D367-K369 PolarHBondContact O-N 2.78Å; D367-K369 IonicContact OD1-NZ 2.69Å; D367-K369 PolarHBondContact OD1-NZ 3.11Å; D367-K369 WeakPolarHBondContact OD2-CE 3.26Å; D367-K369 IonicContact OD2-NZ 2.75Å; D367-K369 PolarHBondContact OD2-NZ 3.01Å; D367-N372 PolarHBondContact O-ND2 2.72Å; D367-N372 PolarHBondContact OD2-ND2 2.88Å; D367-F388 HydrophobicContact CB-CB 4.29Å; D367-F388 HydrophobicContact CB-CD2 3.64Å; D367-F388 HydrophobicContact CB-CE2 4.44Å; D367-F388 HydrophobicContact CB-CG 4.33Å; D367-T405 WeakPolarHBondContact OD1-CB 3.4Å; D367-T405 PolarHBondContact OD1-N 3.23Å; D367-T405 PolarHBondContact OD1-OG1 2.83Å
368	I	96.7	Very high	94.7	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.01	15%	0.149	C	C	.	.			trans	-74.1	123.4	174.3	-61	-62.4	0	0	0	109.3	L355 H365 L383 D424 S427 L428 M431	L355-I368 HydrophobicContact CD2-CD1 3.83Å; L355-I368 HydrophobicContact CD2-CG1 4.08Å; H365-I368 HydrophobicContact CB-CD1 3.83Å; H365-I368 HydrophobicContact CB-CG1 4.07Å; H365-I368 VanDerWaalsContact CG-CD1 3.47Å; I368-L383 HydrophobicContact CD1-CD1 3.82Å; I368-L383 HydrophobicContact CD1-CD2 4.3Å; I368-D424 HydrophobicContact CG1-CB 4.14Å; I368-S427 WeakPolarHBondContact O-CB 3.34Å; I368-L428 HydrophobicContact CG2-CB 4.44Å; I368-L428 HydrophobicContact CG2-CD1 4.5Å; I368-M431 HydrophobicContact CG2-SD 4.2Å
369	K	95.5	Very high	94.8	Very high	24 Å²	24	26.6 Å²	26.6	10%	0.104	15%	0.149	C	C	.	.	S	Bend	trans	-169.1	165.2	179.9	57.3	-174.5	170.9	-167.8	0	108.9	D367 D371 N372 T405 W408	D367-K369 PolarHBondContact O-N 2.78Å; D367-K369 IonicContact OD1-NZ 2.69Å; D367-K369 PolarHBondContact OD1-NZ 3.11Å; D367-K369 WeakPolarHBondContact OD2-CE 3.26Å; D367-K369 IonicContact OD2-NZ 2.75Å; D367-K369 PolarHBondContact OD2-NZ 3.01Å; K369-D371 HydrophobicContact CD-CB 4.23Å; K369-D371 HydrophobicContact CG-CB 4.18Å; K369-D371 PolarHBondContact O-N 3.46Å; K369-N372 VanDerWaalsContact CE-ND2 3.27Å; K369-N372 WeakPolarHBondContact CE-ND2 3.34Å; K369-N372 HydrophobicContact CG-CB 4.31Å; K369-N372 PolarHBondContact O-N 3.37Å; K369-T405 PolarHBondContact NZ-OG1 3.44Å; K369-W408 HydrophobicContact CB-CD2 3.77Å; K369-W408 VanDerWaalsContact CB-CE2 3.47Å; K369-W408 HydrophobicContact CB-CE3 4.41Å; K369-W408 HydrophobicContact CB-CG 3.99Å; K369-W408 HydrophobicContact CB-CH2 4.48Å; K369-W408 HydrophobicContact CB-CZ2 3.87Å
370	S	96.3	Very high	94.9	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-59.2	-29.8	-178	72	0	0	0	0	114	L330 T331 N372 V373 E434	L330-S370 WeakPolarHBondContact CB-O 3.44Å; L330-S370 PolarHBondContact N-O 3.43Å; T331-S370 WeakPolarHBondContact CA-OG 3.36Å; T331-S370 WeakPolarHBondContact CB-OG 3.24Å; T331-S370 VanDerWaalsContact OG1-C 3.28Å; T331-S370 PolarHBondContact OG1-OG 3.01Å; S370-N372 PolarHBondContact O-N 3Å; S370-V373 PolarHBondContact O-N 3.32Å; S370-E434 VanDerWaalsContact CB-CD 3.44Å; S370-E434 WeakPolarHBondContact CB-OE1 3.17Å; S370-E434 VanDerWaalsContact CB-OE2 3.26Å; S370-E434 WeakPolarHBondContact CB-OE2 3.19Å; S370-E434 PolarHBondContact N-OE2 3.01Å; S370-E434 PolarHBondContact OG-OE1 3.43Å; S370-E434 PolarHBondContact OG-OE2 3.49Å
371	D	92.7	Very high	95	Very high	68 Å²	68	23.3 Å²	23.3	36%	0.364	13%	0.127	S	C	.	.	G	3₁₀ helix	trans	-62.8	-29.6	176.9	-58.2	-70.2	0	0	0	112.8	T331 K369	T331-D371 WeakPolarHBondContact OG1-CA 3.47Å; T331-D371 VanDerWaalsContact OG1-CG 3.29Å; T331-D371 PolarHBondContact OG1-N 3.25Å; T331-D371 PolarHBondContact OG1-OD1 3.31Å; K369-D371 HydrophobicContact CD-CB 4.23Å; K369-D371 HydrophobicContact CG-CB 4.18Å; K369-D371 PolarHBondContact O-N 3.46Å
372	N	95	Very high	95.3	Very high	11 Å²	11	21.3 Å²	21.3	6%	0.059	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-99.1	14.9	-177.3	-70.2	-10.9	0	0	0	112.5	D367 K369 S370 L383 T384	D367-N372 PolarHBondContact O-ND2 2.72Å; D367-N372 PolarHBondContact OD2-ND2 2.88Å; K369-N372 VanDerWaalsContact CE-ND2 3.27Å; K369-N372 WeakPolarHBondContact CE-ND2 3.34Å; K369-N372 HydrophobicContact CG-CB 4.31Å; K369-N372 PolarHBondContact O-N 3.37Å; S370-N372 PolarHBondContact O-N 3Å; N372-L383 WeakPolarHBondContact O-CA 3.47Å; N372-T384 HydrophobicContact CB-CG2 4.43Å; N372-T384 PolarHBondContact O-N 2.98Å
373	V	97.4	Very high	95.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	114.8	169.5	-174.8	0	0	0	0	108.7	C329 L330 S370 V381 L383 M431	C329-V373 CarbonylContact C-O 3.44Å; C329-V373 VanDerWaalsContact CA-O 3.25Å; C329-V373 WeakPolarHBondContact CA-O 3.28Å; L330-V373 HydrophobicContact CB-CB 3.88Å; L330-V373 HydrophobicContact CB-CG1 4.21Å; L330-V373 HydrophobicContact CD2-CB 4.16Å; L330-V373 HydrophobicContact CD2-CG1 4.25Å; L330-V373 HydrophobicContact CD2-CG2 4.36Å; L330-V373 PolarHBondContact N-O 2.89Å; S370-V373 PolarHBondContact O-N 3.32Å; V373-V381 HydrophobicContact CG1-CG1 3.49Å; V373-V381 VanDerWaalsContact CG1-CG1 3.49Å; V373-L383 HydrophobicContact CG2-CD2 3.77Å; V373-M431 HydrophobicContact CG2-CE 4.21Å; V373-M431 HydrophobicContact CG2-SD 3.53Å; V373-M431 VanDerWaalsContact CG2-SD 3.53Å
374	L	97.4	Very high	95.5	Very high	34 Å²	34	19.6 Å²	19.6	18%	0.178	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	147.3	177.8	-60.6	-170.3	0	0	0	111.8	V305 L325 G328 C329 K382 T384	V305-L374 HydrophobicContact CG2-CD1 4.01Å; V305-L374 HydrophobicContact CG2-CG 4.45Å; L325-L374 HydrophobicContact CB-CB 3.91Å; L325-L374 HydrophobicContact CB-CD1 4.33Å; L325-L374 HydrophobicContact CD1-CB 3.86Å; L325-L374 HydrophobicContact CD1-CD1 3.91Å; L325-L374 HydrophobicContact CD2-CB 4.33Å; L325-L374 HydrophobicContact CG-CB 4.25Å; G328-L374 WeakPolarHBondContact O-CA 3.31Å; C329-L374 HydrophobicContact CB-CD2 3.91Å; L374-K382 PolarHBondContact N-O 3.47Å; L374-K382 PolarHBondContact O-N 3.01Å; L374-T384 HydrophobicContact CD1-CG2 4.08Å; L374-T384 HydrophobicContact CD2-CG2 4.29Å; L374-T384 HydrophobicContact CG-CG2 3.79Å
375	L	98	Very high	95	Very high	2 Å²	2	21 Å²	21	1%	0.01	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	137.8	-176.9	-57.9	176.2	0	0	0	111.5	L325 G327 G328 L330 V333 S380 V381 I512	L325-L375 WeakPolarHBondContact CB-O 3.45Å; G327-L375 CarbonylContact C-O 3.46Å; G327-L375 WeakPolarHBondContact CA-O 3.47Å; G327-L375 PolarHBondContact N-O 3.24Å; G328-L375 PolarHBondContact O-N 3.44Å; L330-L375 HydrophobicContact CD1-CD1 4.24Å; V333-L375 HydrophobicContact CB-CD1 4.48Å; V333-L375 HydrophobicContact CG2-CD1 3.63Å; L375-S380 CarbonylContact C-O 3.6Å; L375-S380 VanDerWaalsContact CA-O 3.24Å; L375-S380 WeakPolarHBondContact CA-O 2.98Å; L375-V381 HydrophobicContact CD2-CB 4.36Å; L375-V381 HydrophobicContact CD2-CG1 4.34Å; L375-V381 HydrophobicContact CD2-CG2 3.81Å; L375-I512 HydrophobicContact CB-CD1 3.96Å; L375-I512 HydrophobicContact CB-CG1 4.39Å; L375-I512 HydrophobicContact CD1-CD1 4.1Å; L375-I512 HydrophobicContact CD1-CG1 3.9Å
376	G	97	Very high	94.3	Very high	6 Å²	6	21.1 Å²	21.1	6%	0.062	11%	0.113	C	C	.	.			trans	-89	160.3	168.1	0	0	0	0	0	112.3	D378 G379 S380 I512	G376-D378 PolarHBondContact O-N 2.97Å; G376-G379 PolarHBondContact O-N 2.64Å; G376-S380 WeakPolarHBondContact CA-OG 3.34Å; G376-S380 PolarHBondContact N-O 3.33Å; G376-S380 PolarHBondContact N-OG 3.39Å; G376-I512 WeakPolarHBondContact O-CD1 3.38Å
377	L	95.9	Very high	93.1	Very high	58 Å²	58	20.9 Å²	20.9	30%	0.304	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-16.2	175.5	-72.6	-175.1	0	0	0	114	E326 G379 V509 I512 K516	E326-L377 HydrophobicContact CB-CD1 3.98Å; E326-L377 HydrophobicContact CB-CD2 4.39Å; E326-L377 HydrophobicContact CB-CG 3.68Å; E326-L377 WeakPolarHBondContact OE2-CD1 3.38Å; L377-G379 VanDerWaalsContact C-N 3.31Å; L377-V509 WeakPolarHBondContact O-CG2 3.31Å; L377-I512 HydrophobicContact CD2-CG2 4.06Å; L377-K516 HydrophobicContact CD2-CD 4.11Å
378	D	96	Very high	91.8	Very high	111 Å²	111	23 Å²	23	59%	0.594	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-4.8	172.3	66	-21.2	0	0	0	113.1	G376 S380 V509	G376-D378 PolarHBondContact O-N 2.97Å; D378-S380 VanDerWaalsContact OD1-CB 3.28Å; D378-S380 WeakPolarHBondContact OD1-CB 3.47Å; D378-S380 PolarHBondContact OD1-N 3.44Å; D378-S380 PolarHBondContact OD1-OG 3.3Å; D378-V509 VanDerWaalsContact C-CG2 3.5Å
379	G	96.9	Very high	90.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.122	C	C	.	.			trans	90.5	5	-175.7	0	0	0	0	0	114.1	G376 L377 L505	G376-G379 PolarHBondContact O-N 2.64Å; L377-G379 VanDerWaalsContact C-N 3.31Å; G379-L505 WeakPolarHBondContact O-CB 3.5Å
380	S	97.8	Very high	89.4	Confident	25 Å²	25	21.8 Å²	21.8	18%	0.175	12%	0.117	C	C	.	.			trans	-57.7	144.1	174.5	54	0	0	0	0	111.7	L375 G376 D378	L375-S380 CarbonylContact C-O 3.6Å; L375-S380 VanDerWaalsContact CA-O 3.24Å; L375-S380 WeakPolarHBondContact CA-O 2.98Å; G376-S380 WeakPolarHBondContact CA-OG 3.34Å; G376-S380 PolarHBondContact N-O 3.33Å; G376-S380 PolarHBondContact N-OG 3.39Å; D378-S380 VanDerWaalsContact OD1-CB 3.28Å; D378-S380 WeakPolarHBondContact OD1-CB 3.47Å; D378-S380 PolarHBondContact OD1-N 3.44Å; D378-S380 PolarHBondContact OD1-OG 3.3Å
381	V	98.5	Very high	88.1	Confident	2 Å²	2	25.8 Å²	25.8	1%	0.012	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	123.7	-177.3	-177.3	0	0	0	0	108.8	N303 V347 E350 V373 L375 L505 L508	N303-V381 PolarHBondContact ND2-O 2.9Å; N303-V381 VanDerWaalsContact ND2-O 3.08Å; V347-V381 HydrophobicContact CG1-CG1 4.13Å; V347-V381 HydrophobicContact CG2-CG2 4.46Å; E350-V381 HydrophobicContact CB-CB 3.73Å; E350-V381 HydrophobicContact CB-CG1 4.06Å; E350-V381 HydrophobicContact CB-CG2 4.46Å; E350-V381 HydrophobicContact CG-CB 4.09Å; E350-V381 HydrophobicContact CG-CG2 4.41Å; V373-V381 HydrophobicContact CG1-CG1 3.49Å; V373-V381 VanDerWaalsContact CG1-CG1 3.49Å; L375-V381 HydrophobicContact CD2-CB 4.36Å; L375-V381 HydrophobicContact CD2-CG1 4.34Å; L375-V381 HydrophobicContact CD2-CG2 3.81Å; V381-L505 HydrophobicContact CG2-CD2 3.95Å; V381-L508 HydrophobicContact CG2-CD1 3.96Å
382	K	98.2	Very high	86.9	Confident	33 Å²	33	23.2 Å²	23.2	14%	0.143	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	136.3	-176.6	-57.8	-168.3	-178.9	-176.4	0	112.6	K302 N303 V305 E323 L325 L374	K302-K382 VanDerWaalsContact O-CE 3.27Å; K302-K382 WeakPolarHBondContact O-CE 3.41Å; N303-K382 CarbonylContact O-C 3.42Å; N303-K382 VanDerWaalsContact O-CA 3.32Å; N303-K382 WeakPolarHBondContact O-CA 3.46Å; V305-K382 HydrophobicContact CG2-CB 3.91Å; E323-K382 WeakPolarHBondContact OE1-CD 3.45Å; E323-K382 IonicContact OE1-NZ 2.68Å; E323-K382 PolarHBondContact OE1-NZ 3.46Å; E323-K382 IonicContact OE2-NZ 3.81Å; E323-K382 PolarHBondContact OE2-NZ 2.97Å; L325-K382 HydrophobicContact CD1-CB 4.5Å; L325-K382 HydrophobicContact CD1-CD 4.23Å; L325-K382 HydrophobicContact CD2-CB 4.38Å; L325-K382 HydrophobicContact CD2-CD 3.99Å; L325-K382 HydrophobicContact CD2-CG 4.1Å; L374-K382 PolarHBondContact N-O 3.47Å; L374-K382 PolarHBondContact O-N 3.01Å
383	L	97	Very high	85.4	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	142.9	171.7	-60.5	-174.9	0	0	0	111.4	N303 L304 V305 C351 A354 L355 I368 N372 V373	N303-L383 PolarHBondContact O-N 3.12Å; L304-L383 HydrophobicContact CD2-CB 4.02Å; V305-L383 WeakPolarHBondContact CG2-O 3.41Å; V305-L383 PolarHBondContact N-O 3.26Å; C351-L383 HydrophobicContact CB-CD2 4.3Å; A354-L383 HydrophobicContact CB-CD1 3.54Å; A354-L383 HydrophobicContact CB-CG 3.86Å; L355-L383 HydrophobicContact CD2-CD1 4.15Å; L355-L383 HydrophobicContact CG-CD1 4.21Å; I368-L383 HydrophobicContact CD1-CD1 3.82Å; I368-L383 HydrophobicContact CD1-CD2 4.3Å; N372-L383 WeakPolarHBondContact O-CA 3.47Å; V373-L383 HydrophobicContact CG2-CD2 3.77Å
384	T	92.3	Very high	83.6	Confident	18 Å²	18	33.3 Å²	33.3	11%	0.11	18%	0.183	C	C	.	.			trans	-134.8	179.6	178.1	-163.8	0	0	0	0	111.9	H365 N372 L374	H365-T384 PolarHBondContact CE1-O 3.02Å; H365-T384 PolarHBondContact NE2-O 2.98Å; N372-T384 HydrophobicContact CB-CG2 4.43Å; N372-T384 PolarHBondContact O-N 2.98Å; L374-T384 HydrophobicContact CD1-CG2 4.08Å; L374-T384 HydrophobicContact CD2-CG2 4.29Å; L374-T384 HydrophobicContact CG-CG2 3.79Å
385	D	81.7	Confident	81.8	Confident	29 Å²	29	40.7 Å²	40.7	16%	0.155	22%	0.217	C	C	.	.			trans	63.2	63.5	174.2	-154.2	18.5	0	0	0	115.1	K276 H365 G387	K276-D385 IonicContact NZ-OD1 3.38Å; K276-D385 PolarHBondContact NZ-OD1 3.02Å; H365-D385 PolarHBondContact CE1-O 3.2Å; D385-G387 PolarHBondContact O-N 2.89Å; D385-G387 VanDerWaalsContact O-N 3.1Å
386	F	77.5	Confident	79.9	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.018	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-75	12.6	174.9	-52.4	-83.9	0	0	0	113.4	E292 V295 M296 L304 L358 F388 C389	E292-F386 HydrophobicContact CG-CB 4.48Å; V295-F386 HydrophobicContact CG1-CB 4.38Å; V295-F386 HydrophobicContact CG1-CD1 4.26Å; V295-F386 HydrophobicContact CG1-CG 4.38Å; M296-F386 HydrophobicContact CE-CD2 4.43Å; M296-F386 HydrophobicContact CG-CB 4.26Å; M296-F386 HydrophobicContact CG-CD2 3.46Å; M296-F386 VanDerWaalsContact CG-CD2 3.46Å; M296-F386 HydrophobicContact CG-CE2 4.15Å; M296-F386 HydrophobicContact CG-CG 4.12Å; M296-F386 HydrophobicContact SD-CD2 3.93Å; L304-F386 HydrophobicContact CB-CZ 4.06Å; L304-F386 HydrophobicContact CD1-CE1 4.47Å; L304-F386 HydrophobicContact CD1-CZ 4.33Å; L304-F386 HydrophobicContact CD2-CE1 3.92Å; L304-F386 HydrophobicContact CD2-CZ 3.75Å; L304-F386 HydrophobicContact CG-CZ 4.24Å; L358-F386 HydrophobicContact CD1-CE1 4.08Å; L358-F386 HydrophobicContact CD2-CE1 4.4Å; F386-F388 PolarHBondContact O-N 3.19Å; F386-F388 VanDerWaalsContact O-N 3.13Å; F386-C389 HydrophobicContact CB-CB 4.2Å; F386-C389 VanDerWaalsContact CB-SG 3.55Å; F386-C389 VanDerWaalsContact CD1-SG 3.54Å; F386-C389 WeakPolarHBondContact O-CB 3.5Å; F386-C389 PolarHBondContact O-N 2.73Å
387	G	65	Low	78	Confident	6 Å²	6	49.7 Å²	49.7	6%	0.062	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-62.7	-17.9	-179.9	0	0	0	0	0	113.9	M288 E292 D385	M288-G387 WeakPolarHBondContact CE-O 3.23Å; E292-G387 WeakPolarHBondContact OE2-CA 3.26Å; D385-G387 PolarHBondContact O-N 2.89Å; D385-G387 VanDerWaalsContact O-N 3.1Å
388	F	65	Low	76.2	Confident	49 Å²	49	52.2 Å²	52.2	22%	0.215	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-102.9	7.1	171.3	-63.2	-66.5	0	0	0	113.5	H365 R366 D367 F386 V403	H365-F388 CarbonylContact O-C 3.53Å; R366-F388 HydrophobicContact CB-CB 4.38Å; R366-F388 PolarHBondContact NE-O 3.43Å; R366-F388 PolarHBondContact NH2-O 3Å; D367-F388 HydrophobicContact CB-CB 4.29Å; D367-F388 HydrophobicContact CB-CD2 3.64Å; D367-F388 HydrophobicContact CB-CE2 4.44Å; D367-F388 HydrophobicContact CB-CG 4.33Å; F386-F388 PolarHBondContact O-N 3.19Å; F386-F388 VanDerWaalsContact O-N 3.13Å; F388-V403 HydrophobicContact CD1-CB 4Å; F388-V403 HydrophobicContact CD1-CG1 4.33Å
389	C	73.3	Confident	74.3	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.252	C	S	.	.			trans	-62	156.9	-175.9	-83.7	0	0	0	0	114.1	V295 I363 I364 R366 F386	V295-C389 HydrophobicContact CG2-CB 4.37Å; I363-C389 HydrophobicContact CG2-CB 4.21Å; I364-C389 CarbonylContact O-C 3.58Å; I364-C389 VanDerWaalsContact O-CA 3.26Å; I364-C389 WeakPolarHBondContact O-CA 3.27Å; R366-C389 PolarHBondContact NH2-O 3.3Å; F386-C389 HydrophobicContact CB-CB 4.2Å; F386-C389 VanDerWaalsContact CB-SG 3.55Å; F386-C389 VanDerWaalsContact CD1-SG 3.54Å; F386-C389 WeakPolarHBondContact O-CB 3.5Å; F386-C389 PolarHBondContact O-N 2.73Å
390	A	68.3	Low	71.9	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	110.2	-174.1	0	0	0	0	0	109.9	I363 I364 R399	I363-A390 CarbonylContact C-O 3.59Å; I363-A390 WeakPolarHBondContact CA-O 3.36Å; I364-A390 HydrophobicContact CB-CB 4.06Å; I364-A390 HydrophobicContact CG1-CB 4.41Å; I364-A390 PolarHBondContact N-O 3.47Å; I364-A390 PolarHBondContact O-N 3.13Å; A390-R399 VanDerWaalsContact CA-NH2 3.32Å; A390-R399 VanDerWaalsContact CB-NE 3.29Å
391	Q	69	Low	70.1	Confident	84 Å²	84	55.6 Å²	55.6	39%	0.393	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	124.8	164.5	-164.6	164.4	27.7	0	0	109.3	Y299 S362 R399	Y299-Q391 PolarHBondContact OH-NE2 2.8Å; S362-Q391 CarbonylContact O-C 3.53Å; S362-Q391 WeakPolarHBondContact O-CA 3.3Å; Q391-R399 PolarHBondContact O-NH2 3.3Å
392	L	67.9	Low	68.1	Low	14 Å²	14	56.6 Å²	56.6	7%	0.073	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-78.3	132.4	170.1	-64.2	171.4	0	0	0	108.4	S362 I364 S397 R399	S362-L392 PolarHBondContact O-N 2.9Å; I364-L392 HydrophobicContact CD1-CD1 4.02Å; I364-L392 HydrophobicContact CD1-CD2 3.79Å; I364-L392 HydrophobicContact CD1-CG 3.95Å; I364-L392 HydrophobicContact CG1-CD1 4.16Å; I364-L392 HydrophobicContact CG1-CG 4.14Å; L392-S397 WeakPolarHBondContact CD1-O 3.43Å; L392-R399 HydrophobicContact CD2-CG 3.99Å
393	N	63.1	Low	66.4	Low	95 Å²	95	55.7 Å²	55.7	51%	0.508	29%	0.289	S	S	.	.	B	Isolated β-bridge	trans	-80.9	143.5	171.1	-69.2	-13.1	0	0	0	108.1	E395 R396 S397	N393-E395 PolarHBondContact O-N 3.19Å; N393-E395 VanDerWaalsContact O-N 3.08Å; N393-R396 HydrophobicContact CB-CB 4.41Å; N393-R396 CarbonylContact O-C 3.39Å; N393-R396 WeakPolarHBondContact O-CA 3.37Å; N393-R396 PolarHBondContact O-N 3.43Å; N393-R396 VanDerWaalsContact O-O 3.08Å; N393-S397 PolarHBondContact O-N 3.4Å
394	P	59.9	Low	64.7	Low	128 Å²	128	56.2 Å²	56.2	83%	0.831	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-29.9	175.2	-26.2	34.3	0	0	0	113.5
395	E	58.8	Low	64.1	Low	189 Å²	189	57 Å²	57	88%	0.883	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-21	176.1	-61.6	179.9	178.8	0	0	113.6	N393	N393-E395 PolarHBondContact O-N 3.19Å; N393-E395 VanDerWaalsContact O-N 3.08Å
396	R	58	Low	64.4	Low	127 Å²	127	56.6 Å²	56.6	48%	0.479	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-132.7	77.5	179.6	-69.5	-173.1	178.5	-163.5	-3.6	109.3	N393 K398	N393-R396 HydrophobicContact CB-CB 4.41Å; N393-R396 CarbonylContact O-C 3.39Å; N393-R396 WeakPolarHBondContact O-CA 3.37Å; N393-R396 PolarHBondContact O-N 3.43Å; N393-R396 VanDerWaalsContact O-O 3.08Å; R396-K398 PolarHBondContact O-N 3.06Å; R396-K398 VanDerWaalsContact O-N 3.15Å
397	S	57.6	Low	65.1	Low	71 Å²	71	57.8 Å²	57.8	50%	0.497	30%	0.303	S	S	.	.			trans	-72.9	1.7	-178.4	-45.8	0	0	0	0	114.6	L392 N393	L392-S397 WeakPolarHBondContact CD1-O 3.43Å; N393-S397 PolarHBondContact O-N 3.4Å
398	K	57.8	Low	66.6	Low	111 Å²	111	58.2 Å²	58.2	48%	0.483	30%	0.303	S	S	.	.			trans	-134.8	152.9	177.4	-55.9	-175.7	178.9	-176	0	111.2	R396 Q418 Y419	R396-K398 PolarHBondContact O-N 3.06Å; R396-K398 VanDerWaalsContact O-N 3.15Å; K398-Q418 HydrophobicContact CB-CB 3.77Å; K398-Q418 HydrophobicContact CB-CG 4.45Å; K398-Q418 HydrophobicContact CD-CB 3.8Å; K398-Q418 HydrophobicContact CG-CB 4.41Å; K398-Y419 CarbonylContact C-O 3.5Å; K398-Y419 VanDerWaalsContact CA-O 3.25Å; K398-Y419 WeakPolarHBondContact CA-O 3.09Å
399	R	56.3	Low	67.9	Low	67 Å²	67	56.2 Å²	56.2	25%	0.253	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-119	153.3	174.9	-72.8	-166.6	176.4	-158.3	0.9	111.4	A390 Q391 L392 Q418 Y419	A390-R399 VanDerWaalsContact CA-NH2 3.32Å; A390-R399 VanDerWaalsContact CB-NE 3.29Å; Q391-R399 PolarHBondContact O-NH2 3.3Å; L392-R399 HydrophobicContact CD2-CG 3.99Å; R399-Q418 CarbonylContact O-C 2.99Å; R399-Q418 VanDerWaalsContact O-CA 3.31Å; R399-Q418 WeakPolarHBondContact O-CA 3.46Å; R399-Y419 HydrophobicContact CB-CE1 4.24Å; R399-Y419 HydrophobicContact CB-CE2 3.94Å; R399-Y419 PolarHBondContact N-O 3.05Å; R399-Y419 WeakPolarHBondContact O-CD1 3.27Å; R399-Y419 WeakPolarHBondContact O-CE1 3.43Å; R399-Y419 PolarHBondContact O-N 3.45Å
400	C	47.2	Very low	68.9	Low	87 Å²	87	56.2 Å²	56.2	59%	0.588	30%	0.295	S	S	*	.			trans	-112.9	-4.2	171.9	57.6	0	0	0	0	112.9	M402	C400-M402 PolarHBondContact O-N 3.48Å
401	T	60.7	Low	70.1	Confident	53 Å²	53	56.5 Å²	56.5	33%	0.325	30%	0.296	S	S	.	.			trans	-67.9	133.7	-173.3	50.2	0	0	0	0	112.1	R366 V403 Y419	R366-T401 PolarHBondContact NH1-OG1 3.1Å; T401-V403 PolarHBondContact O-N 3.25Å; T401-Y419 VanDerWaalsContact O-CE1 3.26Å; T401-Y419 WeakPolarHBondContact O-CE1 3.4Å; T401-Y419 PolarHBondContact O-OH 3.47Å; T401-Y419 PolarHBondContact OG1-OH 3.09Å
402	M	55.7	Low	71.2	Confident	23 Å²	23	53 Å²	53	11%	0.113	28%	0.28	C	S	.	.			trans	-93	93.8	-172.6	-176.4	-177.5	-85.2	0	0	111.8	F82 A85 R89 C400 R416	F82-M402 WeakPolarHBondContact CA-SD 3.37Å; F82-M402 HydrophobicContact CB-CE 3.84Å; F82-M402 HydrophobicContact CB-SD 3.63Å; F82-M402 HydrophobicContact CD2-CE 3.72Å; F82-M402 HydrophobicContact CD2-CG 3.16Å; F82-M402 HydrophobicContact CD2-SD 3.16Å; F82-M402 WeakPolarHBondContact CD2-SD 3.28Å; F82-M402 HydrophobicContact CE2-CG 3.27Å; F82-M402 HydrophobicContact CE2-SD 3.86Å; F82-M402 HydrophobicContact CG-CE 4.22Å; F82-M402 HydrophobicContact CG-CG 4.16Å; F82-M402 HydrophobicContact CG-SD 3.6Å; F82-M402 VanDerWaalsContact CG-SD 3.6Å; F82-M402 HydrophobicContact CZ-CG 4.41Å; A85-M402 HydrophobicContact CB-SD 4.2Å; R89-M402 PolarHBondContact NH1-O 2.91Å; C400-M402 PolarHBondContact O-N 3.48Å; M402-R416 HydrophobicContact CE-CG 3.48Å; M402-R416 VanDerWaalsContact CE-CG 3.48Å; M402-R416 VanDerWaalsContact CE-NH2 3.34Å
403	V	62.1	Low	72.2	Confident	13 Å²	13	52.8 Å²	52.8	8%	0.079	28%	0.279	C	S	.	.			trans	-136.6	162.6	179.2	-62.2	0	0	0	0	110.4	R366 F388 T401	R366-V403 HydrophobicContact CB-CG2 4.02Å; R366-V403 HydrophobicContact CG-CG2 4.5Å; F388-V403 HydrophobicContact CD1-CB 4Å; F388-V403 HydrophobicContact CD1-CG1 4.33Å; T401-V403 PolarHBondContact O-N 3.25Å
404	G	62.4	Low	73.3	Confident	12 Å²	12	48.2 Å²	48.2	12%	0.124	26%	0.255	C	S	.	.	S	Bend	trans	117.3	171.3	-178.1	0	0	0	0	0	113.1	R366	R366-G404 WeakPolarHBondContact O-CA 3.38Å
405	T	79.1	Confident	74.5	Confident	34 Å²	34	43.6 Å²	43.6	21%	0.209	22%	0.223	C	C	.	.			trans	-90.4	121.7	177.5	-54.8	0	0	0	0	110	D367 K369 Y407 W408 M409	D367-T405 WeakPolarHBondContact OD1-CB 3.4Å; D367-T405 PolarHBondContact OD1-N 3.23Å; D367-T405 PolarHBondContact OD1-OG1 2.83Å; K369-T405 PolarHBondContact NZ-OG1 3.44Å; T405-Y407 VanDerWaalsContact C-N 3.31Å; T405-Y407 PolarHBondContact O-N 3.4Å; T405-W408 HydrophobicContact CG2-CE3 3.57Å; T405-W408 HydrophobicContact CG2-CZ3 3.49Å; T405-W408 VanDerWaalsContact CG2-CZ3 3.49Å; T405-W408 PolarHBondContact O-N 3.31Å; T405-M409 WeakPolarHBondContact O-CG 3.44Å
406	P	87	Confident	75.4	Confident	21 Å²	21	39.9 Å²	39.9	14%	0.136	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-45.2	-44.1	-164.6	-34.4	36.3	0	0	0	116.9	F82 W408 M409 P447 L451 I454	F82-P406 HydrophobicContact CE1-CG 3.98Å; F82-P406 HydrophobicContact CZ-CG 4.31Å; P406-W408 VanDerWaalsContact C-N 3.31Å; P406-W408 PolarHBondContact O-N 3.23Å; P406-M409 WeakPolarHBondContact O-CB 3.3Å; P406-M409 PolarHBondContact O-N 3.23Å; P406-P447 HydrophobicContact CG-CB 4.33Å; P406-L451 HydrophobicContact CB-CD1 4.5Å; P406-L451 HydrophobicContact CB-CD2 4.02Å; P406-L451 HydrophobicContact CB-CG 4.12Å; P406-I454 WeakPolarHBondContact O-CD1 3.45Å
407	Y	93.6	Very high	76.5	Confident	30 Å²	30	41.9 Å²	41.9	12%	0.118	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-72.4	-20.3	-172.9	-46.7	-80.7	0	0	0	114.2	T405 Y442 L443 E445 A450	T405-Y407 VanDerWaalsContact C-N 3.31Å; T405-Y407 PolarHBondContact O-N 3.4Å; Y407-Y442 VanDerWaalsContact CE1-O 3.28Å; Y407-Y442 WeakPolarHBondContact CE1-O 3.34Å; Y407-L443 HydrophobicContact CD2-CD1 4.17Å; Y407-L443 HydrophobicContact CE2-CD1 4.11Å; Y407-E445 PolarHBondContact OH-O 3.47Å; Y407-A450 HydrophobicContact CD1-CB 3.64Å; Y407-A450 HydrophobicContact CE1-CB 3.5Å
408	W	95.8	Very high	77.6	Confident	14 Å²	14	44.8 Å²	44.8	5%	0.053	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-98.8	-4	177.3	-68.3	-102	0	0	0	112.7	K369 T405 P406 S427 I430 E434 P440	K369-W408 HydrophobicContact CB-CD2 3.77Å; K369-W408 VanDerWaalsContact CB-CE2 3.47Å; K369-W408 HydrophobicContact CB-CE3 4.41Å; K369-W408 HydrophobicContact CB-CG 3.99Å; K369-W408 HydrophobicContact CB-CH2 4.48Å; K369-W408 HydrophobicContact CB-CZ2 3.87Å; T405-W408 HydrophobicContact CG2-CE3 3.57Å; T405-W408 HydrophobicContact CG2-CZ3 3.49Å; T405-W408 VanDerWaalsContact CG2-CZ3 3.49Å; T405-W408 PolarHBondContact O-N 3.31Å; P406-W408 VanDerWaalsContact C-N 3.31Å; P406-W408 PolarHBondContact O-N 3.23Å; W408-S427 PolarHBondContact O-OG 3.25Å; W408-S427 VanDerWaalsContact O-OG 3.07Å; W408-I430 HydrophobicContact CB-CG2 4.38Å; W408-I430 VanDerWaalsContact CD1-CG2 3.43Å; W408-I430 HydrophobicContact CD2-CG2 4.39Å; W408-I430 HydrophobicContact CG-CB 4.28Å; W408-I430 HydrophobicContact CG-CG2 3.82Å; W408-E434 WeakPolarHBondContact CZ2-OE2 3.47Å; W408-E434 PolarHBondContact NE1-OE2 2.69Å; W408-P440 HydrophobicContact CD2-CB 4.47Å; W408-P440 HydrophobicContact CH2-CB 4.38Å; W408-P440 HydrophobicContact CH2-CG 3.61Å; W408-P440 HydrophobicContact CZ2-CB 3.94Å; W408-P440 HydrophobicContact CZ2-CG 3.59Å; W408-P440 HydrophobicContact CZ3-CG 4.13Å
409	M	92.5	Very high	78.8	Confident	7 Å²	7	39.8 Å²	39.8	3%	0.034	19%	0.192	C	C	.	.			trans	-70.1	138.4	-174	-71.1	-178.3	71.2	0	0	112.6	F82 T405 P406 V413 V414 W426 L451	F82-M409 HydrophobicContact CD2-CE 3.87Å; F82-M409 HydrophobicContact CD2-SD 4.16Å; F82-M409 HydrophobicContact CE1-SD 4.41Å; F82-M409 HydrophobicContact CE2-CE 3.2Å; F82-M409 HydrophobicContact CE2-SD 3.24Å; F82-M409 WeakPolarHBondContact CE2-SD 3.49Å; F82-M409 HydrophobicContact CZ-CE 3.98Å; F82-M409 HydrophobicContact CZ-SD 3.36Å; F82-M409 WeakPolarHBondContact CZ-SD 3.42Å; T405-M409 WeakPolarHBondContact O-CG 3.44Å; P406-M409 WeakPolarHBondContact O-CB 3.3Å; P406-M409 PolarHBondContact O-N 3.23Å; M409-V413 HydrophobicContact CE-CB 3.83Å; M409-V413 HydrophobicContact CE-CG1 3.23Å; M409-V414 HydrophobicContact CB-CG2 3.9Å; M409-V414 HydrophobicContact CE-CG2 4.26Å; M409-W426 PolarHBondContact O-NE1 3.3Å; M409-L451 HydrophobicContact SD-CD2 4.02Å
410	A	94.3	Very high	80.4	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.008	19%	0.188	C	C	.	.			trans	-70.8	147.5	173.3	0	0	0	0	0	111.8	E412 V413 V414 V423 W426	A410-E412 VanDerWaalsContact CB-CD 3.45Å; A410-E412 HydrophobicContact CB-CG 4.46Å; A410-E412 WeakPolarHBondContact CB-OE1 3.46Å; A410-E412 VanDerWaalsContact CB-OE2 3.3Å; A410-E412 WeakPolarHBondContact CB-OE2 3.43Å; A410-E412 PolarHBondContact O-N 2.94Å; A410-V413 HydrophobicContact CB-CG2 4.18Å; A410-V413 WeakPolarHBondContact O-CB 3.3Å; A410-V413 PolarHBondContact O-N 3.46Å; A410-V414 PolarHBondContact O-N 2.82Å; A410-V423 HydrophobicContact CB-CB 4.26Å; A410-V423 HydrophobicContact CB-CG1 4.19Å; A410-W426 VanDerWaalsContact CA-CD1 3.46Å; A410-W426 HydrophobicContact CB-CB 3.68Å; A410-W426 HydrophobicContact CB-CD2 4.1Å; A410-W426 HydrophobicContact CB-CG 3.59Å
411	P	93.3	Very high	82.6	Confident	6 Å²	6	37.2 Å²	37.2	4%	0.039	17%	0.173	C	C	.	.	H	α-helix	trans	-57.6	-34.7	-177.1	-24.8	33.7	0	0	0	113	V413 V414 N415 W426 I454	P411-V413 VanDerWaalsContact C-N 3.31Å; P411-V413 PolarHBondContact O-N 2.85Å; P411-V414 PolarHBondContact O-N 2.75Å; P411-N415 WeakPolarHBondContact O-CB 3.35Å; P411-N415 VanDerWaalsContact O-CG 3.3Å; P411-N415 PolarHBondContact O-N 3.19Å; P411-N415 PolarHBondContact O-ND2 3.07Å; P411-W426 VanDerWaalsContact CD-CZ2 3.48Å; P411-W426 HydrophobicContact CG-CE3 4.42Å; P411-W426 HydrophobicContact CG-CH2 3.44Å; P411-W426 VanDerWaalsContact CG-CH2 3.44Å; P411-W426 HydrophobicContact CG-CZ2 3.65Å; P411-W426 HydrophobicContact CG-CZ3 3.85Å; P411-I454 HydrophobicContact CB-CG2 4.48Å; P411-I454 HydrophobicContact CG-CG2 4.22Å
412	E	92.3	Very high	84.4	Confident	9 Å²	9	35.6 Å²	35.6	4%	0.042	16%	0.162	C	C	.	.	H	α-helix	trans	-67.1	-30.3	177.1	68.1	-85.2	-162.9	0	0	113.1	A410 R416 R417 V423 V484 R487	A410-E412 VanDerWaalsContact CB-CD 3.45Å; A410-E412 HydrophobicContact CB-CG 4.46Å; A410-E412 WeakPolarHBondContact CB-OE1 3.46Å; A410-E412 VanDerWaalsContact CB-OE2 3.3Å; A410-E412 WeakPolarHBondContact CB-OE2 3.43Å; A410-E412 PolarHBondContact O-N 2.94Å; E412-R416 PolarHBondContact O-N 2.92Å; E412-R417 HydrophobicContact CB-CB 4.21Å; E412-R417 PolarHBondContact O-N 3.26Å; E412-V423 HydrophobicContact CG-CG1 4.3Å; E412-V423 WeakPolarHBondContact OE1-CG1 3.44Å; E412-V484 HydrophobicContact CB-CG2 4.23Å; E412-V484 HydrophobicContact CG-CG2 3.94Å; E412-R487 IonicContact OE1-CZ 3.42Å; E412-R487 IonicContact OE1-NH1 2.54Å; E412-R487 PolarHBondContact OE1-NH1 3.12Å; E412-R487 IonicContact OE1-NH2 3.69Å; E412-R487 PolarHBondContact OE1-NH2 2.8Å; E412-R487 IonicContact OE2-CZ 3.34Å; E412-R487 IonicContact OE2-NH1 3.76Å; E412-R487 IonicContact OE2-NH2 2.64Å; E412-R487 PolarHBondContact OE2-NH2 3.22Å
413	V	88.8	Confident	86.3	Confident	10 Å²	10	34.8 Å²	34.8	6%	0.061	16%	0.158	C	C	.	.	H	α-helix	trans	-73.1	-43.6	174.8	-171.1	0	0	0	0	109.8	M409 A410 P411 N415 R416 Y419 V423	M409-V413 HydrophobicContact CE-CB 3.83Å; M409-V413 HydrophobicContact CE-CG1 3.23Å; A410-V413 HydrophobicContact CB-CG2 4.18Å; A410-V413 WeakPolarHBondContact O-CB 3.3Å; A410-V413 PolarHBondContact O-N 3.46Å; P411-V413 VanDerWaalsContact C-N 3.31Å; P411-V413 PolarHBondContact O-N 2.85Å; V413-N415 VanDerWaalsContact C-N 3.32Å; V413-N415 PolarHBondContact O-N 2.75Å; V413-R416 PolarHBondContact O-N 2.68Å; V413-Y419 HydrophobicContact CB-CD1 4.47Å; V413-Y419 HydrophobicContact CG1-CD1 4.35Å; V413-Y419 HydrophobicContact CG1-CE1 4.12Å; V413-Y419 HydrophobicContact CG2-CD1 3.93Å; V413-Y419 HydrophobicContact CG2-CD2 4.48Å; V413-Y419 HydrophobicContact CG2-CE1 4.35Å; V413-Y419 HydrophobicContact CG2-CG 4.01Å; V413-V423 HydrophobicContact CG2-CB 4.05Å; V413-V423 HydrophobicContact CG2-CG1 3.43Å; V413-V423 VanDerWaalsContact CG2-CG1 3.43Å
414	V	87.1	Confident	88	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.2	-41.5	176.7	-177.3	0	0	0	0	110.7	M409 A410 P411 R416 L451 I454 A455	M409-V414 HydrophobicContact CB-CG2 3.9Å; M409-V414 HydrophobicContact CE-CG2 4.26Å; A410-V414 PolarHBondContact O-N 2.82Å; P411-V414 PolarHBondContact O-N 2.75Å; V414-R416 PolarHBondContact O-N 3.21Å; V414-R416 VanDerWaalsContact O-N 3.16Å; V414-L451 HydrophobicContact CG1-CB 4.14Å; V414-L451 HydrophobicContact CG1-CD2 4.08Å; V414-L451 WeakPolarHBondContact CG1-O 3.49Å; V414-L451 HydrophobicContact CG2-CD2 3.81Å; V414-I454 HydrophobicContact CG2-CG2 3.9Å; V414-A455 HydrophobicContact CG1-CB 3.95Å
415	N	84.6	Confident	89.7	Confident	31 Å²	31	33.6 Å²	33.6	17%	0.166	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	11.1	178.5	-72.6	-44.4	0	0	0	114.6	H78 P411 V413 R417	H78-N415 PolarHBondContact CE1-O 3.25Å; H78-N415 WeakPolarHBondContact ND1-CA 3.49Å; H78-N415 PolarHBondContact ND1-OD1 3.26Å; P411-N415 WeakPolarHBondContact O-CB 3.35Å; P411-N415 VanDerWaalsContact O-CG 3.3Å; P411-N415 PolarHBondContact O-N 3.19Å; P411-N415 PolarHBondContact O-ND2 3.07Å; V413-N415 VanDerWaalsContact C-N 3.32Å; V413-N415 PolarHBondContact O-N 2.75Å; N415-R417 HydrophobicContact CB-CG 4.31Å; N415-R417 PolarHBondContact O-N 2.69Å; N415-R417 VanDerWaalsContact O-N 3.08Å
416	R	76.6	Confident	90.6	Very high	110 Å²	110	32.1 Å²	32.1	42%	0.415	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	27.4	177.8	-65.4	-178.6	168.6	-109.5	-6.5	114	K81 M402 E412 V413 V414	K81-R416 PolarHBondContact O-NH2 2.93Å; M402-R416 HydrophobicContact CE-CG 3.48Å; M402-R416 VanDerWaalsContact CE-CG 3.48Å; M402-R416 VanDerWaalsContact CE-NH2 3.34Å; E412-R416 PolarHBondContact O-N 2.92Å; V413-R416 PolarHBondContact O-N 2.68Å; V414-R416 PolarHBondContact O-N 3.21Å; V414-R416 VanDerWaalsContact O-N 3.16Å
417	R	81.2	Confident	91.1	Very high	169 Å²	169	31.5 Å²	31.5	64%	0.638	14%	0.135	S	C	*	.			trans	-80.3	156.4	173.7	-63	-175.8	179.4	-177.6	-0.8	109.3	E412 N415 Y419	E412-R417 HydrophobicContact CB-CB 4.21Å; E412-R417 PolarHBondContact O-N 3.26Å; N415-R417 HydrophobicContact CB-CG 4.31Å; N415-R417 PolarHBondContact O-N 2.69Å; N415-R417 VanDerWaalsContact O-N 3.08Å; R417-Y419 PolarHBondContact O-N 3.46Å
418	Q	80.8	Confident	91.4	Very high	133 Å²	133	30 Å²	30	62%	0.621	13%	0.129	S	C	*	.			trans	-63.7	126.4	169.6	-73.5	-175.4	9.5	0	0	109.5	K398 R399	K398-Q418 HydrophobicContact CB-CB 3.77Å; K398-Q418 HydrophobicContact CB-CG 4.45Å; K398-Q418 HydrophobicContact CD-CB 3.8Å; K398-Q418 HydrophobicContact CG-CB 4.41Å; R399-Q418 CarbonylContact O-C 2.99Å; R399-Q418 VanDerWaalsContact O-CA 3.31Å; R399-Q418 WeakPolarHBondContact O-CA 3.46Å
419	Y	84.4	Confident	91.5	Very high	5 Å²	5	29.4 Å²	29.4	2%	0.02	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-122.7	155.7	-176.7	65.3	-98.9	0	0	0	112.1	I364 R366 K398 R399 T401 V413 R417 V423	I364-Y419 HydrophobicContact CD1-CD2 4.34Å; I364-Y419 HydrophobicContact CD1-CE2 4.23Å; R366-Y419 WeakPolarHBondContact CD-OH 3.24Å; R366-Y419 HydrophobicContact CG-CE2 4.42Å; R366-Y419 PolarHBondContact NH1-OH 3.49Å; K398-Y419 CarbonylContact C-O 3.5Å; K398-Y419 VanDerWaalsContact CA-O 3.25Å; K398-Y419 WeakPolarHBondContact CA-O 3.09Å; R399-Y419 HydrophobicContact CB-CE1 4.24Å; R399-Y419 HydrophobicContact CB-CE2 3.94Å; R399-Y419 PolarHBondContact N-O 3.05Å; R399-Y419 WeakPolarHBondContact O-CD1 3.27Å; R399-Y419 WeakPolarHBondContact O-CE1 3.43Å; R399-Y419 PolarHBondContact O-N 3.45Å; T401-Y419 VanDerWaalsContact O-CE1 3.26Å; T401-Y419 WeakPolarHBondContact O-CE1 3.4Å; T401-Y419 PolarHBondContact O-OH 3.47Å; T401-Y419 PolarHBondContact OG1-OH 3.09Å; V413-Y419 HydrophobicContact CB-CD1 4.47Å; V413-Y419 HydrophobicContact CG1-CD1 4.35Å; V413-Y419 HydrophobicContact CG1-CE1 4.12Å; V413-Y419 HydrophobicContact CG2-CD1 3.93Å; V413-Y419 HydrophobicContact CG2-CD2 4.48Å; V413-Y419 HydrophobicContact CG2-CE1 4.35Å; V413-Y419 HydrophobicContact CG2-CG 4.01Å; R417-Y419 PolarHBondContact O-N 3.46Å; Y419-V423 HydrophobicContact CD2-CB 4.49Å; Y419-V423 HydrophobicContact CD2-CG1 3.66Å; Y419-V423 HydrophobicContact CD2-CG2 4.03Å; Y419-V423 HydrophobicContact CE2-CG2 4.37Å; Y419-V423 HydrophobicContact CG-CG1 3.8Å
420	N	89.6	Confident	91.8	Very high	28 Å²	28	29.3 Å²	29.3	15%	0.15	13%	0.126	C	C	.	.			trans	-115.1	-163.5	175.7	67.2	10.3	0	0	0	110.1	K422 V423	N420-K422 PolarHBondContact O-N 2.87Å; N420-K422 VanDerWaalsContact OD1-CB 3.3Å; N420-K422 WeakPolarHBondContact OD1-CB 3.39Å; N420-K422 PolarHBondContact OD1-N 2.95Å; N420-V423 WeakPolarHBondContact O-CG2 3.36Å; N420-V423 PolarHBondContact O-N 2.87Å
421	Y	93.6	Very high	92	Very high	73 Å²	73	29.2 Å²	29.2	29%	0.286	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-16.3	-178.7	56.7	-101.8	0	0	0	115.1	H359 V423 D424 T489	H359-Y421 HydrophobicContact CB-CD2 4.1Å; H359-Y421 HydrophobicContact CB-CG 4.1Å; H359-Y421 AromaticContact CE1-CD2 3.91Å; H359-Y421 PolarHBondContact CE1-O 2.83Å; H359-Y421 VanDerWaalsContact CE1-O 3.24Å; H359-Y421 AromaticContact CG-CD2 3.76Å; H359-Y421 AromaticContact CG-CG 3.85Å; H359-Y421 AromaticContact ND1-CD2 3.35Å; H359-Y421 VanDerWaalsContact ND1-CD2 3.35Å; H359-Y421 WeakPolarHBondContact ND1-CD2 3.4Å; H359-Y421 AromaticContact ND1-CG 3.89Å; H359-Y421 PolarHBondContact NE2-O 3.42Å; Y421-V423 PolarHBondContact O-N 3.18Å; Y421-V423 VanDerWaalsContact O-N 3.09Å; Y421-D424 WeakPolarHBondContact O-CB 3.21Å; Y421-D424 PolarHBondContact O-N 3.42Å; Y421-T489 HydrophobicContact CE2-CG2 4.18Å
422	K	96.9	Very high	92.2	Very high	19 Å²	19	29 Å²	29	8%	0.083	12%	0.124	C	C	.	.	H	α-helix	trans	-66.7	-9.2	179.1	-67.7	-171.7	177.2	-173.8	0	113.7	N420 D424 I425 W426 V484 D485 R487	N420-K422 PolarHBondContact O-N 2.87Å; N420-K422 VanDerWaalsContact OD1-CB 3.3Å; N420-K422 WeakPolarHBondContact OD1-CB 3.39Å; N420-K422 PolarHBondContact OD1-N 2.95Å; K422-D424 PolarHBondContact O-N 2.83Å; K422-I425 WeakPolarHBondContact O-CB 3.31Å; K422-I425 PolarHBondContact O-N 3.48Å; K422-W426 PolarHBondContact O-N 3.36Å; K422-V484 HydrophobicContact CB-CG1 4.34Å; K422-V484 HydrophobicContact CD-CG1 4.18Å; K422-V484 WeakPolarHBondContact CD-O 3.48Å; K422-V484 WeakPolarHBondContact CE-O 3.4Å; K422-V484 PolarHBondContact NZ-O 3.25Å; K422-D485 PolarHBondContact NZ-O 2.74Å; K422-R487 HydrophobicContact CD-CB 4.31Å; K422-R487 WeakPolarHBondContact CD-O 3.37Å; K422-R487 WeakPolarHBondContact CE-O 3.25Å; K422-R487 PolarHBondContact NZ-O 3.42Å; K422-R487 WeakPolarHBondContact O-CD 3.44Å; K422-R487 PolarHBondContact O-NH1 3.05Å
423	V	96	Very high	92.5	Very high	5 Å²	5	28.6 Å²	28.6	3%	0.03	12%	0.122	C	C	.	.	H	α-helix	trans	-64.1	-31	169.1	-59.2	0	0	0	0	112.3	I364 A410 E412 V413 Y419 N420 Y421 I425 W426 S427	I364-V423 HydrophobicContact CG2-CG2 3.6Å; A410-V423 HydrophobicContact CB-CB 4.26Å; A410-V423 HydrophobicContact CB-CG1 4.19Å; E412-V423 HydrophobicContact CG-CG1 4.3Å; E412-V423 WeakPolarHBondContact OE1-CG1 3.44Å; V413-V423 HydrophobicContact CG2-CB 4.05Å; V413-V423 HydrophobicContact CG2-CG1 3.43Å; V413-V423 VanDerWaalsContact CG2-CG1 3.43Å; Y419-V423 HydrophobicContact CD2-CB 4.49Å; Y419-V423 HydrophobicContact CD2-CG1 3.66Å; Y419-V423 HydrophobicContact CD2-CG2 4.03Å; Y419-V423 HydrophobicContact CE2-CG2 4.37Å; Y419-V423 HydrophobicContact CG-CG1 3.8Å; N420-V423 WeakPolarHBondContact O-CG2 3.36Å; N420-V423 PolarHBondContact O-N 2.87Å; Y421-V423 PolarHBondContact O-N 3.18Å; Y421-V423 VanDerWaalsContact O-N 3.09Å; V423-I425 VanDerWaalsContact C-N 3.28Å; V423-I425 PolarHBondContact O-N 3.48Å; V423-W426 PolarHBondContact O-N 2.9Å; V423-S427 PolarHBondContact O-N 2.96Å; V423-S427 VanDerWaalsContact O-N 3.09Å; V423-S427 PolarHBondContact O-OG 3.04Å
424	D	97.7	Very high	92.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-69.4	-31.2	176	-66	-24.8	0	0	0	110.8	L355 H359 I364 H365 R366 I368 Y421 K422 S427 L428	L355-D424 HydrophobicContact CD1-CB 4.27Å; L355-D424 HydrophobicContact CD2-CB 3.82Å; H359-D424 IonicContact CD2-OD2 3.78Å; H359-D424 IonicContact CE1-OD2 3.27Å; H359-D424 IonicContact NE2-OD2 2.91Å; H359-D424 PolarHBondContact NE2-OD2 3.22Å; I364-D424 WeakPolarHBondContact CG2-OD2 3.23Å; H365-D424 PolarHBondContact N-OD1 3.17Å; H365-D424 PolarHBondContact N-OD2 2.97Å; R366-D424 WeakPolarHBondContact CA-OD1 3.47Å; R366-D424 PolarHBondContact N-OD1 3.42Å; I368-D424 HydrophobicContact CG1-CB 4.14Å; Y421-D424 WeakPolarHBondContact O-CB 3.21Å; Y421-D424 PolarHBondContact O-N 3.42Å; K422-D424 PolarHBondContact O-N 2.83Å; D424-S427 PolarHBondContact O-N 3.43Å; D424-L428 WeakPolarHBondContact O-CB 3.43Å; D424-L428 PolarHBondContact O-N 3.46Å
425	I	98.6	Very high	93.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-70	-40.6	177.1	-56.6	-55.9	0	0	0	111.4	L352 L355 K422 V423 S427 L428 G429 C479 R487 A488 A490 L493	L352-I425 HydrophobicContact CD2-CD1 4.27Å; L355-I425 HydrophobicContact CD1-CD1 4.31Å; K422-I425 WeakPolarHBondContact O-CB 3.31Å; K422-I425 PolarHBondContact O-N 3.48Å; V423-I425 VanDerWaalsContact C-N 3.28Å; V423-I425 PolarHBondContact O-N 3.48Å; I425-S427 VanDerWaalsContact C-N 3.34Å; I425-L428 WeakPolarHBondContact O-CB 3.37Å; I425-L428 PolarHBondContact O-N 3.24Å; I425-G429 PolarHBondContact O-N 3.19Å; I425-C479 HydrophobicContact CG2-CB 4.31Å; I425-R487 HydrophobicContact CG2-CG 4.29Å; I425-A488 WeakPolarHBondContact CG2-O 3.33Å; I425-A490 HydrophobicContact CD1-CB 3.99Å; I425-L493 HydrophobicContact CD1-CD1 4.26Å; I425-L493 HydrophobicContact CG2-CD1 3.5Å
426	W	98.4	Very high	93.8	Very high	3 Å²	3	29.3 Å²	29.3	1%	0.011	13%	0.125	C	C	.	.	H	α-helix	trans	-58.9	-49.3	170.7	178.7	-79.7	0	0	0	111	M409 A410 P411 K422 V423 L428 G429 I430 G458 L480 V482	M409-W426 PolarHBondContact O-NE1 3.3Å; A410-W426 VanDerWaalsContact CA-CD1 3.46Å; A410-W426 HydrophobicContact CB-CB 3.68Å; A410-W426 HydrophobicContact CB-CD2 4.1Å; A410-W426 HydrophobicContact CB-CG 3.59Å; P411-W426 VanDerWaalsContact CD-CZ2 3.48Å; P411-W426 HydrophobicContact CG-CE3 4.42Å; P411-W426 HydrophobicContact CG-CH2 3.44Å; P411-W426 VanDerWaalsContact CG-CH2 3.44Å; P411-W426 HydrophobicContact CG-CZ2 3.65Å; P411-W426 HydrophobicContact CG-CZ3 3.85Å; K422-W426 PolarHBondContact O-N 3.36Å; V423-W426 PolarHBondContact O-N 2.9Å; W426-L428 VanDerWaalsContact C-N 3.27Å; W426-L428 PolarHBondContact O-N 3.31Å; W426-G429 WeakPolarHBondContact O-CA 3.46Å; W426-G429 PolarHBondContact O-N 3.39Å; W426-I430 PolarHBondContact O-N 2.67Å; W426-G458 WeakPolarHBondContact CH2-O 3.36Å; W426-L480 HydrophobicContact CD2-CD2 4Å; W426-L480 HydrophobicContact CE3-CD2 4.3Å; W426-L480 HydrophobicContact CG-CD2 4.37Å; W426-L480 HydrophobicContact CZ2-CD2 4.38Å; W426-L480 HydrophobicContact CZ3-CB 4.39Å; W426-L480 WeakPolarHBondContact CZ3-O 3.48Å; W426-V482 HydrophobicContact CH2-CG2 4.36Å; W426-V482 HydrophobicContact CZ3-CG2 4.27Å
427	S	98.2	Very high	94.6	Very high	8 Å²	8	25.8 Å²	25.8	6%	0.056	12%	0.115	C	C	.	.	H	α-helix	trans	-60.7	-37.3	-179.6	-54.4	0	0	0	0	111.7	I368 W408 V423 D424 I425 I430 M431	I368-S427 WeakPolarHBondContact O-CB 3.34Å; W408-S427 PolarHBondContact O-OG 3.25Å; W408-S427 VanDerWaalsContact O-OG 3.07Å; V423-S427 PolarHBondContact O-N 2.96Å; V423-S427 VanDerWaalsContact O-N 3.09Å; V423-S427 PolarHBondContact O-OG 3.04Å; D424-S427 PolarHBondContact O-N 3.43Å; I425-S427 VanDerWaalsContact C-N 3.34Å; S427-I430 PolarHBondContact O-N 2.77Å; S427-M431 PolarHBondContact O-N 3.21Å
428	L	98.7	Very high	95.2	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.6	-42.5	171.3	-174.5	84.3	0	0	0	111.8	L348 C351 L352 L355 I368 D424 I425 W426 M431 A432	L348-L428 HydrophobicContact CD2-CD1 3.84Å; L348-L428 HydrophobicContact CD2-CD2 4.3Å; L348-L428 HydrophobicContact CD2-CG 3.86Å; C351-L428 HydrophobicContact CB-CD1 3.72Å; L352-L428 HydrophobicContact CD1-CD2 4.26Å; L352-L428 HydrophobicContact CD2-CD2 3.51Å; L352-L428 HydrophobicContact CG-CD2 3.69Å; L355-L428 HydrophobicContact CD1-CB 4.45Å; L355-L428 HydrophobicContact CD1-CD1 4.25Å; I368-L428 HydrophobicContact CG2-CB 4.44Å; I368-L428 HydrophobicContact CG2-CD1 4.5Å; D424-L428 WeakPolarHBondContact O-CB 3.43Å; D424-L428 PolarHBondContact O-N 3.46Å; I425-L428 WeakPolarHBondContact O-CB 3.37Å; I425-L428 PolarHBondContact O-N 3.24Å; W426-L428 VanDerWaalsContact C-N 3.27Å; W426-L428 PolarHBondContact O-N 3.31Å; L428-M431 HydrophobicContact CD1-CE 3.67Å; L428-M431 CarbonylContact O-C 3.52Å; L428-M431 WeakPolarHBondContact O-CB 3.46Å; L428-M431 PolarHBondContact O-N 2.84Å; L428-A432 PolarHBondContact O-N 3.21Å
429	G	98.5	Very high	95.8	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-60.7	-42	174.5	0	0	0	0	0	112.6	I425 W426 A432 L433	I425-G429 PolarHBondContact O-N 3.19Å; W426-G429 WeakPolarHBondContact O-CA 3.46Å; W426-G429 PolarHBondContact O-N 3.39Å; G429-A432 WeakPolarHBondContact O-CB 3.44Å; G429-A432 PolarHBondContact O-N 3.06Å; G429-L433 PolarHBondContact O-N 3.08Å; G429-L433 VanDerWaalsContact O-N 3.12Å
430	I	98.3	Very high	96.3	Very high	5 Å²	5	14.7 Å²	14.7	3%	0.026	8%	0.076	C	C	.	.	H	α-helix	trans	-64.7	-40.8	173.8	-59.6	-59.5	0	0	0	111.3	W408 W426 S427 A432 L433 E434 P440 P441 P460 L480	W408-I430 HydrophobicContact CB-CG2 4.38Å; W408-I430 VanDerWaalsContact CD1-CG2 3.43Å; W408-I430 HydrophobicContact CD2-CG2 4.39Å; W408-I430 HydrophobicContact CG-CB 4.28Å; W408-I430 HydrophobicContact CG-CG2 3.82Å; W426-I430 PolarHBondContact O-N 2.67Å; S427-I430 PolarHBondContact O-N 2.77Å; I430-A432 VanDerWaalsContact C-N 3.27Å; I430-A432 PolarHBondContact O-N 3.27Å; I430-L433 HydrophobicContact CD1-CD1 4.47Å; I430-L433 WeakPolarHBondContact O-CB 3.38Å; I430-L433 PolarHBondContact O-N 2.73Å; I430-E434 PolarHBondContact O-N 3.28Å; I430-P440 HydrophobicContact CG2-CB 3.7Å; I430-P441 HydrophobicContact CD1-CG 4.38Å; I430-P460 HydrophobicContact CD1-CG 3.91Å; I430-L480 HydrophobicContact CD1-CD2 3.73Å; I430-L480 HydrophobicContact CG1-CD2 4.07Å
431	M	98.2	Very high	96.6	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-64.7	-30.2	174.5	-172.8	-175.6	77.9	0	0	112.4	L330 L348 C351 I368 V373 S427 L428 E434 M435	L330-M431 HydrophobicContact CD2-SD 4.37Å; L348-M431 HydrophobicContact CD2-CE 4.28Å; C351-M431 HydrophobicContact CB-CE 4.4Å; I368-M431 HydrophobicContact CG2-SD 4.2Å; V373-M431 HydrophobicContact CG2-CE 4.21Å; V373-M431 HydrophobicContact CG2-SD 3.53Å; V373-M431 VanDerWaalsContact CG2-SD 3.53Å; S427-M431 PolarHBondContact O-N 3.21Å; L428-M431 HydrophobicContact CD1-CE 3.67Å; L428-M431 CarbonylContact O-C 3.52Å; L428-M431 WeakPolarHBondContact O-CB 3.46Å; L428-M431 PolarHBondContact O-N 2.84Å; M431-E434 WeakPolarHBondContact O-CB 3.34Å; M431-E434 PolarHBondContact O-N 3.24Å; M431-M435 HydrophobicContact CE-CE 4.2Å; M431-M435 PolarHBondContact O-N 3.42Å
432	A	98.3	Very high	96.6	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-67.9	-39.8	172.4	0	0	0	0	0	112.1	L348 L428 G429 I430 E434 M435 L436 F472 L476	L348-A432 HydrophobicContact CD1-CB 4.18Å; L348-A432 HydrophobicContact CD2-CB 4.14Å; L428-A432 PolarHBondContact O-N 3.21Å; G429-A432 WeakPolarHBondContact O-CB 3.44Å; G429-A432 PolarHBondContact O-N 3.06Å; I430-A432 VanDerWaalsContact C-N 3.27Å; I430-A432 PolarHBondContact O-N 3.27Å; A432-E434 VanDerWaalsContact C-N 3.32Å; A432-M435 PolarHBondContact O-N 2.93Å; A432-L436 PolarHBondContact O-N 3.13Å; A432-F472 HydrophobicContact CB-CE2 4.37Å; A432-F472 HydrophobicContact CB-CZ 4.42Å; A432-L476 HydrophobicContact CB-CD2 3.67Å
433	L	97.2	Very high	96.4	Very high	1 Å²	1	15 Å²	15	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-64.4	-38.3	170.7	-63.6	179.5	0	0	0	111.6	G429 I430 M435 L436 D437 P441 P460 I462 L476 L480	G429-L433 PolarHBondContact O-N 3.08Å; G429-L433 VanDerWaalsContact O-N 3.12Å; I430-L433 HydrophobicContact CD1-CD1 4.47Å; I430-L433 WeakPolarHBondContact O-CB 3.38Å; I430-L433 PolarHBondContact O-N 2.73Å; L433-M435 VanDerWaalsContact C-N 3.33Å; L433-M435 PolarHBondContact O-N 2.79Å; L433-L436 WeakPolarHBondContact O-CB 3.41Å; L433-L436 PolarHBondContact O-N 3.03Å; L433-L436 VanDerWaalsContact O-N 3.08Å; L433-D437 WeakPolarHBondContact O-CB 3.41Å; L433-D437 PolarHBondContact O-N 3.15Å; L433-P441 HydrophobicContact CD1-CG 3.83Å; L433-P460 HydrophobicContact CD1-CG 3.86Å; L433-I462 HydrophobicContact CD2-CB 4.46Å; L433-I462 HydrophobicContact CD2-CD1 4.38Å; L433-I462 HydrophobicContact CD2-CG1 3.96Å; L433-I462 HydrophobicContact CD2-CG2 3.95Å; L433-L476 HydrophobicContact CD2-CD1 3.93Å; L433-L476 HydrophobicContact CD2-CD2 4.11Å; L433-L476 HydrophobicContact CG-CD2 4.37Å; L433-L480 HydrophobicContact CD1-CD1 3.87Å; L433-L480 HydrophobicContact CG-CD1 4.43Å
434	E	96.6	Very high	96.1	Very high	6 Å²	6	20 Å²	20	3%	0.028	11%	0.108	C	C	.	.	H	α-helix	trans	-62.1	-38.4	174.6	-176.8	-176.8	-165.6	0	0	112.4	V334 S370 W408 I430 M431 A432 L436 G438	V334-E434 HydrophobicContact CG2-CG 4.29Å; S370-E434 VanDerWaalsContact CB-CD 3.44Å; S370-E434 WeakPolarHBondContact CB-OE1 3.17Å; S370-E434 VanDerWaalsContact CB-OE2 3.26Å; S370-E434 WeakPolarHBondContact CB-OE2 3.19Å; S370-E434 PolarHBondContact N-OE2 3.01Å; S370-E434 PolarHBondContact OG-OE1 3.43Å; S370-E434 PolarHBondContact OG-OE2 3.49Å; W408-E434 WeakPolarHBondContact CZ2-OE2 3.47Å; W408-E434 PolarHBondContact NE1-OE2 2.69Å; I430-E434 PolarHBondContact O-N 3.28Å; M431-E434 WeakPolarHBondContact O-CB 3.34Å; M431-E434 PolarHBondContact O-N 3.24Å; A432-E434 VanDerWaalsContact C-N 3.32Å; E434-L436 VanDerWaalsContact C-N 3.27Å; E434-L436 PolarHBondContact O-N 3.15Å; E434-G438 CarbonylContact O-C 3.47Å; E434-G438 WeakPolarHBondContact O-CA 3.48Å; E434-G438 PolarHBondContact O-N 2.81Å
435	M	97.5	Very high	95.8	Very high	4 Å²	4	23.2 Å²	23.2	2%	0.02	12%	0.123	C	C	.	.	H	α-helix	trans	-67.3	-27.6	173.1	-74.5	-174	-84.2	0	0	113.4	L330 V334 L339 I344 V347 L348 M431 A432 L433	L330-M435 HydrophobicContact CD2-CG 4.13Å; L330-M435 HydrophobicContact CD2-SD 3.96Å; V334-M435 HydrophobicContact CG1-CB 4.15Å; V334-M435 HydrophobicContact CG1-CG 3.64Å; L339-M435 HydrophobicContact CD1-CG 4.46Å; L339-M435 HydrophobicContact CD1-SD 4.38Å; I344-M435 HydrophobicContact CD1-CB 4.13Å; I344-M435 HydrophobicContact CG1-CB 3.97Å; I344-M435 HydrophobicContact CG1-SD 4.45Å; I344-M435 HydrophobicContact CG2-CB 4.42Å; I344-M435 HydrophobicContact CG2-CE 3.9Å; I344-M435 HydrophobicContact CG2-SD 4.2Å; V347-M435 HydrophobicContact CB-CE 4.45Å; V347-M435 HydrophobicContact CB-SD 3.95Å; V347-M435 HydrophobicContact CG1-CE 4.2Å; V347-M435 HydrophobicContact CG1-SD 3.87Å; V347-M435 HydrophobicContact CG2-SD 4.32Å; L348-M435 HydrophobicContact CD1-CE 4.48Å; L348-M435 HydrophobicContact CD2-CE 3.67Å; L348-M435 HydrophobicContact CG-CE 3.84Å; M431-M435 HydrophobicContact CE-CE 4.2Å; M431-M435 PolarHBondContact O-N 3.42Å; A432-M435 PolarHBondContact O-N 2.93Å; L433-M435 VanDerWaalsContact C-N 3.33Å; L433-M435 PolarHBondContact O-N 2.79Å
436	L	94.8	Very high	95.3	Very high	46 Å²	46	24.4 Å²	24.4	24%	0.241	13%	0.133	C	C	.	.	H	α-helix	trans	-80.5	-48	178.7	179.8	69.6	0	0	0	111.7	A432 L433 E434 I462 L468	A432-L436 PolarHBondContact O-N 3.13Å; L433-L436 WeakPolarHBondContact O-CB 3.41Å; L433-L436 PolarHBondContact O-N 3.03Å; L433-L436 VanDerWaalsContact O-N 3.08Å; E434-L436 VanDerWaalsContact C-N 3.27Å; E434-L436 PolarHBondContact O-N 3.15Å; L436-I462 HydrophobicContact CD2-CG2 4.37Å; L436-L468 HydrophobicContact CD1-CD2 3.73Å; L436-L468 HydrophobicContact CD2-CD1 4.24Å; L436-L468 HydrophobicContact CD2-CD2 3.62Å; L436-L468 HydrophobicContact CD2-CG 4.47Å; L436-L468 HydrophobicContact CG-CD2 4.34Å
437	D	93.2	Very high	94.7	Very high	36 Å²	36	26.7 Å²	26.7	19%	0.193	15%	0.148	C	C	.	.	H	α-helix	trans	-100.3	-12.4	-169.6	-70.4	-28.7	0	0	0	113.5	L433 E439	L433-D437 WeakPolarHBondContact O-CB 3.41Å; L433-D437 PolarHBondContact O-N 3.15Å; D437-E439 PolarHBondContact O-N 2.82Å
438	G	93.1	Very high	94.2	Very high	22 Å²	22	26.3 Å²	26.3	23%	0.227	15%	0.145	C	C	.	.	S	Bend	trans	81.5	-5.3	-173.9	0	0	0	0	0	114.5	E434	E434-G438 CarbonylContact O-C 3.47Å; E434-G438 WeakPolarHBondContact O-CA 3.48Å; E434-G438 PolarHBondContact O-N 2.81Å
439	E	94.1	Very high	93.7	Very high	49 Å²	49	27.2 Å²	27.2	23%	0.229	15%	0.149	C	C	.	.	S	Bend	trans	-151.2	151.3	178.9	57.8	175.6	-162.2	0	0	110.9	D437 L443 K463	D437-E439 PolarHBondContact O-N 2.82Å; E439-L443 HydrophobicContact CB-CB 4.37Å; E439-L443 HydrophobicContact CB-CD2 3.69Å; E439-K463 IonicContact OE1-NZ 2.69Å; E439-K463 PolarHBondContact OE1-NZ 3.28Å
440	P	95.5	Very high	93.3	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.019	15%	0.149	C	C	.	.			trans	-70.3	161.9	170.4	33.9	-39.8	0	0	0	111.4	W408 I430 L443	W408-P440 HydrophobicContact CD2-CB 4.47Å; W408-P440 HydrophobicContact CH2-CB 4.38Å; W408-P440 HydrophobicContact CH2-CG 3.61Å; W408-P440 HydrophobicContact CZ2-CB 3.94Å; W408-P440 HydrophobicContact CZ2-CG 3.59Å; W408-P440 HydrophobicContact CZ3-CG 4.13Å; I430-P440 HydrophobicContact CG2-CB 3.7Å; P440-L443 HydrophobicContact CG-CB 4.19Å; P440-L443 HydrophobicContact CG-CD1 4.07Å; P440-L443 PolarHBondContact O-N 3.35Å
441	P	95.4	Very high	92.9	Very high	16 Å²	16	27 Å²	27	10%	0.104	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	143.8	172.1	-25.1	36.2	0	0	0	112.6	I430 L433 L443 P460	I430-P441 HydrophobicContact CD1-CG 4.38Å; L433-P441 HydrophobicContact CD1-CG 3.83Å; P441-L443 PolarHBondContact O-N 3.05Å; P441-P460 HydrophobicContact CB-CB 3.81Å; P441-P460 HydrophobicContact CB-CG 4.42Å; P441-P460 HydrophobicContact CG-CB 3.73Å; P441-P460 HydrophobicContact CG-CG 3.85Å
442	Y	94.3	Very high	92.5	Very high	47 Å²	47	27.1 Å²	27.1	18%	0.184	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	16.2	175.8	-36.7	-60.8	0	0	0	115.5	Y407 N444 E445 L453 I454 P460	Y407-Y442 VanDerWaalsContact CE1-O 3.28Å; Y407-Y442 WeakPolarHBondContact CE1-O 3.34Å; Y442-N444 PolarHBondContact O-N 3.34Å; Y442-E445 VanDerWaalsContact O-CB 3.31Å; Y442-E445 WeakPolarHBondContact O-CB 3.27Å; Y442-E445 PolarHBondContact O-N 2.99Å; Y442-L453 HydrophobicContact CD1-CB 4.41Å; Y442-L453 HydrophobicContact CD1-CD1 3.65Å; Y442-L453 HydrophobicContact CD2-CB 4.41Å; Y442-L453 HydrophobicContact CE1-CB 4.26Å; Y442-L453 HydrophobicContact CE1-CD1 4.03Å; Y442-L453 HydrophobicContact CE2-CB 4.25Å; Y442-L453 HydrophobicContact CG-CB 4.47Å; Y442-L453 HydrophobicContact CG-CD1 4.07Å; Y442-I454 HydrophobicContact CD2-CG1 4.19Å; Y442-I454 HydrophobicContact CE2-CG1 4.13Å; Y442-P460 HydrophobicContact CE2-CB 4.31Å
443	L	91.9	Very high	92.2	Very high	63 Å²	63	28.4 Å²	28.4	33%	0.33	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-29	178.9	-171.3	68.4	0	0	0	113.2	Y407 E439 P440 P441 E445	Y407-L443 HydrophobicContact CD2-CD1 4.17Å; Y407-L443 HydrophobicContact CE2-CD1 4.11Å; E439-L443 HydrophobicContact CB-CB 4.37Å; E439-L443 HydrophobicContact CB-CD2 3.69Å; P440-L443 HydrophobicContact CG-CB 4.19Å; P440-L443 HydrophobicContact CG-CD1 4.07Å; P440-L443 PolarHBondContact O-N 3.35Å; P441-L443 PolarHBondContact O-N 3.05Å; L443-E445 VanDerWaalsContact C-N 3.29Å
444	N	90.7	Very high	92	Very high	110 Å²	110	28.7 Å²	28.7	59%	0.588	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-20.4	174.9	62.9	-37.7	0	0	0	113.3	Y442	Y442-N444 PolarHBondContact O-N 3.34Å
445	E	91.1	Very high	91.6	Very high	68 Å²	68	29 Å²	29	32%	0.318	16%	0.16	S	C	.	.	S	Bend	trans	-80.7	158	178	-61.5	-62.6	162.7	0	0	112.1	Y407 Y442 L443 K449 A450 L453	Y407-E445 PolarHBondContact OH-O 3.47Å; Y442-E445 VanDerWaalsContact O-CB 3.31Å; Y442-E445 WeakPolarHBondContact O-CB 3.27Å; Y442-E445 PolarHBondContact O-N 2.99Å; L443-E445 VanDerWaalsContact C-N 3.29Å; E445-K449 HydrophobicContact CB-CB 4.33Å; E445-K449 HydrophobicContact CB-CG 4.26Å; E445-K449 HydrophobicContact CG-CG 4.36Å; E445-A450 HydrophobicContact CB-CB 4.49Å; E445-L453 HydrophobicContact CG-CD1 4.03Å
446	A	87.2	Confident	91.3	Very high	25 Å²	25	31.1 Å²	31.1	21%	0.207	17%	0.17	C	C	.	.			trans	-67.9	149.3	169.9	0	0	0	0	0	110.5	Q63 L448 K449 A450	Q63-A446 HydrophobicContact CG-CB 4.29Å; Q63-A446 VanDerWaalsContact OE1-CB 3.3Å; A446-L448 VanDerWaalsContact C-N 3.28Å; A446-L448 PolarHBondContact O-N 3.4Å; A446-L448 VanDerWaalsContact O-N 3.12Å; A446-K449 PolarHBondContact O-N 3.37Å; A446-A450 PolarHBondContact O-N 2.86Å
447	P	86.6	Confident	91.1	Very high	51 Å²	51	32.9 Å²	32.9	33%	0.331	18%	0.18	S	C	.	.	H	α-helix	trans	-53.5	-39.4	-176.9	-29.7	34.1	0	0	0	114.7	P406 A450 L451	P406-P447 HydrophobicContact CG-CB 4.33Å; P447-A450 PolarHBondContact O-N 3.46Å; P447-L451 VanDerWaalsContact O-CD1 3.27Å; P447-L451 WeakPolarHBondContact O-CD1 3.2Å; P447-L451 WeakPolarHBondContact O-CG 3.39Å; P447-L451 PolarHBondContact O-N 3.11Å
448	L	86.3	Confident	91.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.8	-43.2	177.3	174.2	70.4	0	0	0	111.6	M59 A79 L80 Y83 A446 L451 Y452	M59-L448 HydrophobicContact CE-CD2 3.54Å; A79-L448 HydrophobicContact CB-CD1 3.63Å; A79-L448 WeakPolarHBondContact O-CD1 3.29Å; L80-L448 HydrophobicContact CD2-CD1 4.15Å; L80-L448 HydrophobicContact CD2-CD2 3.9Å; L80-L448 HydrophobicContact CG-CD1 4.42Å; Y83-L448 HydrophobicContact CD2-CB 3.97Å; Y83-L448 HydrophobicContact CG-CB 4.15Å; Y83-L448 HydrophobicContact CG-CD1 4.38Å; A446-L448 VanDerWaalsContact C-N 3.28Å; A446-L448 PolarHBondContact O-N 3.4Å; A446-L448 VanDerWaalsContact O-N 3.12Å; L448-L451 PolarHBondContact O-N 3.06Å; L448-Y452 PolarHBondContact O-N 3.42Å
449	K	88.6	Confident	91.2	Very high	19 Å²	19	33.9 Å²	33.9	8%	0.083	18%	0.178	C	C	.	.	H	α-helix	trans	-64.3	-42.2	175.6	-178.5	59.6	167.9	-170.3	0	111.4	Q63 I64 D68 E445 A446 L451 Y452 L453	Q63-K449 WeakPolarHBondContact O-CD 3.29Å; I64-K449 HydrophobicContact CG1-CD 3.96Å; D68-K449 IonicContact OD2-NZ 3.4Å; D68-K449 PolarHBondContact OD2-NZ 2.68Å; E445-K449 HydrophobicContact CB-CB 4.33Å; E445-K449 HydrophobicContact CB-CG 4.26Å; E445-K449 HydrophobicContact CG-CG 4.36Å; A446-K449 PolarHBondContact O-N 3.37Å; K449-L451 PolarHBondContact O-N 2.85Å; K449-Y452 HydrophobicContact CD-CD1 4.11Å; K449-Y452 WeakPolarHBondContact O-CB 3.42Å; K449-Y452 PolarHBondContact O-N 2.65Å; K449-L453 HydrophobicContact CD-CG 4.34Å; K449-L453 HydrophobicContact CG-CD1 4.13Å; K449-L453 HydrophobicContact CG-CG 4.42Å; K449-L453 WeakPolarHBondContact O-CG 3.4Å; K449-L453 PolarHBondContact O-N 2.75Å
450	A	90.4	Very high	91.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.7	-44.6	176	0	0	0	0	0	112	Y407 E445 A446 P447 Y452 L453 I454	Y407-A450 HydrophobicContact CD1-CB 3.64Å; Y407-A450 HydrophobicContact CE1-CB 3.5Å; E445-A450 HydrophobicContact CB-CB 4.49Å; A446-A450 PolarHBondContact O-N 2.86Å; P447-A450 PolarHBondContact O-N 3.46Å; A450-Y452 VanDerWaalsContact C-N 3.33Å; A450-Y452 PolarHBondContact O-N 3.41Å; A450-L453 PolarHBondContact O-N 2.89Å; A450-I454 VanDerWaalsContact O-CG1 3.26Å; A450-I454 WeakPolarHBondContact O-CG1 3.2Å; A450-I454 PolarHBondContact O-N 3.21Å
451	L	89.5	Confident	91.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61	-42	175.3	-68.4	158.7	0	0	0	112	A79 F82 P406 M409 V414 P447 L448 K449 I454 A455	A79-L451 HydrophobicContact CB-CB 3.94Å; F82-L451 HydrophobicContact CB-CD1 3.98Å; F82-L451 HydrophobicContact CD1-CD1 3.06Å; F82-L451 HydrophobicContact CD1-CD2 3.97Å; F82-L451 HydrophobicContact CD1-CG 4.14Å; F82-L451 HydrophobicContact CD2-CD2 4.12Å; F82-L451 HydrophobicContact CE1-CD1 3.62Å; F82-L451 HydrophobicContact CE1-CD2 4.09Å; F82-L451 HydrophobicContact CE1-CG 4.47Å; F82-L451 HydrophobicContact CE2-CD2 4.35Å; F82-L451 HydrophobicContact CG-CD1 3.6Å; F82-L451 HydrophobicContact CG-CD2 3.99Å; F82-L451 HydrophobicContact CG-CG 4.42Å; F82-L451 HydrophobicContact CZ-CD2 4.3Å; P406-L451 HydrophobicContact CB-CD1 4.5Å; P406-L451 HydrophobicContact CB-CD2 4.02Å; P406-L451 HydrophobicContact CB-CG 4.12Å; M409-L451 HydrophobicContact SD-CD2 4.02Å; V414-L451 HydrophobicContact CG1-CB 4.14Å; V414-L451 HydrophobicContact CG1-CD2 4.08Å; V414-L451 WeakPolarHBondContact CG1-O 3.49Å; V414-L451 HydrophobicContact CG2-CD2 3.81Å; P447-L451 VanDerWaalsContact O-CD1 3.27Å; P447-L451 WeakPolarHBondContact O-CD1 3.2Å; P447-L451 WeakPolarHBondContact O-CG 3.39Å; P447-L451 PolarHBondContact O-N 3.11Å; L448-L451 PolarHBondContact O-N 3.06Å; K449-L451 PolarHBondContact O-N 2.85Å; L451-I454 PolarHBondContact O-N 2.98Å; L451-A455 WeakPolarHBondContact O-CB 3.16Å; L451-A455 PolarHBondContact O-N 2.89Å
452	Y	89.6	Confident	90.9	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-59.5	-47.8	173.4	166.3	-94.1	0	0	0	111.5	I64 D68 A75 V76 L448 K449 A450 I454 A455 Q456	I64-Y452 HydrophobicContact CD1-CD1 4.38Å; I64-Y452 HydrophobicContact CD1-CD2 4.06Å; I64-Y452 HydrophobicContact CD1-CG 3.77Å; I64-Y452 HydrophobicContact CG2-CD1 4.47Å; I64-Y452 HydrophobicContact CG2-CE1 4.38Å; I64-Y452 HydrophobicContact CG2-CE2 4.45Å; D68-Y452 HydrophobicContact CB-CE1 4.2Å; D68-Y452 WeakPolarHBondContact CB-OH 3.27Å; D68-Y452 PolarHBondContact O-OH 3.16Å; A75-Y452 HydrophobicContact CB-CD2 3.95Å; A75-Y452 HydrophobicContact CB-CE2 4.13Å; V76-Y452 HydrophobicContact CG2-CD2 3.6Å; V76-Y452 HydrophobicContact CG2-CE2 3.62Å; L448-Y452 PolarHBondContact O-N 3.42Å; K449-Y452 HydrophobicContact CD-CD1 4.11Å; K449-Y452 WeakPolarHBondContact O-CB 3.42Å; K449-Y452 PolarHBondContact O-N 2.65Å; A450-Y452 VanDerWaalsContact C-N 3.33Å; A450-Y452 PolarHBondContact O-N 3.41Å; Y452-I454 VanDerWaalsContact C-N 3.35Å; Y452-I454 PolarHBondContact O-N 3.41Å; Y452-A455 PolarHBondContact O-N 3.07Å; Y452-Q456 HydrophobicContact CE1-CB 4.49Å; Y452-Q456 WeakPolarHBondContact O-CB 3.32Å; Y452-Q456 PolarHBondContact O-N 3.32Å
453	L	92.2	Very high	90.6	Very high	27 Å²	27	42.1 Å²	42.1	14%	0.141	22%	0.216	C	C	.	.	H	α-helix	trans	-62.7	-40.3	179.8	-69.4	171.7	0	0	0	112	Y442 E445 K449 A450 Q456 N457	Y442-L453 HydrophobicContact CD1-CB 4.41Å; Y442-L453 HydrophobicContact CD1-CD1 3.65Å; Y442-L453 HydrophobicContact CD2-CB 4.41Å; Y442-L453 HydrophobicContact CE1-CB 4.26Å; Y442-L453 HydrophobicContact CE1-CD1 4.03Å; Y442-L453 HydrophobicContact CE2-CB 4.25Å; Y442-L453 HydrophobicContact CG-CB 4.47Å; Y442-L453 HydrophobicContact CG-CD1 4.07Å; E445-L453 HydrophobicContact CG-CD1 4.03Å; K449-L453 HydrophobicContact CD-CG 4.34Å; K449-L453 HydrophobicContact CG-CD1 4.13Å; K449-L453 HydrophobicContact CG-CG 4.42Å; K449-L453 WeakPolarHBondContact O-CG 3.4Å; K449-L453 PolarHBondContact O-N 2.75Å; A450-L453 PolarHBondContact O-N 2.89Å; L453-Q456 PolarHBondContact O-N 3.01Å; L453-N457 VanDerWaalsContact O-CB 3.29Å; L453-N457 WeakPolarHBondContact O-CB 3.45Å; L453-N457 PolarHBondContact O-N 3.22Å
454	I	92.7	Very high	90.2	Very high	6 Å²	6	46.2 Å²	46.2	3%	0.031	23%	0.234	C	C	.	.	H	α-helix	trans	-63.4	-47.2	175.4	-68.9	164	0	0	0	110.8	P406 P411 V414 Y442 A450 L451 Y452 Q456 G458	P406-I454 WeakPolarHBondContact O-CD1 3.45Å; P411-I454 HydrophobicContact CB-CG2 4.48Å; P411-I454 HydrophobicContact CG-CG2 4.22Å; V414-I454 HydrophobicContact CG2-CG2 3.9Å; Y442-I454 HydrophobicContact CD2-CG1 4.19Å; Y442-I454 HydrophobicContact CE2-CG1 4.13Å; A450-I454 VanDerWaalsContact O-CG1 3.26Å; A450-I454 WeakPolarHBondContact O-CG1 3.2Å; A450-I454 PolarHBondContact O-N 3.21Å; L451-I454 PolarHBondContact O-N 2.98Å; Y452-I454 VanDerWaalsContact C-N 3.35Å; Y452-I454 PolarHBondContact O-N 3.41Å; I454-Q456 VanDerWaalsContact C-N 3.28Å; I454-Q456 PolarHBondContact O-N 3.37Å; I454-G458 WeakPolarHBondContact O-CA 3.26Å; I454-G458 PolarHBondContact O-N 3.38Å
455	A	90.1	Very high	90.1	Very high	13 Å²	13	45.5 Å²	45.5	11%	0.107	23%	0.227	C	C	.	.	H	α-helix	trans	-65	-33.4	178.5	0	0	0	0	0	112.6	A75 V414 L451 Y452	A75-A455 HydrophobicContact CB-CB 3.82Å; V414-A455 HydrophobicContact CG1-CB 3.95Å; L451-A455 WeakPolarHBondContact O-CB 3.16Å; L451-A455 PolarHBondContact O-N 2.89Å; Y452-A455 PolarHBondContact O-N 3.07Å
456	Q	89.5	Confident	90.1	Very high	48 Å²	48	51.8 Å²	51.8	22%	0.224	26%	0.256	C	S	.	.	H	α-helix	trans	-80.9	-48.5	-177.3	176.3	57.1	28.8	0	0	113.3	N72 Y452 L453 I454	N72-Q456 VanDerWaalsContact CG-OE1 3.23Å; N72-Q456 PolarHBondContact ND2-OE1 2.98Å; Y452-Q456 HydrophobicContact CE1-CB 4.49Å; Y452-Q456 WeakPolarHBondContact O-CB 3.32Å; Y452-Q456 PolarHBondContact O-N 3.32Å; L453-Q456 PolarHBondContact O-N 3.01Å; I454-Q456 VanDerWaalsContact C-N 3.28Å; I454-Q456 PolarHBondContact O-N 3.37Å
457	N	91.5	Very high	90.3	Very high	84 Å²	84	54.3 Å²	54.3	45%	0.449	27%	0.272	S	S	.	.	H	α-helix	trans	-93.2	-25.2	-170.6	-62.5	-17.2	0	0	0	112.2	L453 K459	L453-N457 VanDerWaalsContact O-CB 3.29Å; L453-N457 WeakPolarHBondContact O-CB 3.45Å; L453-N457 PolarHBondContact O-N 3.22Å; N457-K459 PolarHBondContact O-N 2.84Å
458	G	92.8	Very high	90.7	Very high	7 Å²	7	52.8 Å²	52.8	7%	0.072	26%	0.261	C	S	.	.	S	Bend	trans	66.9	-110.9	-169.8	0	0	0	0	0	110.5	W426 I454	W426-G458 WeakPolarHBondContact CH2-O 3.36Å; I454-G458 WeakPolarHBondContact O-CA 3.26Å; I454-G458 PolarHBondContact O-N 3.38Å
459	K	95.3	Very high	91.2	Very high	72 Å²	72	54.9 Å²	54.9	31%	0.313	28%	0.276	S	S	.	.	S	Bend	trans	-64	124	-178.3	-179.6	-177.7	176	-164.1	0	109.9	N457 D477 L480 V482	N457-K459 PolarHBondContact O-N 2.84Å; K459-D477 WeakPolarHBondContact CE-OD1 3.48Å; K459-D477 VanDerWaalsContact NZ-CG 3.31Å; K459-D477 IonicContact NZ-OD1 2.86Å; K459-D477 PolarHBondContact NZ-OD1 2.79Å; K459-D477 IonicContact NZ-OD2 2.75Å; K459-L480 HydrophobicContact CD-CB 4.44Å; K459-L480 HydrophobicContact CG-CB 3.99Å; K459-V482 HydrophobicContact CB-CG2 4.34Å
460	P	95	Very high	91.6	Very high	6 Å²	6	62 Å²	62	4%	0.039	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-68.4	153	177.1	29.6	-35	0	0	0	111.4	I430 L433 P441 Y442 L480	I430-P460 HydrophobicContact CD1-CG 3.91Å; L433-P460 HydrophobicContact CD1-CG 3.86Å; P441-P460 HydrophobicContact CB-CB 3.81Å; P441-P460 HydrophobicContact CB-CG 4.42Å; P441-P460 HydrophobicContact CG-CB 3.73Å; P441-P460 HydrophobicContact CG-CG 3.85Å; Y442-P460 HydrophobicContact CE2-CB 4.31Å; P460-L480 HydrophobicContact CG-CD1 4.26Å
461	E	92.2	Very high	92	Very high	177 Å²	177	65.9 Å²	65.9	83%	0.827	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-68.6	133.7	169.9	-172.7	178.8	177.1	0	0	110
462	I	92.1	Very high	92.4	Very high	6 Å²	6	65.9 Å²	65.9	3%	0.031	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-90.7	116.9	-179.1	-58.4	174.4	0	0	0	108.5	L433 L436 Q464 Q465 L468 L476	L433-I462 HydrophobicContact CD2-CB 4.46Å; L433-I462 HydrophobicContact CD2-CD1 4.38Å; L433-I462 HydrophobicContact CD2-CG1 3.96Å; L433-I462 HydrophobicContact CD2-CG2 3.95Å; L436-I462 HydrophobicContact CD2-CG2 4.37Å; I462-Q464 PolarHBondContact O-N 2.98Å; I462-Q465 HydrophobicContact CB-CB 4.26Å; I462-Q465 HydrophobicContact CG2-CB 4.41Å; I462-Q465 PolarHBondContact O-N 2.88Å; I462-L468 HydrophobicContact CG2-CD1 3.66Å; I462-L476 HydrophobicContact CD1-CB 4.26Å; I462-L476 HydrophobicContact CD1-CD1 3.95Å
463	K	87.6	Confident	92.7	Very high	99 Å²	99	66.7 Å²	66.7	43%	0.43	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	133.5	173.9	-61.5	178.6	-171	165.1	0	108.3	E439 Q465	E439-K463 IonicContact OE1-NZ 2.69Å; E439-K463 PolarHBondContact OE1-NZ 3.28Å; K463-Q465 VanDerWaalsContact C-N 3.29Å; K463-Q465 PolarHBondContact O-N 3.35Å
464	Q	83.6	Confident	93	Very high	149 Å²	149	68.5 Å²	68.5	70%	0.696	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	36.1	177.9	-52.6	172.7	54.2	0	0	114.2	I462 Q466 S467	I462-Q464 PolarHBondContact O-N 2.98Å; Q464-Q466 PolarHBondContact O-N 3.45Å; Q464-S467 PolarHBondContact O-N 3.45Å; Q464-S467 PolarHBondContact O-OG 3.29Å
465	Q	88.8	Confident	93.3	Very high	95 Å²	95	68.2 Å²	68.2	44%	0.444	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-48.3	-32.5	179.1	-172.9	172.9	-18.3	0	0	114.2	I462 K463 S467 L468	I462-Q465 HydrophobicContact CB-CB 4.26Å; I462-Q465 HydrophobicContact CG2-CB 4.41Å; I462-Q465 PolarHBondContact O-N 2.88Å; K463-Q465 VanDerWaalsContact C-N 3.29Å; K463-Q465 PolarHBondContact O-N 3.35Å; Q465-S467 VanDerWaalsContact C-N 3.27Å; Q465-S467 PolarHBondContact O-N 3.36Å; Q465-L468 PolarHBondContact O-N 2.99Å
466	Q	90.1	Very high	93.6	Very high	199 Å²	199	67.6 Å²	67.6	93%	0.93	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-67	-19.6	177.9	-64.5	-179.1	-9.5	0	0	114.7	Q464	Q464-Q466 PolarHBondContact O-N 3.45Å
467	S	92.4	Very high	94	Very high	79 Å²	79	68 Å²	68	55%	0.552	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-87.4	-11.2	177.5	65.3	0	0	0	0	113.5	Q464 Q465	Q464-S467 PolarHBondContact O-N 3.45Å; Q464-S467 PolarHBondContact O-OG 3.29Å; Q465-S467 VanDerWaalsContact C-N 3.27Å; Q465-S467 PolarHBondContact O-N 3.36Å
468	L	95	Very high	94.4	Very high	19 Å²	19	69.6 Å²	69.6	10%	0.099	35%	0.345	C	S	.	.	S	Bend	trans	-79.1	145	-179.2	-55.8	179.6	0	0	0	110.9	E341 L436 I462 Q465 F472 L476	E341-L468 WeakPolarHBondContact OE1-CA 3.08Å; L436-L468 HydrophobicContact CD1-CD2 3.73Å; L436-L468 HydrophobicContact CD2-CD1 4.24Å; L436-L468 HydrophobicContact CD2-CD2 3.62Å; L436-L468 HydrophobicContact CD2-CG 4.47Å; L436-L468 HydrophobicContact CG-CD2 4.34Å; I462-L468 HydrophobicContact CG2-CD1 3.66Å; Q465-L468 PolarHBondContact O-N 2.99Å; L468-F472 HydrophobicContact CD2-CD1 3.8Å; L468-F472 HydrophobicContact CD2-CE1 4.03Å; L468-L476 HydrophobicContact CD1-CD1 3.92Å
469	S	96.9	Very high	94.6	Very high	44 Å²	44	69.3 Å²	69.3	31%	0.308	34%	0.341	S	S	.	.			trans	-62.5	148.4	168.1	76.2	0	0	0	0	110.2	E341 L471 F472 S473	E341-S469 PolarHBondContact OE1-N 3.04Å; E341-S469 WeakPolarHBondContact OE2-CB 3.38Å; E341-S469 PolarHBondContact OE2-OG 2.86Å; S469-L471 PolarHBondContact O-N 3.17Å; S469-L471 VanDerWaalsContact O-N 3.14Å; S469-F472 PolarHBondContact O-N 3.41Å; S469-F472 WeakPolarHBondContact OG-CB 3.3Å; S469-F472 PolarHBondContact OG-N 3.36Å; S469-F472 VanDerWaalsContact OG-N 3.12Å; S469-S473 PolarHBondContact O-N 2.84Å
470	M	96.8	Very high	94.8	Very high	169 Å²	169	65.9 Å²	65.9	83%	0.833	33%	0.326	S	S	*	.	H	α-helix	trans	-55.1	-35.2	176.5	-65.3	-172.6	-62	0	0	111.8	D474	M470-D474 PolarHBondContact O-N 3.19Å
471	L	97.8	Very high	94.9	Very high	81 Å²	81	67.2 Å²	67.2	42%	0.424	34%	0.336	S	S	.	.	H	α-helix	trans	-69.3	-39.7	178.2	-64	-177.2	0	0	0	112.1	S469 F475 H496 P497 F498	S469-L471 PolarHBondContact O-N 3.17Å; S469-L471 VanDerWaalsContact O-N 3.14Å; L471-F475 WeakPolarHBondContact O-CB 3.43Å; L471-F475 PolarHBondContact O-N 2.96Å; L471-H496 PolarHBondContact O-CE1 3.23Å; L471-P497 HydrophobicContact CD1-CB 4.34Å; L471-P497 HydrophobicContact CD2-CB 4.06Å; L471-F498 HydrophobicContact CB-CB 4.15Å; L471-F498 HydrophobicContact CB-CD2 4.44Å
472	F	97.8	Very high	95.1	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-72	-38.6	177.9	-170.5	-153.6	0	0	0	111.5	E341 I344 A432 L468 S469 F475 L476 F498	E341-F472 HydrophobicContact CG-CD1 3.72Å; E341-F472 HydrophobicContact CG-CE1 4.32Å; E341-F472 HydrophobicContact CG-CG 4.4Å; I344-F472 HydrophobicContact CD1-CE1 4.21Å; I344-F472 HydrophobicContact CD1-CZ 4.29Å; I344-F472 HydrophobicContact CG2-CE2 4.18Å; I344-F472 HydrophobicContact CG2-CZ 3.84Å; A432-F472 HydrophobicContact CB-CE2 4.37Å; A432-F472 HydrophobicContact CB-CZ 4.42Å; L468-F472 HydrophobicContact CD2-CD1 3.8Å; L468-F472 HydrophobicContact CD2-CE1 4.03Å; S469-F472 PolarHBondContact O-N 3.41Å; S469-F472 WeakPolarHBondContact OG-CB 3.3Å; S469-F472 PolarHBondContact OG-N 3.36Å; S469-F472 VanDerWaalsContact OG-N 3.12Å; F472-F475 HydrophobicContact CD2-CB 4.48Å; F472-F475 HydrophobicContact CD2-CD1 4.44Å; F472-F475 HydrophobicContact CE2-CD1 4.44Å; F472-F475 WeakPolarHBondContact O-CB 3.37Å; F472-F475 PolarHBondContact O-N 3.17Å; F472-L476 HydrophobicContact CD2-CD1 4.3Å; F472-L476 HydrophobicContact CD2-CG 4.13Å; F472-L476 HydrophobicContact CE1-CD1 4.35Å; F472-L476 HydrophobicContact CE2-CD1 4.06Å; F472-L476 HydrophobicContact CE2-CD2 4.05Å; F472-L476 HydrophobicContact CE2-CG 3.87Å; F472-L476 HydrophobicContact CZ-CD1 4.08Å; F472-L476 HydrophobicContact CZ-CD2 4.37Å; F472-L476 HydrophobicContact CZ-CG 4.32Å; F472-L476 WeakPolarHBondContact O-CG 3.39Å; F472-L476 PolarHBondContact O-N 2.75Å; F472-F498 HydrophobicContact CB-CD2 3.73Å; F472-F498 HydrophobicContact CB-CE2 3.48Å; F472-F498 VanDerWaalsContact CB-CE2 3.48Å; F472-F498 HydrophobicContact CB-CG 4.49Å; F472-F498 HydrophobicContact CB-CZ 4.06Å; F472-F498 HydrophobicContact CD1-CE2 4.42Å; F472-F498 HydrophobicContact CD1-CZ 4.36Å; F472-F498 HydrophobicContact CD2-CD1 4.01Å; F472-F498 HydrophobicContact CD2-CD2 4.17Å; F472-F498 AromaticContact CD2-CE1 3.42Å; F472-F498 HydrophobicContact CD2-CE1 3.42Å; F472-F498 VanDerWaalsContact CD2-CE1 3.42Å; F472-F498 AromaticContact CD2-CE2 3.61Å; F472-F498 HydrophobicContact CD2-CE2 3.61Å; F472-F498 HydrophobicContact CD2-CG 4.36Å; F472-F498 AromaticContact CD2-CZ 3.2Å; F472-F498 HydrophobicContact CD2-CZ 3.2Å; F472-F498 AromaticContact CE2-CE1 3.77Å; F472-F498 HydrophobicContact CE2-CE1 3.77Å; F472-F498 HydrophobicContact CE2-CE2 4.47Å; F472-F498 AromaticContact CE2-CZ 3.67Å; F472-F498 HydrophobicContact CE2-CZ 3.67Å; F472-F498 HydrophobicContact CG-CD2 4.22Å; F472-F498 HydrophobicContact CG-CE1 4.27Å; F472-F498 AromaticContact CG-CE2 3.59Å; F472-F498 HydrophobicContact CG-CE2 3.59Å; F472-F498 AromaticContact CG-CZ 3.62Å; F472-F498 HydrophobicContact CG-CZ 3.62Å; F472-F498 HydrophobicContact CZ-CZ 4.42Å
473	S	97.3	Very high	95.2	Very high	21 Å²	21	66.3 Å²	66.3	15%	0.147	34%	0.339	C	S	.	.	H	α-helix	trans	-58.6	-48.2	171.9	-168.8	0	0	0	0	111.5	S469 F475 L476 D477	S469-S473 PolarHBondContact O-N 2.84Å; S473-F475 VanDerWaalsContact C-N 3.31Å; S473-F475 PolarHBondContact O-N 3.04Å; S473-L476 PolarHBondContact O-N 2.71Å; S473-D477 PolarHBondContact O-N 3.46Å
474	D	97.6	Very high	95.6	Very high	64 Å²	64	63 Å²	63	34%	0.342	33%	0.327	S	S	.	.	H	α-helix	trans	-61.6	-39.1	177	-168.6	63.6	0	0	0	111.8	M470 L476 D477 R478 H496	M470-D474 PolarHBondContact O-N 3.19Å; D474-L476 PolarHBondContact O-N 2.91Å; D474-D477 PolarHBondContact O-N 2.76Å; D474-R478 WeakPolarHBondContact O-CG 3.47Å; D474-R478 PolarHBondContact O-N 3.36Å; D474-R478 IonicContact OD2-CZ 2.92Å; D474-R478 IonicContact OD2-NE 3.99Å; D474-R478 PolarHBondContact OD2-NE 2.8Å; D474-R478 IonicContact OD2-NH2 3.73Å; D474-R478 PolarHBondContact OD2-NH2 2.96Å; D474-H496 IonicContact OD2-CD2 3.86Å; D474-H496 IonicContact OD2-CE1 2.92Å; D474-H496 IonicContact OD2-NE2 2.68Å; D474-H496 PolarHBondContact OD2-NE2 3.43Å
475	F	98.5	Very high	96.1	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-61	-45.5	176.1	-178.3	-88	0	0	0	111.9	L348 L352 L471 F472 S473 D477 R478 C479 L493 H496 F498 L499	L348-F475 HydrophobicContact CB-CZ 4.48Å; L348-F475 HydrophobicContact CD1-CD1 4.32Å; L348-F475 HydrophobicContact CD1-CE1 3.64Å; L348-F475 HydrophobicContact CD1-CZ 4.07Å; L352-F475 HydrophobicContact CD1-CE2 4.12Å; L352-F475 HydrophobicContact CD1-CZ 3.99Å; L471-F475 WeakPolarHBondContact O-CB 3.43Å; L471-F475 PolarHBondContact O-N 2.96Å; F472-F475 HydrophobicContact CD2-CB 4.48Å; F472-F475 HydrophobicContact CD2-CD1 4.44Å; F472-F475 HydrophobicContact CE2-CD1 4.44Å; F472-F475 WeakPolarHBondContact O-CB 3.37Å; F472-F475 PolarHBondContact O-N 3.17Å; S473-F475 VanDerWaalsContact C-N 3.31Å; S473-F475 PolarHBondContact O-N 3.04Å; F475-D477 VanDerWaalsContact C-N 3.35Å; F475-R478 PolarHBondContact O-N 2.62Å; F475-C479 VanDerWaalsContact CE1-SG 3.53Å; F475-C479 PolarHBondContact O-N 3.33Å; F475-C479 VanDerWaalsContact O-N 3.11Å; F475-C479 PolarHBondContact O-SG 3.02Å; F475-L493 HydrophobicContact CD2-CD2 3.99Å; F475-L493 HydrophobicContact CE2-CB 4.14Å; F475-L493 HydrophobicContact CE2-CD2 3.79Å; F475-L493 HydrophobicContact CE2-CG 4.41Å; F475-L493 HydrophobicContact CZ-CD2 4.35Å; F475-H496 HydrophobicContact CD2-CB 3.99Å; F475-H496 AromaticContact CD2-CG 3.8Å; F475-H496 AromaticContact CD2-ND1 3.7Å; F475-H496 HydrophobicContact CE2-CB 4.44Å; F475-F498 HydrophobicContact CB-CB 3.99Å; F475-F498 HydrophobicContact CB-CD1 3.81Å; F475-F498 HydrophobicContact CB-CG 4.06Å; F475-F498 AromaticContact CD1-CD1 3.99Å; F475-F498 HydrophobicContact CD1-CD1 3.99Å; F475-F498 HydrophobicContact CD1-CE1 4.25Å; F475-F498 HydrophobicContact CD2-CB 4.3Å; F475-F498 AromaticContact CD2-CD1 3.78Å; F475-F498 HydrophobicContact CD2-CD1 3.78Å; F475-F498 HydrophobicContact CD2-CG 4.5Å; F475-F498 HydrophobicContact CE2-CD1 4.35Å; F475-F498 HydrophobicContact CG-CB 4.37Å; F475-F498 AromaticContact CG-CD1 3.57Å; F475-F498 HydrophobicContact CG-CD1 3.57Å; F475-F498 HydrophobicContact CG-CE1 4.27Å; F475-F498 HydrophobicContact CG-CG 4.29Å; F475-L499 HydrophobicContact CD2-CD2 4.33Å; F475-L499 HydrophobicContact CD2-CG 4.46Å; F475-L499 HydrophobicContact CE2-CD1 4.14Å; F475-L499 HydrophobicContact CE2-CD2 3.8Å; F475-L499 HydrophobicContact CE2-CG 4Å; F475-L499 HydrophobicContact CZ-CD2 4.22Å
476	L	98.2	Very high	96.5	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-64.2	-39.9	176.7	-71.2	169.7	0	0	0	111.5	A432 L433 I462 L468 F472 S473 D474 R478 C479 L480	A432-L476 HydrophobicContact CB-CD2 3.67Å; L433-L476 HydrophobicContact CD2-CD1 3.93Å; L433-L476 HydrophobicContact CD2-CD2 4.11Å; L433-L476 HydrophobicContact CG-CD2 4.37Å; I462-L476 HydrophobicContact CD1-CB 4.26Å; I462-L476 HydrophobicContact CD1-CD1 3.95Å; L468-L476 HydrophobicContact CD1-CD1 3.92Å; F472-L476 HydrophobicContact CD2-CD1 4.3Å; F472-L476 HydrophobicContact CD2-CG 4.13Å; F472-L476 HydrophobicContact CE1-CD1 4.35Å; F472-L476 HydrophobicContact CE2-CD1 4.06Å; F472-L476 HydrophobicContact CE2-CD2 4.05Å; F472-L476 HydrophobicContact CE2-CG 3.87Å; F472-L476 HydrophobicContact CZ-CD1 4.08Å; F472-L476 HydrophobicContact CZ-CD2 4.37Å; F472-L476 HydrophobicContact CZ-CG 4.32Å; F472-L476 WeakPolarHBondContact O-CG 3.39Å; F472-L476 PolarHBondContact O-N 2.75Å; S473-L476 PolarHBondContact O-N 2.71Å; D474-L476 PolarHBondContact O-N 2.91Å; L476-R478 VanDerWaalsContact C-N 3.34Å; L476-R478 PolarHBondContact O-N 3.1Å; L476-C479 PolarHBondContact O-N 3.27Å; L476-L480 WeakPolarHBondContact O-CB 3.05Å; L476-L480 WeakPolarHBondContact O-CG 3.38Å; L476-L480 PolarHBondContact O-N 3.2Å
477	D	97.5	Very high	96.9	Very high	58 Å²	58	55 Å²	55	31%	0.31	29%	0.294	S	S	.	.	H	α-helix	trans	-62.3	-41.5	178.1	-69.9	1.8	0	0	0	111.7	K459 S473 D474 F475 C481	K459-D477 WeakPolarHBondContact CE-OD1 3.48Å; K459-D477 VanDerWaalsContact NZ-CG 3.31Å; K459-D477 IonicContact NZ-OD1 2.86Å; K459-D477 PolarHBondContact NZ-OD1 2.79Å; K459-D477 IonicContact NZ-OD2 2.75Å; S473-D477 PolarHBondContact O-N 3.46Å; D474-D477 PolarHBondContact O-N 2.76Å; F475-D477 VanDerWaalsContact C-N 3.35Å; D477-C481 PolarHBondContact O-N 2.88Å
478	R	98.4	Very high	97.2	Very high	117 Å²	117	51.6 Å²	51.6	44%	0.442	27%	0.27	S	S	.	.	H	α-helix	trans	-67.8	-32.7	174.9	-70.5	-177.6	-171.8	-123.9	-2.2	113.5	D474 F475 L476 R487 A488 L493	D474-R478 WeakPolarHBondContact O-CG 3.47Å; D474-R478 PolarHBondContact O-N 3.36Å; D474-R478 IonicContact OD2-CZ 2.92Å; D474-R478 IonicContact OD2-NE 3.99Å; D474-R478 PolarHBondContact OD2-NE 2.8Å; D474-R478 IonicContact OD2-NH2 3.73Å; D474-R478 PolarHBondContact OD2-NH2 2.96Å; F475-R478 PolarHBondContact O-N 2.62Å; L476-R478 VanDerWaalsContact C-N 3.34Å; L476-R478 PolarHBondContact O-N 3.1Å; R478-R487 WeakPolarHBondContact O-CG 3.38Å; R478-A488 HydrophobicContact CB-CB 4.05Å; R478-A488 PolarHBondContact O-N 3.45Å; R478-A488 VanDerWaalsContact O-N 3.17Å; R478-L493 HydrophobicContact CB-CD2 3.98Å
479	C	98.6	Very high	97.4	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-75.2	-43.7	175.9	-65.3	0	0	0	0	112.2	I425 F475 L476 C481 R487 L493	I425-C479 HydrophobicContact CG2-CB 4.31Å; F475-C479 VanDerWaalsContact CE1-SG 3.53Å; F475-C479 PolarHBondContact O-N 3.33Å; F475-C479 VanDerWaalsContact O-N 3.11Å; F475-C479 PolarHBondContact O-SG 3.02Å; L476-C479 PolarHBondContact O-N 3.27Å; C479-C481 VanDerWaalsContact C-N 3.34Å; C479-C481 PolarHBondContact O-N 3.2Å; C479-R487 VanDerWaalsContact O-CD 3.3Å; C479-R487 WeakPolarHBondContact O-CD 3.34Å; C479-R487 WeakPolarHBondContact O-CG 3.42Å; C479-L493 VanDerWaalsContact SG-CD1 3.56Å
480	L	98.1	Very high	97.5	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	-97.8	27.3	-173	-59.1	173.8	0	0	0	112.6	W426 I430 L433 K459 P460 L476 V482	W426-L480 HydrophobicContact CD2-CD2 4Å; W426-L480 HydrophobicContact CE3-CD2 4.3Å; W426-L480 HydrophobicContact CG-CD2 4.37Å; W426-L480 HydrophobicContact CZ2-CD2 4.38Å; W426-L480 HydrophobicContact CZ3-CB 4.39Å; W426-L480 WeakPolarHBondContact CZ3-O 3.48Å; I430-L480 HydrophobicContact CD1-CD2 3.73Å; I430-L480 HydrophobicContact CG1-CD2 4.07Å; L433-L480 HydrophobicContact CD1-CD1 3.87Å; L433-L480 HydrophobicContact CG-CD1 4.43Å; K459-L480 HydrophobicContact CD-CB 4.44Å; K459-L480 HydrophobicContact CG-CB 3.99Å; P460-L480 HydrophobicContact CG-CD1 4.26Å; L476-L480 WeakPolarHBondContact O-CB 3.05Å; L476-L480 WeakPolarHBondContact O-CG 3.38Å; L476-L480 PolarHBondContact O-N 3.2Å; L480-V482 PolarHBondContact O-N 2.89Å
481	C	97.3	Very high	97.6	Very high	35 Å²	35	44 Å²	44	24%	0.236	24%	0.237	C	C	.	.			trans	-69.2	125	172.1	-172.7	0	0	0	0	109.8	D477 C479 D483 R487	D477-C481 PolarHBondContact O-N 2.88Å; C479-C481 VanDerWaalsContact C-N 3.34Å; C479-C481 PolarHBondContact O-N 3.2Å; C481-D483 PolarHBondContact SG-O 3.33Å; C481-R487 HydrophobicContact CB-CB 3.92Å; C481-R487 HydrophobicContact CB-CG 4.21Å; C481-R487 PolarHBondContact O-NE 3.33Å; C481-R487 PolarHBondContact O-NH2 3.08Å; C481-R487 VanDerWaalsContact O-NH2 3.1Å
482	V	95.9	Very high	97.6	Very high	76 Å²	76	45.2 Å²	45.2	46%	0.461	24%	0.241	S	C	.	.	S	Bend	trans	-70.1	-37.4	-178.4	177.8	0	0	0	0	110.8	W426 K459 L480 V484	W426-V482 HydrophobicContact CH2-CG2 4.36Å; W426-V482 HydrophobicContact CZ3-CG2 4.27Å; K459-V482 HydrophobicContact CB-CG2 4.34Å; L480-V482 PolarHBondContact O-N 2.89Å; V482-V484 PolarHBondContact O-N 3.05Å
483	D	95.5	Very high	97.6	Very high	88 Å²	88	45.2 Å²	45.2	47%	0.471	24%	0.241	S	C	.	.	S	Bend	trans	-70.7	120.7	171.8	-166.4	-27.4	0	0	0	109.7	C481 D485 E486 R487	C481-D483 PolarHBondContact SG-O 3.33Å; D483-D485 VanDerWaalsContact C-N 3.32Å; D483-D485 PolarHBondContact OD1-N 2.92Å; D483-E486 HydrophobicContact CB-CB 4.14Å; D483-E486 HydrophobicContact CB-CG 4.18Å; D483-R487 WeakPolarHBondContact O-CB 3.44Å; D483-R487 PolarHBondContact O-N 3.36Å
484	V	95.3	Very high	97.7	Very high	30 Å²	30	46.2 Å²	46.2	18%	0.182	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-32.6	-176.4	-179.5	0	0	0	0	110.9	E412 K422 V482	E412-V484 HydrophobicContact CB-CG2 4.23Å; E412-V484 HydrophobicContact CG-CG2 3.94Å; K422-V484 HydrophobicContact CB-CG1 4.34Å; K422-V484 HydrophobicContact CD-CG1 4.18Å; K422-V484 WeakPolarHBondContact CD-O 3.48Å; K422-V484 WeakPolarHBondContact CE-O 3.4Å; K422-V484 PolarHBondContact NZ-O 3.25Å; V482-V484 PolarHBondContact O-N 3.05Å
485	D	95.4	Very high	97.7	Very high	129 Å²	129	50.5 Å²	50.5	69%	0.69	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-36.3	-177.9	-68.1	-33.7	0	0	0	110.3	K422 D483	K422-D485 PolarHBondContact NZ-O 2.74Å; D483-D485 VanDerWaalsContact C-N 3.32Å; D483-D485 PolarHBondContact OD1-N 2.92Å
486	E	97.3	Very high	97.7	Very high	144 Å²	144	50.7 Å²	50.7	67%	0.673	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-22.1	176.1	-61.1	-59.6	143.7	0	0	114.4	D483 A488	D483-E486 HydrophobicContact CB-CB 4.14Å; D483-E486 HydrophobicContact CB-CG 4.18Å; E486-A488 PolarHBondContact O-N 2.92Å
487	R	98.4	Very high	97.7	Very high	1 Å²	1	53.5 Å²	53.5	0%	0.004	28%	0.282	C	S	.	.	S	Bend	trans	-60.8	132.8	177.8	-169.9	-174	-55.6	154.1	5.5	110.5	E412 K422 I425 R478 C479 C481 D483	E412-R487 IonicContact OE1-CZ 3.42Å; E412-R487 IonicContact OE1-NH1 2.54Å; E412-R487 PolarHBondContact OE1-NH1 3.12Å; E412-R487 IonicContact OE1-NH2 3.69Å; E412-R487 PolarHBondContact OE1-NH2 2.8Å; E412-R487 IonicContact OE2-CZ 3.34Å; E412-R487 IonicContact OE2-NH1 3.76Å; E412-R487 IonicContact OE2-NH2 2.64Å; E412-R487 PolarHBondContact OE2-NH2 3.22Å; K422-R487 HydrophobicContact CD-CB 4.31Å; K422-R487 WeakPolarHBondContact CD-O 3.37Å; K422-R487 WeakPolarHBondContact CE-O 3.25Å; K422-R487 PolarHBondContact NZ-O 3.42Å; K422-R487 WeakPolarHBondContact O-CD 3.44Å; K422-R487 PolarHBondContact O-NH1 3.05Å; I425-R487 HydrophobicContact CG2-CG 4.29Å; R478-R487 WeakPolarHBondContact O-CG 3.38Å; C479-R487 VanDerWaalsContact O-CD 3.3Å; C479-R487 WeakPolarHBondContact O-CD 3.34Å; C479-R487 WeakPolarHBondContact O-CG 3.42Å; C481-R487 HydrophobicContact CB-CB 3.92Å; C481-R487 HydrophobicContact CB-CG 4.21Å; C481-R487 PolarHBondContact O-NE 3.33Å; C481-R487 PolarHBondContact O-NH2 3.08Å; C481-R487 VanDerWaalsContact O-NH2 3.1Å; D483-R487 WeakPolarHBondContact O-CB 3.44Å; D483-R487 PolarHBondContact O-N 3.36Å
488	A	98.5	Very high	97.8	Very high	7 Å²	7	50.8 Å²	50.8	6%	0.058	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-63.5	152.3	-177.5	0	0	0	0	0	112.5	I425 R478 E486 E492 L493	I425-A488 WeakPolarHBondContact CG2-O 3.33Å; R478-A488 HydrophobicContact CB-CB 4.05Å; R478-A488 PolarHBondContact O-N 3.45Å; R478-A488 VanDerWaalsContact O-N 3.17Å; E486-A488 PolarHBondContact O-N 2.92Å; A488-E492 HydrophobicContact CB-CB 4.33Å; A488-L493 HydrophobicContact CB-CD1 4.28Å; A488-L493 HydrophobicContact CB-CD2 3.81Å; A488-L493 HydrophobicContact CB-CG 3.7Å
489	T	98.6	Very high	97.8	Very high	27 Å²	27	45.9 Å²	45.9	17%	0.166	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-85.4	166.7	168.9	61.7	0	0	0	0	111.1	Y421 A491 E492 L493	Y421-T489 HydrophobicContact CE2-CG2 4.18Å; T489-A491 VanDerWaalsContact C-N 3.31Å; T489-A491 PolarHBondContact O-N 3.36Å; T489-E492 WeakPolarHBondContact CB-OE2 3.36Å; T489-E492 WeakPolarHBondContact CG2-OE2 3.21Å; T489-E492 PolarHBondContact N-OE2 2.82Å; T489-E492 PolarHBondContact O-N 3.22Å; T489-E492 VanDerWaalsContact OG1-CD 3.24Å; T489-E492 VanDerWaalsContact OG1-CG 3.27Å; T489-E492 WeakPolarHBondContact OG1-CG 3.4Å; T489-E492 PolarHBondContact OG1-N 3.19Å; T489-E492 PolarHBondContact OG1-OE2 2.85Å; T489-L493 WeakPolarHBondContact O-CG 3.5Å; T489-L493 PolarHBondContact O-N 3.02Å
490	A	98.6	Very high	97.7	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-58.8	-43.5	174.9	0	0	0	0	0	111.9	L352 L355 D356 I425 E492 L493 L494	L352-A490 HydrophobicContact CD2-CB 4.12Å; L355-A490 HydrophobicContact CB-CB 4.17Å; D356-A490 HydrophobicContact CB-CB 3.8Å; I425-A490 HydrophobicContact CD1-CB 3.99Å; A490-E492 PolarHBondContact O-N 3.45Å; A490-L493 PolarHBondContact O-N 3.43Å; A490-L494 WeakPolarHBondContact O-CG 3.32Å; A490-L494 PolarHBondContact O-N 3.3Å
491	A	98.4	Very high	97.5	Very high	45 Å²	45	55.1 Å²	55.1	37%	0.372	30%	0.296	S	S	.	.	H	α-helix	trans	-59.1	-43.3	176.9	0	0	0	0	0	113	D356 T489	D356-A491 WeakPolarHBondContact OD1-CB 3.06Å; D356-A491 PolarHBondContact OD1-N 3.2Å; T489-A491 VanDerWaalsContact C-N 3.31Å; T489-A491 PolarHBondContact O-N 3.36Å
492	E	98.5	Very high	97.5	Very high	107 Å²	107	55 Å²	55	50%	0.5	30%	0.297	S	S	.	.	H	α-helix	trans	-68.2	-42.1	177.6	-71.7	161.8	148.4	0	0	111.7	A488 T489 A490 L494 Q495	A488-E492 HydrophobicContact CB-CB 4.33Å; T489-E492 WeakPolarHBondContact CB-OE2 3.36Å; T489-E492 WeakPolarHBondContact CG2-OE2 3.21Å; T489-E492 PolarHBondContact N-OE2 2.82Å; T489-E492 PolarHBondContact O-N 3.22Å; T489-E492 VanDerWaalsContact OG1-CD 3.24Å; T489-E492 VanDerWaalsContact OG1-CG 3.27Å; T489-E492 WeakPolarHBondContact OG1-CG 3.4Å; T489-E492 PolarHBondContact OG1-N 3.19Å; T489-E492 PolarHBondContact OG1-OE2 2.85Å; A490-E492 PolarHBondContact O-N 3.45Å; E492-L494 VanDerWaalsContact C-N 3.32Å; E492-L494 PolarHBondContact O-N 2.84Å; E492-Q495 PolarHBondContact O-N 3.26Å; E492-Q495 VanDerWaalsContact O-N 3.13Å
493	L	98.7	Very high	97.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.4	-32.8	177.7	-72.4	172.5	0	0	0	112.6	L352 I425 F475 R478 C479 A488 T489 A490 Q495 H496 L499	L352-L493 HydrophobicContact CD1-CB 3.78Å; L352-L493 HydrophobicContact CD2-CB 3.84Å; L352-L493 HydrophobicContact CD2-CD1 3.95Å; I425-L493 HydrophobicContact CD1-CD1 4.26Å; I425-L493 HydrophobicContact CG2-CD1 3.5Å; F475-L493 HydrophobicContact CD2-CD2 3.99Å; F475-L493 HydrophobicContact CE2-CB 4.14Å; F475-L493 HydrophobicContact CE2-CD2 3.79Å; F475-L493 HydrophobicContact CE2-CG 4.41Å; F475-L493 HydrophobicContact CZ-CD2 4.35Å; R478-L493 HydrophobicContact CB-CD2 3.98Å; C479-L493 VanDerWaalsContact SG-CD1 3.56Å; A488-L493 HydrophobicContact CB-CD1 4.28Å; A488-L493 HydrophobicContact CB-CD2 3.81Å; A488-L493 HydrophobicContact CB-CG 3.7Å; T489-L493 WeakPolarHBondContact O-CG 3.5Å; T489-L493 PolarHBondContact O-N 3.02Å; A490-L493 PolarHBondContact O-N 3.43Å; L493-Q495 PolarHBondContact O-N 3.37Å; L493-H496 WeakPolarHBondContact O-CB 3.42Å; L493-H496 PolarHBondContact O-N 2.76Å; L493-L499 WeakPolarHBondContact O-CD1 3.48Å
494	L	98.5	Very high	97.6	Very high	41 Å²	41	51.7 Å²	51.7	22%	0.215	28%	0.283	C	S	.	.	H	α-helix	trans	-60.4	-23.6	173.4	-78.7	169.3	0	0	0	113	L352 K353 D356 A490 E492	L352-L494 HydrophobicContact CB-CD2 3.63Å; L352-L494 HydrophobicContact CB-CG 3.9Å; K353-L494 HydrophobicContact CG-CD2 4Å; D356-L494 HydrophobicContact CB-CD1 3.86Å; A490-L494 WeakPolarHBondContact O-CG 3.32Å; A490-L494 PolarHBondContact O-N 3.3Å; E492-L494 VanDerWaalsContact C-N 3.32Å; E492-L494 PolarHBondContact O-N 2.84Å
495	Q	98.2	Very high	97.7	Very high	154 Å²	154	52.5 Å²	52.5	72%	0.72	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-1.1	175.2	-56.7	-54.8	-41.8	0	0	113.4	E492 L493	E492-Q495 PolarHBondContact O-N 3.26Å; E492-Q495 VanDerWaalsContact O-N 3.13Å; L493-Q495 PolarHBondContact O-N 3.37Å
496	H	98.6	Very high	97.8	Very high	5 Å²	5	50.1 Å²	50.1	2%	0.023	28%	0.28	C	S	.	.			trans	-68.1	134.9	-173.8	-164.7	-90.4	0	0	0	112.1	L471 D474 F475 L493 F498 L499	L471-H496 PolarHBondContact O-CE1 3.23Å; D474-H496 IonicContact OD2-CD2 3.86Å; D474-H496 IonicContact OD2-CE1 2.92Å; D474-H496 IonicContact OD2-NE2 2.68Å; D474-H496 PolarHBondContact OD2-NE2 3.43Å; F475-H496 HydrophobicContact CD2-CB 3.99Å; F475-H496 AromaticContact CD2-CG 3.8Å; F475-H496 AromaticContact CD2-ND1 3.7Å; F475-H496 HydrophobicContact CE2-CB 4.44Å; L493-H496 WeakPolarHBondContact O-CB 3.42Å; L493-H496 PolarHBondContact O-N 2.76Å; H496-F498 WeakPolarHBondContact ND1-CB 3.43Å; H496-F498 PolarHBondContact ND1-N 3.38Å; H496-F498 PolarHBondContact O-N 3.41Å; H496-F498 VanDerWaalsContact O-N 3.12Å; H496-L499 PolarHBondContact O-N 3.17Å
497	P	98.1	Very high	97.8	Very high	59 Å²	59	49.9 Å²	49.9	38%	0.383	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-57.8	-30.7	-177.2	-26.5	34.2	0	0	0	114.7	L471 L499 Q500	L471-P497 HydrophobicContact CD1-CB 4.34Å; L471-P497 HydrophobicContact CD2-CB 4.06Å; P497-L499 PolarHBondContact O-N 2.91Å; P497-Q500 WeakPolarHBondContact O-CB 3.36Å; P497-Q500 PolarHBondContact O-N 3.31Å
498	F	98.4	Very high	97.7	Very high	1 Å²	1	50.1 Å²	50.1	0%	0.004	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-51.8	-42.1	173.1	175.8	-120	0	0	0	112.4	E341 A345 L348 L471 F472 F475 H496 Q500 C501	E341-F498 HydrophobicContact CB-CE2 4.12Å; A345-F498 HydrophobicContact CB-CD1 4.42Å; A345-F498 HydrophobicContact CB-CE1 3.86Å; A345-F498 HydrophobicContact CB-CE2 4.3Å; A345-F498 HydrophobicContact CB-CZ 3.78Å; L348-F498 HydrophobicContact CD1-CE1 3.84Å; L471-F498 HydrophobicContact CB-CB 4.15Å; L471-F498 HydrophobicContact CB-CD2 4.44Å; F472-F498 HydrophobicContact CB-CD2 3.73Å; F472-F498 HydrophobicContact CB-CE2 3.48Å; F472-F498 VanDerWaalsContact CB-CE2 3.48Å; F472-F498 HydrophobicContact CB-CG 4.49Å; F472-F498 HydrophobicContact CB-CZ 4.06Å; F472-F498 HydrophobicContact CD1-CE2 4.42Å; F472-F498 HydrophobicContact CD1-CZ 4.36Å; F472-F498 HydrophobicContact CD2-CD1 4.01Å; F472-F498 HydrophobicContact CD2-CD2 4.17Å; F472-F498 AromaticContact CD2-CE1 3.42Å; F472-F498 HydrophobicContact CD2-CE1 3.42Å; F472-F498 VanDerWaalsContact CD2-CE1 3.42Å; F472-F498 AromaticContact CD2-CE2 3.61Å; F472-F498 HydrophobicContact CD2-CE2 3.61Å; F472-F498 HydrophobicContact CD2-CG 4.36Å; F472-F498 AromaticContact CD2-CZ 3.2Å; F472-F498 HydrophobicContact CD2-CZ 3.2Å; F472-F498 AromaticContact CE2-CE1 3.77Å; F472-F498 HydrophobicContact CE2-CE1 3.77Å; F472-F498 HydrophobicContact CE2-CE2 4.47Å; F472-F498 AromaticContact CE2-CZ 3.67Å; F472-F498 HydrophobicContact CE2-CZ 3.67Å; F472-F498 HydrophobicContact CG-CD2 4.22Å; F472-F498 HydrophobicContact CG-CE1 4.27Å; F472-F498 AromaticContact CG-CE2 3.59Å; F472-F498 HydrophobicContact CG-CE2 3.59Å; F472-F498 AromaticContact CG-CZ 3.62Å; F472-F498 HydrophobicContact CG-CZ 3.62Å; F472-F498 HydrophobicContact CZ-CZ 4.42Å; F475-F498 HydrophobicContact CB-CB 3.99Å; F475-F498 HydrophobicContact CB-CD1 3.81Å; F475-F498 HydrophobicContact CB-CG 4.06Å; F475-F498 AromaticContact CD1-CD1 3.99Å; F475-F498 HydrophobicContact CD1-CD1 3.99Å; F475-F498 HydrophobicContact CD1-CE1 4.25Å; F475-F498 HydrophobicContact CD2-CB 4.3Å; F475-F498 AromaticContact CD2-CD1 3.78Å; F475-F498 HydrophobicContact CD2-CD1 3.78Å; F475-F498 HydrophobicContact CD2-CG 4.5Å; F475-F498 HydrophobicContact CE2-CD1 4.35Å; F475-F498 HydrophobicContact CG-CB 4.37Å; F475-F498 AromaticContact CG-CD1 3.57Å; F475-F498 HydrophobicContact CG-CD1 3.57Å; F475-F498 HydrophobicContact CG-CE1 4.27Å; F475-F498 HydrophobicContact CG-CG 4.29Å; H496-F498 WeakPolarHBondContact ND1-CB 3.43Å; H496-F498 PolarHBondContact ND1-N 3.38Å; H496-F498 PolarHBondContact O-N 3.41Å; H496-F498 VanDerWaalsContact O-N 3.12Å; F498-Q500 PolarHBondContact O-N 2.85Å; F498-C501 PolarHBondContact O-N 3.42Å; F498-C501 PolarHBondContact O-SG 2.93Å
499	L	98.2	Very high	97.7	Very high	14 Å²	14	50.9 Å²	50.9	7%	0.073	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-72.8	-15.7	-176.7	-58.6	-171.1	0	0	0	113.1	A345 L348 V349 L352 F475 L493 H496 P497 C501 A502	A345-L499 HydrophobicContact CB-CD2 4.37Å; L348-L499 HydrophobicContact CB-CD2 4.18Å; V349-L499 HydrophobicContact CG2-CB 3.73Å; V349-L499 HydrophobicContact CG2-CD1 3.93Å; V349-L499 HydrophobicContact CG2-CD2 4.03Å; V349-L499 HydrophobicContact CG2-CG 4.1Å; L352-L499 HydrophobicContact CD1-CD1 3.52Å; F475-L499 HydrophobicContact CD2-CD2 4.33Å; F475-L499 HydrophobicContact CD2-CG 4.46Å; F475-L499 HydrophobicContact CE2-CD1 4.14Å; F475-L499 HydrophobicContact CE2-CD2 3.8Å; F475-L499 HydrophobicContact CE2-CG 4Å; F475-L499 HydrophobicContact CZ-CD2 4.22Å; L493-L499 WeakPolarHBondContact O-CD1 3.48Å; H496-L499 PolarHBondContact O-N 3.17Å; P497-L499 PolarHBondContact O-N 2.91Å; L499-C501 PolarHBondContact O-N 2.89Å; L499-A502 WeakPolarHBondContact O-CB 3.48Å; L499-A502 PolarHBondContact O-N 3.42Å
500	Q	96.4	Very high	97.6	Very high	159 Å²	159	53.4 Å²	53.4	74%	0.743	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-69.1	-19.5	174.5	-57.5	179.7	7.3	0	0	112.3	P497 F498 A502	P497-Q500 WeakPolarHBondContact O-CB 3.36Å; P497-Q500 PolarHBondContact O-N 3.31Å; F498-Q500 PolarHBondContact O-N 2.85Å; Q500-A502 VanDerWaalsContact C-N 3.3Å
501	C	94.5	Very high	97.5	Very high	34 Å²	34	56.5 Å²	56.5	23%	0.23	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-84.9	-3.3	176.2	85.8	0	0	0	0	113.8	R342 F498 L499 A503	R342-C501 HydrophobicContact CG-CB 4.5Å; R342-C501 WeakPolarHBondContact CG-O 3.45Å; R342-C501 PolarHBondContact NH1-O 3.13Å; F498-C501 PolarHBondContact O-N 3.42Å; F498-C501 PolarHBondContact O-SG 2.93Å; L499-C501 PolarHBondContact O-N 2.89Å; C501-A503 PolarHBondContact O-N 2.88Å
502	A	97.5	Very high	97.4	Very high	33 Å²	33	54.5 Å²	54.5	27%	0.273	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-50.7	130.3	-175.3	0	0	0	0	0	112.2	A345 C346 V349 L499 Q500	A345-A502 HydrophobicContact CB-CB 3.99Å; C346-A502 HydrophobicContact CB-CB 4.09Å; V349-A502 HydrophobicContact CG2-CB 4.15Å; L499-A502 WeakPolarHBondContact O-CB 3.48Å; L499-A502 PolarHBondContact O-N 3.42Å; Q500-A502 VanDerWaalsContact C-N 3.3Å
503	A	96.2	Very high	97.3	Very high	10 Å²	10	54.6 Å²	54.6	8%	0.083	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-68.3	155.5	173.6	0	0	0	0	0	111.1	R342 C346 C501 R507	R342-A503 HydrophobicContact CB-CB 4.08Å; R342-A503 PolarHBondContact O-N 2.97Å; C346-A503 WeakPolarHBondContact CB-O 3.19Å; C501-A503 PolarHBondContact O-N 2.88Å; A503-R507 HydrophobicContact CB-CB 4.01Å; A503-R507 HydrophobicContact CB-CG 4.02Å
504	P	97.5	Very high	97.2	Very high	85 Å²	85	56.5 Å²	56.5	55%	0.552	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-58.1	141	163.2	-21.5	32.8	0	0	0	110.5	S506 R507	P504-S506 PolarHBondContact O-N 3.04Å; P504-R507 VanDerWaalsContact O-CB 3.27Å; P504-R507 WeakPolarHBondContact O-CB 3.5Å; P504-R507 PolarHBondContact O-N 2.83Å
505	L	97.4	Very high	97	Very high	47 Å²	47	54.7 Å²	54.7	25%	0.246	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-54.5	-27.3	-179.9	-68.7	-179	0	0	0	113.8	C346 E350 G379 V381 R507 L508	C346-L505 HydrophobicContact CB-CD2 4.2Å; E350-L505 HydrophobicContact CG-CD1 4.15Å; E350-L505 HydrophobicContact CG-CD2 3.96Å; G379-L505 WeakPolarHBondContact O-CB 3.5Å; V381-L505 HydrophobicContact CG2-CD2 3.95Å; L505-R507 PolarHBondContact O-N 2.72Å; L505-L508 HydrophobicContact CD2-CD1 4.2Å; L505-L508 WeakPolarHBondContact O-CB 3.48Å; L505-L508 PolarHBondContact O-N 3.28Å
506	S	97.2	Very high	96.7	Very high	78 Å²	78	50.9 Å²	50.9	55%	0.545	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-57.8	-19.8	174.1	59.8	0	0	0	0	113.9	P504 L508 V509	P504-S506 PolarHBondContact O-N 3.04Å; S506-L508 VanDerWaalsContact C-N 3.27Å; S506-L508 PolarHBondContact O-N 3.32Å; S506-V509 WeakPolarHBondContact O-CB 3.35Å; S506-V509 PolarHBondContact O-N 3.16Å
507	R	96.8	Very high	96.4	Very high	140 Å²	140	56.1 Å²	56.1	53%	0.528	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-71.4	-17.6	173.7	-72.3	-89	-174.2	106.1	-0.2	113.5	A503 P504 L505	A503-R507 HydrophobicContact CB-CB 4.01Å; A503-R507 HydrophobicContact CB-CG 4.02Å; P504-R507 VanDerWaalsContact O-CB 3.27Å; P504-R507 WeakPolarHBondContact O-CB 3.5Å; P504-R507 PolarHBondContact O-N 2.83Å; L505-R507 PolarHBondContact O-N 2.72Å
508	L	97.2	Very high	96.1	Very high	6 Å²	6	56.2 Å²	56.2	3%	0.031	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-26.2	173.5	-59.9	177.5	0	0	0	112.2	Q343 V347 V381 L505 S506 Y511 I512	Q343-L508 HydrophobicContact CB-CD2 4.06Å; Q343-L508 HydrophobicContact CG-CD2 4.36Å; V347-L508 HydrophobicContact CG2-CD1 3.84Å; V347-L508 HydrophobicContact CG2-CD2 4.25Å; V381-L508 HydrophobicContact CG2-CD1 3.96Å; L505-L508 HydrophobicContact CD2-CD1 4.2Å; L505-L508 WeakPolarHBondContact O-CB 3.48Å; L505-L508 PolarHBondContact O-N 3.28Å; S506-L508 VanDerWaalsContact C-N 3.27Å; S506-L508 PolarHBondContact O-N 3.32Å; L508-Y511 WeakPolarHBondContact O-CB 3.25Å; L508-Y511 PolarHBondContact O-N 3.38Å; L508-I512 HydrophobicContact CB-CD1 3.98Å; L508-I512 WeakPolarHBondContact O-CG1 3.31Å; L508-I512 PolarHBondContact O-N 2.91Å
509	V	97.9	Very high	95.6	Very high	23 Å²	23	60 Å²	60	14%	0.139	31%	0.314	C	S	.	.	H	α-helix	trans	-53.9	-43.7	-173.5	176.2	0	0	0	0	113.8	L377 D378 S506 Y511 I512 K513	L377-V509 WeakPolarHBondContact O-CG2 3.31Å; D378-V509 VanDerWaalsContact C-CG2 3.5Å; S506-V509 WeakPolarHBondContact O-CB 3.35Å; S506-V509 PolarHBondContact O-N 3.16Å; V509-Y511 VanDerWaalsContact C-N 3.29Å; V509-Y511 PolarHBondContact O-N 3.08Å; V509-I512 PolarHBondContact O-N 3.49Å; V509-K513 HydrophobicContact CG1-CD 3.91Å; V509-K513 HydrophobicContact CG1-CG 4.3Å; V509-K513 WeakPolarHBondContact O-CB 3.36Å; V509-K513 WeakPolarHBondContact O-CG 3.49Å; V509-K513 PolarHBondContact O-N 3.22Å
510	P	97	Very high	95	Very high	80 Å²	80	63.6 Å²	63.6	52%	0.519	33%	0.332	S	S	.	.	H	α-helix	trans	-60.7	-37.2	177.2	-24.5	35.8	0	0	0	113.4	A514	P510-A514 VanDerWaalsContact O-CB 3.32Å; P510-A514 WeakPolarHBondContact O-CB 3.39Å; P510-A514 PolarHBondContact O-N 2.83Å
511	Y	97	Very high	94.6	Very high	66 Å²	66	62 Å²	62	26%	0.259	32%	0.323	S	S	.	.	H	α-helix	trans	-71.4	-46.2	-179.1	-65.1	-103.8	0	0	0	110.6	T337 I338 L339 Q343 L508 V509 K513 A514 V515	T337-Y511 HydrophobicContact CG2-CD1 4.07Å; T337-Y511 WeakPolarHBondContact OG1-CD1 3.48Å; I338-Y511 WeakPolarHBondContact O-CE1 3.22Å; L339-Y511 HydrophobicContact CD2-CD1 3.87Å; L339-Y511 HydrophobicContact CD2-CE1 4.14Å; L339-Y511 HydrophobicContact CD2-CG 4.19Å; Q343-Y511 PolarHBondContact NE2-OH 3.48Å; Q343-Y511 VanDerWaalsContact NE2-OH 3.1Å; Q343-Y511 PolarHBondContact OE1-OH 3.34Å; L508-Y511 WeakPolarHBondContact O-CB 3.25Å; L508-Y511 PolarHBondContact O-N 3.38Å; V509-Y511 VanDerWaalsContact C-N 3.29Å; V509-Y511 PolarHBondContact O-N 3.08Å; Y511-K513 VanDerWaalsContact C-N 3.33Å; Y511-K513 PolarHBondContact O-N 3.37Å; Y511-A514 PolarHBondContact O-N 2.87Å; Y511-V515 VanDerWaalsContact O-CG2 3.27Å; Y511-V515 WeakPolarHBondContact O-CG2 3.29Å; Y511-V515 PolarHBondContact O-N 3.15Å
512	I	96.7	Very high	94.2	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-57	-47.9	174.4	-63.3	165.7	0	0	0	110.2	V333 L375 G376 L377 L508 V509 A514 V515 K516	V333-I512 HydrophobicContact CG2-CG1 4.34Å; L375-I512 HydrophobicContact CB-CD1 3.96Å; L375-I512 HydrophobicContact CB-CG1 4.39Å; L375-I512 HydrophobicContact CD1-CD1 4.1Å; L375-I512 HydrophobicContact CD1-CG1 3.9Å; G376-I512 WeakPolarHBondContact O-CD1 3.38Å; L377-I512 HydrophobicContact CD2-CG2 4.06Å; L508-I512 HydrophobicContact CB-CD1 3.98Å; L508-I512 WeakPolarHBondContact O-CG1 3.31Å; L508-I512 PolarHBondContact O-N 2.91Å; V509-I512 PolarHBondContact O-N 3.49Å; I512-A514 PolarHBondContact O-N 2.95Å; I512-V515 PolarHBondContact O-N 3.37Å; I512-K516 WeakPolarHBondContact O-CB 3.42Å; I512-K516 PolarHBondContact O-N 3.08Å
513	K	96.3	Very high	93.3	Very high	110 Å²	110	68.7 Å²	68.7	48%	0.478	34%	0.342	S	S	.	.	H	α-helix	trans	-63.5	-41.3	177.7	-74.3	179.8	178.5	179	0	112.3	V509 Y511 K516 Q517	V509-K513 HydrophobicContact CG1-CD 3.91Å; V509-K513 HydrophobicContact CG1-CG 4.3Å; V509-K513 WeakPolarHBondContact O-CB 3.36Å; V509-K513 WeakPolarHBondContact O-CG 3.49Å; V509-K513 PolarHBondContact O-N 3.22Å; Y511-K513 VanDerWaalsContact C-N 3.33Å; Y511-K513 PolarHBondContact O-N 3.37Å; K513-K516 PolarHBondContact O-N 2.87Å; K513-Q517 WeakPolarHBondContact O-CB 3.42Å; K513-Q517 VanDerWaalsContact O-CG 3.27Å; K513-Q517 WeakPolarHBondContact O-CG 3.36Å; K513-Q517 PolarHBondContact O-N 3.34Å
514	A	95	Very high	92.4	Very high	39 Å²	39	73.2 Å²	73.2	32%	0.322	37%	0.365	S	S	.	.	H	α-helix	trans	-62.4	-46.5	178.1	0	0	0	0	0	111.7	P510 Y511 I512 Q517 L518	P510-A514 VanDerWaalsContact O-CB 3.32Å; P510-A514 WeakPolarHBondContact O-CB 3.39Å; P510-A514 PolarHBondContact O-N 2.83Å; Y511-A514 PolarHBondContact O-N 2.87Å; I512-A514 PolarHBondContact O-N 2.95Å; A514-Q517 PolarHBondContact O-N 3.24Å; A514-L518 WeakPolarHBondContact O-CG 3.33Å; A514-L518 PolarHBondContact O-N 3.49Å
515	V	94.3	Very high	91.1	Very high	4 Å²	4	75.3 Å²	75.3	2%	0.024	37%	0.367	C	S	.	.	H	α-helix	trans	-62.8	-44.2	177.2	174.5	0	0	0	0	111.3	E332 V333 E336 T337 Y511 I512 Q517 L518 K519	E332-V515 HydrophobicContact CB-CG1 3.74Å; E332-V515 WeakPolarHBondContact O-CG1 3.26Å; V333-V515 HydrophobicContact CG2-CG2 4.3Å; E336-V515 HydrophobicContact CB-CG2 3.99Å; T337-V515 HydrophobicContact CG2-CG2 3.77Å; Y511-V515 VanDerWaalsContact O-CG2 3.27Å; Y511-V515 WeakPolarHBondContact O-CG2 3.29Å; Y511-V515 PolarHBondContact O-N 3.15Å; I512-V515 PolarHBondContact O-N 3.37Å; V515-Q517 VanDerWaalsContact C-N 3.34Å; V515-Q517 PolarHBondContact O-N 3.02Å; V515-L518 PolarHBondContact O-N 2.92Å; V515-K519 PolarHBondContact O-N 3.28Å
516	K	92.8	Very high	89.5	Confident	74 Å²	74	77.5 Å²	77.5	32%	0.322	38%	0.382	S	S	.	.	H	α-helix	trans	-59.3	-43.3	175.6	-169.1	167.6	-177.4	165.9	0	111.7	E326 L377 I512 K513 K519 L520	E326-K516 PolarHBondContact O-NZ 3.44Å; E326-K516 IonicContact OE2-NZ 3.2Å; E326-K516 PolarHBondContact OE2-NZ 3.18Å; L377-K516 HydrophobicContact CD2-CD 4.11Å; I512-K516 WeakPolarHBondContact O-CB 3.42Å; I512-K516 PolarHBondContact O-N 3.08Å; K513-K516 PolarHBondContact O-N 2.87Å; K516-K519 PolarHBondContact O-N 3.5Å; K516-L520 WeakPolarHBondContact O-CG 3.29Å; K516-L520 PolarHBondContact O-N 3.32Å; K516-L520 VanDerWaalsContact O-N 3.1Å
517	Q	92.4	Very high	87.9	Confident	114 Å²	114	78.2 Å²	78.2	53%	0.533	38%	0.383	S	S	.	.	H	α-helix	trans	-64.9	-39.9	175.5	-73.2	173.2	6.5	0	0	112.7	K513 A514 V515 K519 L520 K521	K513-Q517 WeakPolarHBondContact O-CB 3.42Å; K513-Q517 VanDerWaalsContact O-CG 3.27Å; K513-Q517 WeakPolarHBondContact O-CG 3.36Å; K513-Q517 PolarHBondContact O-N 3.34Å; A514-Q517 PolarHBondContact O-N 3.24Å; V515-Q517 VanDerWaalsContact C-N 3.34Å; V515-Q517 PolarHBondContact O-N 3.02Å; Q517-K519 VanDerWaalsContact C-N 3.33Å; Q517-L520 PolarHBondContact O-N 3.38Å; Q517-K521 WeakPolarHBondContact O-CG 3.31Å; Q517-K521 PolarHBondContact O-N 3.47Å
518	L	91.2	Very high	86.2	Confident	62 Å²	62	75 Å²	75	33%	0.325	38%	0.38	S	S	.	.	H	α-helix	trans	-62.6	-41.1	176	-73.9	170.9	0	0	0	111.5	A514 V515 K521 R522	A514-L518 WeakPolarHBondContact O-CG 3.33Å; A514-L518 PolarHBondContact O-N 3.49Å; V515-L518 PolarHBondContact O-N 2.92Å; L518-K521 PolarHBondContact O-N 2.89Å; L518-R522 WeakPolarHBondContact O-CG 3.37Å; L518-R522 PolarHBondContact O-N 3.44Å
519	K	87.6	Confident	84.3	Confident	80 Å²	80	79.6 Å²	79.6	35%	0.348	41%	0.408	S	S	.	.	H	α-helix	trans	-63.3	-45.5	175.9	-77.5	-175.7	157.6	-158.2	0	113.1	E332 V515 K516 Q517 K521 R522 Q523	E332-K519 VanDerWaalsContact CD-CE 3.42Å; E332-K519 IonicContact OE1-NZ 2.69Å; E332-K519 PolarHBondContact OE1-NZ 3.47Å; E332-K519 WeakPolarHBondContact OE2-CE 3.49Å; E332-K519 IonicContact OE2-NZ 2.84Å; E332-K519 PolarHBondContact OE2-NZ 2.99Å; V515-K519 PolarHBondContact O-N 3.28Å; K516-K519 PolarHBondContact O-N 3.5Å; Q517-K519 VanDerWaalsContact C-N 3.33Å; K519-K521 PolarHBondContact O-N 3.42Å; K519-R522 PolarHBondContact O-N 3.23Å; K519-Q523 WeakPolarHBondContact O-CG 3.3Å; K519-Q523 PolarHBondContact O-N 3.28Å
520	L	87.2	Confident	82	Confident	90 Å²	90	83.9 Å²	83.9	47%	0.471	43%	0.434	S	S	.	.	H	α-helix	trans	-59	-47.1	176.6	-70.9	167.9	0	0	0	111.1	K516 Q517 R522 Q523 D524	K516-L520 WeakPolarHBondContact O-CG 3.29Å; K516-L520 PolarHBondContact O-N 3.32Å; K516-L520 VanDerWaalsContact O-N 3.1Å; Q517-L520 PolarHBondContact O-N 3.38Å; L520-R522 VanDerWaalsContact C-N 3.3Å; L520-R522 PolarHBondContact O-N 3.06Å; L520-Q523 PolarHBondContact O-N 2.83Å; L520-Q523 VanDerWaalsContact O-N 3.14Å; L520-D524 PolarHBondContact O-N 3.23Å
521	K	88	Confident	80.1	Confident	125 Å²	125	86.7 Å²	86.7	54%	0.543	44%	0.443	S	S	.	.	H	α-helix	trans	-59.5	-38.2	176.5	-72.3	177.4	179.7	-178.3	0	113.1	Q517 L518 K519 Q525	Q517-K521 WeakPolarHBondContact O-CG 3.31Å; Q517-K521 PolarHBondContact O-N 3.47Å; L518-K521 PolarHBondContact O-N 2.89Å; K519-K521 PolarHBondContact O-N 3.42Å; K521-Q525 WeakPolarHBondContact O-CG 3.32Å; K521-Q525 PolarHBondContact O-N 3.05Å; K521-Q525 VanDerWaalsContact O-N 3.14Å
522	R	85.9	Confident	77.8	Confident	84 Å²	84	90.8 Å²	90.8	32%	0.317	47%	0.465	S	S	.	.	H	α-helix	trans	-68.1	-38.8	176.9	-73.5	175.9	-177.5	163.2	7.3	111.8	F169 E336 L518 K519 L520 Q525 T526	F169-R522 VanDerWaalsContact CZ-CZ 3.48Å; E336-R522 VanDerWaalsContact CD-NH2 3.32Å; E336-R522 IonicContact OE1-CZ 2.94Å; E336-R522 VanDerWaalsContact OE1-CZ 3.23Å; E336-R522 IonicContact OE1-NH1 3.1Å; E336-R522 PolarHBondContact OE1-NH1 3.41Å; E336-R522 IonicContact OE1-NH2 3.23Å; E336-R522 PolarHBondContact OE1-NH2 3.46Å; E336-R522 IonicContact OE2-NH2 2.6Å; E336-R522 PolarHBondContact OE2-NH2 2.9Å; E336-R522 VanDerWaalsContact OE2-NH2 3.1Å; L518-R522 WeakPolarHBondContact O-CG 3.37Å; L518-R522 PolarHBondContact O-N 3.44Å; K519-R522 PolarHBondContact O-N 3.23Å; L520-R522 VanDerWaalsContact C-N 3.3Å; L520-R522 PolarHBondContact O-N 3.06Å; R522-Q525 PolarHBondContact O-N 3.17Å; R522-T526 PolarHBondContact O-N 3.37Å; R522-T526 VanDerWaalsContact O-N 3.11Å; R522-T526 PolarHBondContact O-OG1 3.31Å
523	Q	78.1	Confident	75	Confident	124 Å²	124	95.2 Å²	95.2	58%	0.579	50%	0.496	S	S	*	.	H	α-helix	trans	-63.6	-43.7	175.8	-72.1	175.5	-12.1	0	0	111.3	K519 L520 Q525 T526 T527	K519-Q523 WeakPolarHBondContact O-CG 3.3Å; K519-Q523 PolarHBondContact O-N 3.28Å; L520-Q523 PolarHBondContact O-N 2.83Å; L520-Q523 VanDerWaalsContact O-N 3.14Å; Q523-Q525 PolarHBondContact O-N 3.32Å; Q523-T526 PolarHBondContact O-N 3.14Å; Q523-T527 PolarHBondContact O-N 3.47Å; Q523-T527 VanDerWaalsContact O-N 3.14Å; Q523-T527 PolarHBondContact O-OG1 3.22Å
524	D	76	Confident	72.4	Confident	105 Å²	105	95.3 Å²	95.3	56%	0.561	51%	0.508	S	S	*	.	H	α-helix	trans	-64.3	-38.9	178.2	-65.9	-23.7	0	0	0	112.9	L520 T527 T528	L520-D524 PolarHBondContact O-N 3.23Å; D524-T527 PolarHBondContact O-N 2.96Å; D524-T528 PolarHBondContact O-N 2.91Å; D524-T528 PolarHBondContact O-OG1 3.16Å
525	Q	70.3	Confident	70.4	Confident	129 Å²	129	99.6 Å²	99.6	60%	0.603	53%	0.532	S	S	*	.	H	α-helix	trans	-68.2	-35.9	177.1	-73.9	177.4	10.4	0	0	112.8	K521 R522 Q523 T527 T528 T529	K521-Q525 WeakPolarHBondContact O-CG 3.32Å; K521-Q525 PolarHBondContact O-N 3.05Å; K521-Q525 VanDerWaalsContact O-N 3.14Å; R522-Q525 PolarHBondContact O-N 3.17Å; Q523-Q525 PolarHBondContact O-N 3.32Å; Q525-T527 VanDerWaalsContact C-N 3.34Å; Q525-T528 PolarHBondContact O-N 3.42Å; Q525-T529 PolarHBondContact O-N 3.22Å; Q525-T529 PolarHBondContact O-OG1 3.29Å
526	T	65.2	Low	68.2	Low	93 Å²	93	104.3 Å²	104.3	57%	0.571	57%	0.566	S	S	*	*	H	α-helix	trans	-68.6	-38.2	178.4	-43.3	0	0	0	0	110.5	R522 Q523 T530	R522-T526 PolarHBondContact O-N 3.37Å; R522-T526 VanDerWaalsContact O-N 3.11Å; R522-T526 PolarHBondContact O-OG1 3.31Å; Q523-T526 PolarHBondContact O-N 3.14Å; T526-T530 PolarHBondContact O-OG1 3.09Å
527	T	62.4	Low	65.8	Low	92 Å²	92	105.7 Å²	105.7	56%	0.564	59%	0.591	S	S	*	*	H	α-helix	trans	-67.8	-37	174.6	-48	0	0	0	0	112	Q523 D524 Q525	Q523-T527 PolarHBondContact O-N 3.47Å; Q523-T527 VanDerWaalsContact O-N 3.14Å; Q523-T527 PolarHBondContact O-OG1 3.22Å; D524-T527 PolarHBondContact O-N 2.96Å; Q525-T527 VanDerWaalsContact C-N 3.34Å
528	T	61.3	Low	63.9	Low	74 Å²	74	107.8 Å²	107.8	45%	0.454	60%	0.604	S	S	.	*	H	α-helix	trans	-74.7	-38.4	-179.1	-52.7	0	0	0	0	113.1	D524 Q525 T530 I531	D524-T528 PolarHBondContact O-N 2.91Å; D524-T528 PolarHBondContact O-OG1 3.16Å; Q525-T528 PolarHBondContact O-N 3.42Å; T528-T530 VanDerWaalsContact C-N 3.29Å; T528-T530 PolarHBondContact O-N 3Å; T528-I531 PolarHBondContact O-N 2.82Å; T528-I531 VanDerWaalsContact O-N 3.14Å
529	T	56.7	Low	61.7	Low	102 Å²	102	112.2 Å²	112.2	63%	0.626	63%	0.628	S	S	*	*	H	α-helix	trans	-67.6	-29.5	-178.7	-52.2	0	0	0	0	112.4	Q525 I531 Q532	Q525-T529 PolarHBondContact O-N 3.22Å; Q525-T529 PolarHBondContact O-OG1 3.29Å; T529-I531 PolarHBondContact O-N 3.32Å; T529-Q532 PolarHBondContact O-N 3.32Å
530	T	51.2	Low	59.4	Low	113 Å²	113	117.7 Å²	117.7	69%	0.693	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-16.7	176.4	-52	0	0	0	0	112.5	T526 T528	T526-T530 PolarHBondContact O-OG1 3.09Å; T528-T530 VanDerWaalsContact C-N 3.29Å; T528-T530 PolarHBondContact O-N 3Å
531	I	55.6	Low	57.6	Low	138 Å²	138	117.5 Å²	117.5	71%	0.708	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	-12.3	-176.2	-58.9	174.4	0	0	0	112.2	T528 T529	T528-I531 PolarHBondContact O-N 2.82Å; T528-I531 VanDerWaalsContact O-N 3.14Å; T529-I531 PolarHBondContact O-N 3.32Å
532	Q	49.6	Very low	55.4	Low	152 Å²	152	122.1 Å²	122.1	71%	0.71	70%	0.704	S	S	*	*			trans	-112.7	9.4	-168.5	-71.9	-171.9	-15.3	0	0	117.1	T529 P534	T529-Q532 PolarHBondContact O-N 3.32Å; Q532-P534 WeakPolarHBondContact O-CD 3.5Å
533	S	37.9	Very low	53.8	Low	96 Å²	96	124 Å²	124	67%	0.671	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-73.1	117.4	170.1	52.1	0	0	0	0	110.6
534	P	41.9	Very low	52.6	Low	112 Å²	112	124 Å²	124	73%	0.727	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-73.1	144.5	174.3	6.1	8.4	0	0	0	109.8	Q532 S536	Q532-P534 WeakPolarHBondContact O-CD 3.5Å; P534-S536 PolarHBondContact O-N 3.22Å
535	P	52.1	Low	51.3	Low	128 Å²	128	125.1 Å²	125.1	83%	0.831	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-64.8	120.8	168.8	26.6	-30.2	0	0	0	109	A537	P535-A537 PolarHBondContact O-N 3.41Å
536	S	49.2	Very low	50.1	Low	103 Å²	103	124.8 Å²	124.8	72%	0.72	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-55.6	123.1	170.1	51.2	0	0	0	0	110.2	P534 I538	P534-S536 PolarHBondContact O-N 3.22Å; S536-I538 PolarHBondContact O-N 3.49Å
537	A	42.6	Very low	49.2	Very low	104 Å²	104	126.8 Å²	126.8	86%	0.86	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-60.8	125.1	169.1	0	0	0	0	0	109.6	P535	P535-A537 PolarHBondContact O-N 3.41Å
538	I	51.4	Low	48.3	Very low	158 Å²	158	129.1 Å²	129.1	81%	0.81	77%	0.773	S	S	*	*			trans	-121.6	125.5	161.2	-62	177.9	0	0	0	105.6	S536	S536-I538 PolarHBondContact O-N 3.49Å
539	D	46.1	Very low	47.4	Very low	154 Å²	154	133.1 Å²	133.1	82%	0.824	80%	0.796	S	S	*	*			trans	-46.9	135.9	-173.6	-88.5	-48.8	0	0	0	115.4
540	E	38.2	Very low	46.7	Very low	196 Å²	196	135.5 Å²	135.5	92%	0.916	81%	0.809	S	S	*	*			trans	-82.4	114.3	144.9	-79.4	-169.8	159.2	0	0	108.7
541	A	49.8	Very low	46.3	Very low	85 Å²	85	137.3 Å²	137.3	70%	0.702	82%	0.819	S	S	*	*			trans	-142.3	117.1	154.9	0	0	0	0	0	108.1
542	V	41.4	Very low	45.5	Very low	222 Å²	222	137.3 Å²	137.3	100%	1.345	83%	0.829	S	S	*	*			trans	25	0	150.9	-174.6	0	0	0	0	118.3

Retrieved 542 of 542 residues in 601.5 ms (Link to these results)

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