A0A2K6LNC5_RHIBE Loading...

F-box and leucine rich repeat protein 3

AlphaFold DB , UniProt , Accession A0A2K6LNC5, Species RHIBE (Rhinopithecus bieti, Black snub-nosed monkey), Gene FBXL3, Length 428 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	32.7	Very low	29.1	Very low	244 Å²	244	167.5 Å²	167.5	100%	1.202	85%	0.849	S	S	*	*				0	132.2	0	-104.6	175.3	165.3	0	0	108.7
2	K	33.8	Very low	28.8	Very low	205 Å²	205	162 Å²	162	89%	0.891	84%	0.837	S	S	*	*			trans	64.6	105.7	176.1	-63.6	-176.9	175.6	-179.5	0	115.2
3	R	26.3	Very low	28.6	Very low	261 Å²	261	157.2 Å²	157.2	99%	0.985	83%	0.826	S	S	*	*				59.4	125.4	52.7	-81.4	-168	179.1	-179.2	0.9	115.2
4	G	28.5	Very low	28.6	Very low	85 Å²	85	158.6 Å²	158.6	88%	0.876	83%	0.826	S	S	*	*			trans	115.9	122.1	159.1	0	0	0	0	0	111.3
5	G	28.9	Very low	28.3	Very low	70 Å²	70	161.5 Å²	161.5	72%	0.722	83%	0.834	S	S	*	*			cis	161.6	153.6	5.9	0	0	0	0	0	107.9
6	R	28.5	Very low	28.3	Very low	236 Å²	236	155.9 Å²	155.9	89%	0.891	83%	0.828	S	S	*	*			trans	33.5	148	146.2	-68.1	-177.3	-174.6	171.8	0.2	119.3
7	D	27.2	Very low	28.2	Very low	122 Å²	122	154.8 Å²	154.8	65%	0.652	83%	0.829	S	S	*	*			cis	-171.9	131.2	4.5	-111.8	-40.4	0	0	0	102.3
8	S	31.1	Very low	28.3	Very low	93 Å²	93	153.6 Å²	153.6	65%	0.65	83%	0.828	S	S	*	*				41.9	114	113.4	64.1	0	0	0	0	117.1
9	D	28.7	Very low	28.4	Very low	153 Å²	153	155.1 Å²	155.1	82%	0.818	83%	0.83	S	S	*	*			trans	-166.9	110.7	140.4	-93.4	-29.5	0	0	0	107.8
10	R	27.8	Very low	28.7	Very low	222 Å²	222	158 Å²	158	84%	0.838	83%	0.834	S	S	*	*				66.7	104.2	81.2	-83.3	-172.2	173.6	-174.4	0.7	114.5
11	N	26	Very low	28.8	Very low	152 Å²	152	155.8 Å²	155.8	81%	0.813	83%	0.832	S	S	*	*			trans	71.5	129.9	132.3	-88.7	6.5	0	0	0	122
12	S	26.2	Very low	29	Very low	101 Å²	101	154.3 Å²	154.3	71%	0.706	82%	0.819	S	S	*	*			trans	94.8	115.6	131.2	60.3	0	0	0	0	119.6
13	S	25.8	Very low	29.1	Very low	99 Å²	99	154.4 Å²	154.4	69%	0.692	82%	0.819	S	S	*	*				80.1	118.9	128.5	56.4	0	0	0	0	119.7
14	E	28.2	Very low	29.5	Very low	177 Å²	177	149.3 Å²	149.3	83%	0.827	81%	0.811	S	S	*	*				156.6	100.3	121.5	-84.4	176.5	179.3	0	0	107.9
15	E	25.3	Very low	29.9	Very low	203 Å²	203	156.9 Å²	156.9	95%	0.949	81%	0.813	S	S	*	*				62.1	110.3	95	-78.5	-162	163.3	0	0	114.2
16	G	27.4	Very low	30.1	Very low	72 Å²	72	159.1 Å²	159.1	74%	0.742	81%	0.813	S	S	*	*			trans	-179.4	51.1	177.7	0	0	0	0	0	113.9
17	T	27.3	Very low	30.5	Very low	136 Å²	136	153.6 Å²	153.6	83%	0.834	81%	0.805	S	S	*	*			trans	20.8	125.6	151.6	41.1	0	0	0	0	120.8
18	T	29	Very low	31	Very low	134 Å²	134	154.7 Å²	154.7	82%	0.822	81%	0.811	S	S	*	*				-158.3	120.2	121.7	26.2	0	0	0	0	112.6
19	E	31.5	Very low	31.4	Very low	182 Å²	182	158.6 Å²	158.6	85%	0.85	82%	0.819	S	S	*	*			trans	67.1	110.4	141.8	-66	-173.3	146.2	0	0	122.5	S21	E19-S21 PolarHBondContact O-N 3.23Å
20	K	32.8	Very low	32.2	Very low	213 Å²	213	159.4 Å²	159.4	93%	0.926	82%	0.818	S	S	*	*			trans	-61.3	108.3	161.5	-71.1	172	175.2	172	0	111
21	S	31.3	Very low	33.2	Very low	112 Å²	112	153.6 Å²	153.6	78%	0.783	81%	0.811	S	S	*	*			trans	-104.5	114.6	153.8	-85.8	0	0	0	0	109.9	E19 K23	E19-S21 PolarHBondContact O-N 3.23Å; S21-K23 PolarHBondContact O-N 2.69Å
22	K	37.7	Very low	34.6	Very low	213 Å²	213	155.2 Å²	155.2	93%	0.926	81%	0.814	S	S	*	*			trans	-57.5	99.9	172.1	-73.6	171.7	174.3	174	0	109.5	L24	K22-L24 PolarHBondContact O-N 2.9Å
23	K	36.2	Very low	36.2	Very low	207 Å²	207	156.3 Å²	156.3	90%	0.9	82%	0.816	S	S	*	*			trans	-89	103.1	160.8	-93.7	-177.4	176.8	178.9	0	109.2	S21	S21-K23 PolarHBondContact O-N 2.69Å
24	L	34.1	Very low	38.3	Very low	154 Å²	154	156.2 Å²	156.2	81%	0.806	81%	0.814	S	S	*	*			trans	-20.7	129.9	157.7	-139.6	71	0	0	0	112.6	K22 T26	K22-L24 PolarHBondContact O-N 2.9Å; L24-T26 VanDerWaalsContact C-N 3.33Å; L24-T26 PolarHBondContact O-N 2.88Å
25	R	36.1	Very low	40.9	Very low	243 Å²	243	152.3 Å²	152.3	92%	0.917	80%	0.799	S	S	*	*			trans	-56.6	99.2	160.9	-79.6	176.4	169.5	175.2	-4.3	107.6	T27	R25-T27 PolarHBondContact O-N 3.32Å; R25-T27 VanDerWaalsContact O-N 3.08Å
26	T	33.8	Very low	43.8	Very low	118 Å²	118	151.2 Å²	151.2	72%	0.724	79%	0.787	S	S	*	*			trans	-66.6	102.6	158.7	35.2	0	0	0	0	106.5	L24 N28	L24-T26 VanDerWaalsContact C-N 3.33Å; L24-T26 PolarHBondContact O-N 2.88Å; T26-N28 PolarHBondContact O-N 3.04Å
27	T	36.4	Very low	46.5	Very low	120 Å²	120	148.4 Å²	148.4	74%	0.736	76%	0.758	S	S	*	*			trans	-45.2	108.9	153	35.6	0	0	0	0	107.5	R25 E29	R25-T27 PolarHBondContact O-N 3.32Å; R25-T27 VanDerWaalsContact O-N 3.08Å; T27-E29 PolarHBondContact O-N 3.42Å
28	N	39.2	Very low	49.3	Very low	144 Å²	144	148 Å²	148	77%	0.77	75%	0.75	S	S	*	*			trans	-62	90.8	162.2	-100.5	-0.5	0	0	0	106.1	T26 H30	T26-N28 PolarHBondContact O-N 3.04Å; N28-H30 PolarHBondContact O-N 3.49Å; N28-H30 PolarHBondContact O-ND1 3.31Å
29	E	39.3	Very low	52.1	Low	175 Å²	175	144 Å²	144	82%	0.818	72%	0.723	S	S	*	*			trans	-49.9	110.4	154.8	-73.1	-178.2	163.1	0	0	105.5	T27 S31	T27-E29 PolarHBondContact O-N 3.42Å; E29-S31 PolarHBondContact O-N 3.34Å
30	H	45	Very low	55	Low	171 Å²	171	141.3 Å²	141.3	79%	0.792	72%	0.715	S	S	*	*			trans	-59.9	98.4	165.8	-77.7	49.3	0	0	0	105.2	N28 Q32	N28-H30 PolarHBondContact O-N 3.49Å; N28-H30 PolarHBondContact O-ND1 3.31Å; H30-Q32 PolarHBondContact O-N 3.21Å
31	S	48.1	Very low	57.9	Low	100 Å²	100	134.9 Å²	134.9	70%	0.699	69%	0.688	S	S	*	*			trans	-59	94	154	46.6	0	0	0	0	104.9	E29 T33	E29-S31 PolarHBondContact O-N 3.34Å; S31-T33 PolarHBondContact O-N 2.94Å
32	Q	55.8	Low	60.8	Low	185 Å²	185	134.8 Å²	134.8	86%	0.864	68%	0.678	S	S	*	*			trans	-56.2	96.4	164.6	-96	177.8	-21.8	0	0	105.2	H30 C34	H30-Q32 PolarHBondContact O-N 3.21Å; Q32-C34 VanDerWaalsContact C-N 3.34Å; Q32-C34 PolarHBondContact O-N 3.18Å
33	T	60.1	Low	63.5	Low	124 Å²	124	128.7 Å²	128.7	76%	0.761	66%	0.655	S	S	*	*			trans	-61	105.1	170.1	48.4	0	0	0	0	105.1	S31 D35	S31-T33 PolarHBondContact O-N 2.94Å; T33-D35 PolarHBondContact O-N 3.1Å
34	C	69.6	Low	66.2	Low	97 Å²	97	118.9 Å²	118.9	66%	0.655	61%	0.613	S	S	*	*			trans	-62.1	104.3	178.7	-168	0	0	0	0	107.5	Q32 W36	Q32-C34 VanDerWaalsContact C-N 3.34Å; Q32-C34 PolarHBondContact O-N 3.18Å; C34-W36 PolarHBondContact O-N 3.03Å; C34-W36 VanDerWaalsContact O-N 3.14Å
35	D	83.4	Confident	69.1	Low	96 Å²	96	111.9 Å²	111.9	51%	0.513	58%	0.576	S	S	.	*			trans	-78.5	98.4	178.6	-178.5	8.6	0	0	0	109.3	T33 G37 N38	T33-D35 PolarHBondContact O-N 3.1Å; D35-G37 PolarHBondContact O-N 2.92Å; D35-G37 VanDerWaalsContact O-N 3.1Å; D35-G37 WeakPolarHBondContact OD1-CA 3.43Å; D35-G37 PolarHBondContact OD1-N 3.12Å; D35-N38 PolarHBondContact O-N 3.27Å; D35-N38 PolarHBondContact OD2-ND2 3.42Å
36	W	85.4	Confident	72	Confident	180 Å²	180	104.9 Å²	104.9	68%	0.682	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-58.5	-17.7	175	-61.7	96.7	0	0	0	113.2	C34 N38 L39 W66	C34-W36 PolarHBondContact O-N 3.03Å; C34-W36 VanDerWaalsContact O-N 3.14Å; W36-N38 VanDerWaalsContact C-N 3.27Å; W36-N38 PolarHBondContact O-N 2.67Å; W36-L39 WeakPolarHBondContact O-CB 3.31Å; W36-L39 PolarHBondContact O-N 3.15Å; W36-W66 PolarHBondContact O-NE1 3.27Å; W36-W66 VanDerWaalsContact O-NE1 3.14Å
37	G	84.8	Confident	74.9	Confident	13 Å²	13	102.2 Å²	102.2	13%	0.134	54%	0.537	C	S	.	.	G	3₁₀ helix	trans	-66.3	-26.4	173.6	0	0	0	0	0	113.6	D35 N65	D35-G37 PolarHBondContact O-N 2.92Å; D35-G37 VanDerWaalsContact O-N 3.1Å; D35-G37 WeakPolarHBondContact OD1-CA 3.43Å; D35-G37 PolarHBondContact OD1-N 3.12Å; G37-N65 VanDerWaalsContact O-CB 3.3Å; G37-N65 WeakPolarHBondContact O-CB 3.27Å; G37-N65 PolarHBondContact O-ND2 2.97Å
38	N	85.3	Confident	77.6	Confident	126 Å²	126	96.5 Å²	96.5	67%	0.674	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-97.4	11.4	-179.4	-61.1	-38.6	0	0	0	113.5	D35 W36	D35-N38 PolarHBondContact O-N 3.27Å; D35-N38 PolarHBondContact OD2-ND2 3.42Å; W36-N38 VanDerWaalsContact C-N 3.27Å; W36-N38 PolarHBondContact O-N 2.67Å
39	L	89.1	Confident	80.2	Confident	50 Å²	50	93.7 Å²	93.7	26%	0.262	48%	0.483	S	S	.	.	S	Bend	trans	-58.3	144.6	176	-167.8	64.6	0	0	0	110.6	W36 Q41 I43 I44 N65	W36-L39 WeakPolarHBondContact O-CB 3.31Å; W36-L39 PolarHBondContact O-N 3.15Å; L39-Q41 PolarHBondContact O-N 3.43Å; L39-I43 HydrophobicContact CD1-CB 4.37Å; L39-I43 HydrophobicContact CD1-CG2 4.18Å; L39-I43 HydrophobicContact CD2-CB 4.11Å; L39-I43 HydrophobicContact CD2-CG2 3.65Å; L39-I43 HydrophobicContact CG-CB 3.99Å; L39-I43 HydrophobicContact CG-CG2 3.99Å; L39-I44 HydrophobicContact CB-CD1 4.18Å; L39-I44 HydrophobicContact CB-CG1 4.03Å; L39-I44 HydrophobicContact CD2-CG1 4Å; L39-I44 HydrophobicContact CG-CG1 4.19Å; L39-I44 WeakPolarHBondContact O-CD1 3.44Å; L39-N65 PolarHBondContact O-ND2 2.75Å
40	L	92.3	Very high	82.7	Confident	127 Å²	127	94.7 Å²	94.7	67%	0.665	48%	0.481	S	S	*	.			trans	-57.5	137.5	178.3	-70.7	170.5	0	0	0	110.7	D42 I43 I44	L40-D42 PolarHBondContact O-N 2.85Å; L40-I43 HydrophobicContact CB-CG1 4.07Å; L40-I43 WeakPolarHBondContact O-CB 2.91Å; L40-I43 PolarHBondContact O-N 3.44Å; L40-I44 PolarHBondContact O-N 2.98Å; L40-I44 VanDerWaalsContact O-N 3.12Å
41	Q	92.1	Very high	84.9	Confident	77 Å²	77	88.9 Å²	88.9	36%	0.36	46%	0.455	S	S	.	.	H	α-helix	trans	-56.7	-37.9	-177.1	-70.3	-175.4	-6.2	0	0	112.4	L39 I43 I44 L45 N65 V69	L39-Q41 PolarHBondContact O-N 3.43Å; Q41-I43 VanDerWaalsContact C-N 3.3Å; Q41-I43 PolarHBondContact O-N 3.14Å; Q41-I44 PolarHBondContact O-N 3.01Å; Q41-L45 WeakPolarHBondContact O-CB 3.16Å; Q41-L45 PolarHBondContact O-N 2.8Å; Q41-N65 WeakPolarHBondContact CG-OD1 3.15Å; Q41-N65 PolarHBondContact NE2-OD1 3.41Å; Q41-V69 HydrophobicContact CB-CG2 3.72Å; Q41-V69 HydrophobicContact CG-CG2 3.73Å
42	D	93.4	Very high	86.7	Confident	110 Å²	110	87.7 Å²	87.7	59%	0.588	45%	0.445	S	S	*	.	H	α-helix	trans	-62.5	-35.1	176.2	-68.1	-50.5	0	0	0	112.9	L40 L45 Q46	L40-D42 PolarHBondContact O-N 2.85Å; D42-L45 WeakPolarHBondContact O-CB 3.4Å; D42-L45 PolarHBondContact O-N 2.64Å; D42-Q46 WeakPolarHBondContact O-CG 3.32Å; D42-Q46 PolarHBondContact O-N 2.97Å; D42-Q46 VanDerWaalsContact O-N 3.08Å
43	I	93.9	Very high	88.1	Confident	86 Å²	86	81.7 Å²	81.7	44%	0.441	42%	0.418	S	S	.	.	H	α-helix	trans	-72.9	-43.6	177.4	-55.5	-62	0	0	0	110.1	L39 L40 Q41 L45 Q46 V47	L39-I43 HydrophobicContact CD1-CB 4.37Å; L39-I43 HydrophobicContact CD1-CG2 4.18Å; L39-I43 HydrophobicContact CD2-CB 4.11Å; L39-I43 HydrophobicContact CD2-CG2 3.65Å; L39-I43 HydrophobicContact CG-CB 3.99Å; L39-I43 HydrophobicContact CG-CG2 3.99Å; L40-I43 HydrophobicContact CB-CG1 4.07Å; L40-I43 WeakPolarHBondContact O-CB 2.91Å; L40-I43 PolarHBondContact O-N 3.44Å; Q41-I43 VanDerWaalsContact C-N 3.3Å; Q41-I43 PolarHBondContact O-N 3.14Å; I43-L45 PolarHBondContact O-N 2.98Å; I43-Q46 PolarHBondContact O-N 2.88Å; I43-Q46 VanDerWaalsContact O-N 3.16Å; I43-V47 WeakPolarHBondContact O-CG2 3.48Å; I43-V47 PolarHBondContact O-N 3.09Å
44	I	94.1	Very high	89.3	Confident	1 Å²	1	81.2 Å²	81.2	1%	0.005	41%	0.411	C	S	.	.	H	α-helix	trans	-61.1	-38.4	174.7	-57.9	164.4	0	0	0	109.9	L39 L40 Q41 Q46 V47 F48 N65 W66 V69	L39-I44 HydrophobicContact CB-CD1 4.18Å; L39-I44 HydrophobicContact CB-CG1 4.03Å; L39-I44 HydrophobicContact CD2-CG1 4Å; L39-I44 HydrophobicContact CG-CG1 4.19Å; L39-I44 WeakPolarHBondContact O-CD1 3.44Å; L40-I44 PolarHBondContact O-N 2.98Å; L40-I44 VanDerWaalsContact O-N 3.12Å; Q41-I44 PolarHBondContact O-N 3.01Å; I44-Q46 PolarHBondContact O-N 3.45Å; I44-V47 WeakPolarHBondContact O-CB 3.38Å; I44-V47 PolarHBondContact O-N 3.29Å; I44-F48 HydrophobicContact CG2-CD1 3.62Å; I44-F48 HydrophobicContact CG2-CE1 3.38Å; I44-F48 HydrophobicContact CG2-CG 4.5Å; I44-F48 HydrophobicContact CG2-CZ 4.1Å; I44-F48 WeakPolarHBondContact O-CB 3.27Å; I44-F48 WeakPolarHBondContact O-CD1 3.21Å; I44-F48 PolarHBondContact O-N 3.01Å; I44-N65 WeakPolarHBondContact CD1-ND2 3.32Å; I44-W66 VanDerWaalsContact CD1-CD1 3.42Å; I44-W66 HydrophobicContact CD1-CG 4.14Å; I44-W66 HydrophobicContact CG2-CD2 4.12Å; I44-W66 HydrophobicContact CG2-CG 4.14Å; I44-V69 HydrophobicContact CB-CB 4.37Å; I44-V69 HydrophobicContact CB-CG1 4.07Å; I44-V69 HydrophobicContact CB-CG2 4Å; I44-V69 HydrophobicContact CD1-CG2 4.23Å; I44-V69 HydrophobicContact CG2-CB 3.93Å; I44-V69 HydrophobicContact CG2-CG1 3.75Å; I44-V69 HydrophobicContact CG2-CG2 4.04Å
45	L	94.9	Very high	90.2	Very high	7 Å²	7	80.1 Å²	80.1	4%	0.037	40%	0.399	C	S	.	.	H	α-helix	trans	-60.2	-44.8	175.5	175.3	66.2	0	0	0	111.1	Q41 D42 I43 V47 F48 K49 V69 M72 D74 L75	Q41-L45 WeakPolarHBondContact O-CB 3.16Å; Q41-L45 PolarHBondContact O-N 2.8Å; D42-L45 WeakPolarHBondContact O-CB 3.4Å; D42-L45 PolarHBondContact O-N 2.64Å; I43-L45 PolarHBondContact O-N 2.98Å; L45-V47 VanDerWaalsContact C-N 3.33Å; L45-V47 PolarHBondContact O-N 3.01Å; L45-F48 PolarHBondContact O-N 2.72Å; L45-K49 WeakPolarHBondContact O-CG 3.28Å; L45-K49 PolarHBondContact O-N 2.81Å; L45-V69 HydrophobicContact CB-CG1 4.02Å; L45-M72 HydrophobicContact CB-SD 4.22Å; L45-M72 HydrophobicContact CD1-CB 4.36Å; L45-M72 HydrophobicContact CD1-SD 4.26Å; L45-M72 HydrophobicContact CD2-CE 3.77Å; L45-M72 HydrophobicContact CD2-SD 4.25Å; L45-M72 HydrophobicContact CG-SD 4.47Å; L45-D74 HydrophobicContact CD1-CB 3.92Å; L45-D74 HydrophobicContact CD2-CB 4.13Å; L45-L75 HydrophobicContact CD1-CD1 4.1Å; L45-L75 HydrophobicContact CD1-CD2 3.66Å; L45-L75 HydrophobicContact CD1-CG 3.57Å
46	Q	95.3	Very high	90.6	Very high	95 Å²	95	78 Å²	78	44%	0.444	38%	0.383	S	S	.	.	H	α-helix	trans	-61.4	-41.8	175.1	-65.2	-54.3	-35.5	0	0	111.6	D42 I43 I44 K49 Y50	D42-Q46 WeakPolarHBondContact O-CG 3.32Å; D42-Q46 PolarHBondContact O-N 2.97Å; D42-Q46 VanDerWaalsContact O-N 3.08Å; I43-Q46 PolarHBondContact O-N 2.88Å; I43-Q46 VanDerWaalsContact O-N 3.16Å; I44-Q46 PolarHBondContact O-N 3.45Å; Q46-K49 WeakPolarHBondContact O-CB 3.18Å; Q46-K49 PolarHBondContact O-N 2.82Å; Q46-Y50 WeakPolarHBondContact O-CD2 3.49Å
47	V	94.5	Very high	90.7	Very high	63 Å²	63	70.7 Å²	70.7	38%	0.382	36%	0.362	S	S	.	.	H	α-helix	trans	-59.9	-47.9	173.9	175.2	0	0	0	0	110.6	I43 I44 L45 K49 Y50 L51	I43-V47 WeakPolarHBondContact O-CG2 3.48Å; I43-V47 PolarHBondContact O-N 3.09Å; I44-V47 WeakPolarHBondContact O-CB 3.38Å; I44-V47 PolarHBondContact O-N 3.29Å; L45-V47 VanDerWaalsContact C-N 3.33Å; L45-V47 PolarHBondContact O-N 3.01Å; V47-K49 VanDerWaalsContact C-N 3.27Å; V47-K49 PolarHBondContact O-N 2.98Å; V47-Y50 PolarHBondContact O-N 3.17Å; V47-L51 HydrophobicContact CG1-CD1 4.44Å
48	F	94.6	Very high	91	Very high	0 Å²	0	75 Å²	75	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-64.1	-31.2	-178.5	-84.2	44.2	0	0	0	112.3	I44 L45 Y50 L51 R56 A59 W66 F70 L75	I44-F48 HydrophobicContact CG2-CD1 3.62Å; I44-F48 HydrophobicContact CG2-CE1 3.38Å; I44-F48 HydrophobicContact CG2-CG 4.5Å; I44-F48 HydrophobicContact CG2-CZ 4.1Å; I44-F48 WeakPolarHBondContact O-CB 3.27Å; I44-F48 WeakPolarHBondContact O-CD1 3.21Å; I44-F48 PolarHBondContact O-N 3.01Å; L45-F48 PolarHBondContact O-N 2.72Å; F48-Y50 PolarHBondContact O-N 2.84Å; F48-L51 HydrophobicContact CD1-CD1 4.37Å; F48-L51 PolarHBondContact O-N 3.29Å; F48-R56 HydrophobicContact CB-CG 4.39Å; F48-R56 HydrophobicContact CD2-CB 4.11Å; F48-R56 HydrophobicContact CD2-CG 4.09Å; F48-R56 HydrophobicContact CE2-CB 4.4Å; F48-R56 HydrophobicContact CG-CG 4.41Å; F48-R56 PolarHBondContact O-NE 3.36Å; F48-R56 PolarHBondContact O-NH2 3.37Å; F48-A59 HydrophobicContact CE1-CB 3.79Å; F48-A59 HydrophobicContact CE2-CB 4.39Å; F48-A59 HydrophobicContact CZ-CB 3.6Å; F48-W66 HydrophobicContact CE1-CD2 4.37Å; F48-W66 AromaticContact CE1-CE3 3.7Å; F48-W66 HydrophobicContact CE1-CE3 3.7Å; F48-W66 HydrophobicContact CE1-CZ3 4.15Å; F48-W66 HydrophobicContact CZ-CB 4.35Å; F48-W66 HydrophobicContact CZ-CE3 4.07Å; F48-F70 HydrophobicContact CD2-CD2 4.4Å; F48-F70 HydrophobicContact CE2-CB 3.97Å; F48-F70 HydrophobicContact CE2-CD2 4.07Å; F48-L75 HydrophobicContact CB-CD1 3.84Å; F48-L75 HydrophobicContact CB-CD2 3.82Å; F48-L75 HydrophobicContact CB-CG 4.5Å; F48-L75 HydrophobicContact CD2-CD1 3.69Å; F48-L75 HydrophobicContact CG-CD1 4.2Å
49	K	92.3	Very high	91.4	Very high	84 Å²	84	69.6 Å²	69.6	37%	0.365	35%	0.35	S	S	.	.	H	α-helix	trans	-59.8	-24.8	173.9	-76.6	175.8	178.6	-179.9	0	112.6	L45 Q46 V47 D74 L75	L45-K49 WeakPolarHBondContact O-CG 3.28Å; L45-K49 PolarHBondContact O-N 2.81Å; Q46-K49 WeakPolarHBondContact O-CB 3.18Å; Q46-K49 PolarHBondContact O-N 2.82Å; V47-K49 VanDerWaalsContact C-N 3.27Å; V47-K49 PolarHBondContact O-N 2.98Å; K49-D74 IonicContact NZ-OD1 3.77Å; K49-D74 PolarHBondContact NZ-OD1 2.87Å; K49-L75 HydrophobicContact CG-CD2 4.08Å
50	Y	93.5	Very high	91.5	Very high	197 Å²	197	67.6 Å²	67.6	77%	0.773	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-9.7	175.3	-66.4	-70.7	0	0	0	114.9	Q46 V47 F48	Q46-Y50 WeakPolarHBondContact O-CD2 3.49Å; V47-Y50 PolarHBondContact O-N 3.17Å; F48-Y50 PolarHBondContact O-N 2.84Å
51	L	90.4	Very high	91.5	Very high	48 Å²	48	68.7 Å²	68.7	25%	0.251	34%	0.343	S	S	.	.	S	Bend	trans	-94.7	146.3	-177.7	-62.1	-179.8	0	0	0	111.6	V47 F48 D55 R56 A59	V47-L51 HydrophobicContact CG1-CD1 4.44Å; F48-L51 HydrophobicContact CD1-CD1 4.37Å; F48-L51 PolarHBondContact O-N 3.29Å; L51-D55 HydrophobicContact CB-CB 4.12Å; L51-D55 HydrophobicContact CD2-CB 4.4Å; L51-R56 HydrophobicContact CB-CG 3.75Å; L51-R56 PolarHBondContact O-NE 3.42Å; L51-R56 PolarHBondContact O-NH2 2.81Å; L51-A59 HydrophobicContact CD1-CB 4.22Å
52	P	86.6	Confident	91.6	Very high	75 Å²	75	69.8 Å²	69.8	49%	0.487	35%	0.354	S	S	.	.			trans	-70.5	165.2	166	31	-35.5	0	0	0	111.3	L54 D55 R56	P52-L54 VanDerWaalsContact C-N 3.32Å; P52-L54 PolarHBondContact O-N 3.36Å; P52-D55 VanDerWaalsContact CD-OD2 3.26Å; P52-D55 WeakPolarHBondContact CD-OD2 3.41Å; P52-D55 HydrophobicContact CG-CB 3.9Å; P52-D55 WeakPolarHBondContact CG-OD2 3.48Å; P52-D55 PolarHBondContact O-N 3.45Å; P52-D55 VanDerWaalsContact O-N 3.16Å; P52-R56 WeakPolarHBondContact O-CG 2.78Å; P52-R56 PolarHBondContact O-N 2.91Å
53	L	85.5	Confident	91.6	Very high	59 Å²	59	66.5 Å²	66.5	31%	0.309	34%	0.339	S	S	.	.	H	α-helix	trans	-56.2	-41.4	-173.4	179.8	63.6	0	0	0	113.9	R56 A57 W76 F79 L98	L53-R56 WeakPolarHBondContact O-CB 3.46Å; L53-R56 PolarHBondContact O-N 3.42Å; L53-A57 WeakPolarHBondContact O-CB 3.32Å; L53-A57 PolarHBondContact O-N 3.42Å; L53-W76 HydrophobicContact CD1-CH2 3.94Å; L53-W76 HydrophobicContact CD1-CZ3 4.22Å; L53-F79 HydrophobicContact CD1-CE2 4.41Å; L53-F79 HydrophobicContact CD2-CE2 3.47Å; L53-F79 VanDerWaalsContact CD2-CE2 3.47Å; L53-F79 HydrophobicContact CD2-CZ 3.79Å; L53-L98 HydrophobicContact CD2-CD2 4.02Å
54	L	84.5	Confident	91.5	Very high	114 Å²	114	73 Å²	73	60%	0.597	36%	0.358	S	S	*	.	H	α-helix	trans	-65.3	-44	179.8	-174.4	61.1	0	0	0	111.3	P52 A57 H58	P52-L54 VanDerWaalsContact C-N 3.32Å; P52-L54 PolarHBondContact O-N 3.36Å; L54-A57 WeakPolarHBondContact O-CB 3.5Å; L54-A57 PolarHBondContact O-N 3.34Å; L54-A57 VanDerWaalsContact O-N 3.14Å; L54-H58 PolarHBondContact O-CD2 2.67Å; L54-H58 PolarHBondContact O-N 2.93Å
55	D	89.3	Confident	91.5	Very high	75 Å²	75	74.4 Å²	74.4	40%	0.401	37%	0.366	S	S	.	.	H	α-helix	trans	-67.5	-37.1	177.1	-66.5	-13.7	0	0	0	111.6	L51 P52 A57 H58 A59	L51-D55 HydrophobicContact CB-CB 4.12Å; L51-D55 HydrophobicContact CD2-CB 4.4Å; P52-D55 VanDerWaalsContact CD-OD2 3.26Å; P52-D55 WeakPolarHBondContact CD-OD2 3.41Å; P52-D55 HydrophobicContact CG-CB 3.9Å; P52-D55 WeakPolarHBondContact CG-OD2 3.48Å; P52-D55 PolarHBondContact O-N 3.45Å; P52-D55 VanDerWaalsContact O-N 3.16Å; D55-A57 VanDerWaalsContact C-N 3.29Å; D55-A57 PolarHBondContact O-N 2.98Å; D55-H58 PolarHBondContact O-N 3.41Å; D55-A59 WeakPolarHBondContact O-CB 3.39Å; D55-A59 PolarHBondContact O-N 2.97Å
56	R	91.8	Very high	91.5	Very high	50 Å²	50	76.3 Å²	76.3	19%	0.189	37%	0.373	C	S	.	.	H	α-helix	trans	-59.4	-42.1	170.5	-67.4	173.5	-169.6	163	9.5	111.1	F48 L51 P52 L53 A59 S60 F70	F48-R56 HydrophobicContact CB-CG 4.39Å; F48-R56 HydrophobicContact CD2-CB 4.11Å; F48-R56 HydrophobicContact CD2-CG 4.09Å; F48-R56 HydrophobicContact CE2-CB 4.4Å; F48-R56 HydrophobicContact CG-CG 4.41Å; F48-R56 PolarHBondContact O-NE 3.36Å; F48-R56 PolarHBondContact O-NH2 3.37Å; L51-R56 HydrophobicContact CB-CG 3.75Å; L51-R56 PolarHBondContact O-NE 3.42Å; L51-R56 PolarHBondContact O-NH2 2.81Å; P52-R56 WeakPolarHBondContact O-CG 2.78Å; P52-R56 PolarHBondContact O-N 2.91Å; L53-R56 WeakPolarHBondContact O-CB 3.46Å; L53-R56 PolarHBondContact O-N 3.42Å; R56-A59 PolarHBondContact O-N 3.2Å; R56-S60 WeakPolarHBondContact O-CB 3.26Å; R56-S60 PolarHBondContact O-N 3.04Å; R56-F70 HydrophobicContact CB-CD2 3.85Å; R56-F70 HydrophobicContact CB-CE2 3.67Å; R56-F70 WeakPolarHBondContact O-CD2 3.24Å
57	A	87.3	Confident	91.4	Very high	28 Å²	28	75 Å²	75	23%	0.231	37%	0.368	C	S	.	.	H	α-helix	trans	-64.8	-44.9	178.5	0	0	0	0	0	111.2	L53 L54 D55 S60 F70	L53-A57 WeakPolarHBondContact O-CB 3.32Å; L53-A57 PolarHBondContact O-N 3.42Å; L54-A57 WeakPolarHBondContact O-CB 3.5Å; L54-A57 PolarHBondContact O-N 3.34Å; L54-A57 VanDerWaalsContact O-N 3.14Å; D55-A57 VanDerWaalsContact C-N 3.29Å; D55-A57 PolarHBondContact O-N 2.98Å; A57-S60 PolarHBondContact O-N 3.28Å; A57-S60 PolarHBondContact O-OG 2.75Å; A57-F70 HydrophobicContact CB-CE2 4.32Å; A57-F70 HydrophobicContact CB-CZ 4.26Å
58	H	90.4	Very high	91.3	Very high	104 Å²	104	77.3 Å²	77.3	48%	0.481	38%	0.375	S	S	.	.	H	α-helix	trans	-63	-45.5	173.8	-68.8	-51.8	0	0	0	112.3	L54 D55 S60 Q61	L54-H58 PolarHBondContact O-CD2 2.67Å; L54-H58 PolarHBondContact O-N 2.93Å; D55-H58 PolarHBondContact O-N 3.41Å; H58-S60 VanDerWaalsContact C-N 3.26Å; H58-S60 PolarHBondContact O-N 3.41Å; H58-Q61 WeakPolarHBondContact O-CB 3.12Å; H58-Q61 PolarHBondContact O-N 3.02Å
59	A	92.8	Very high	91.3	Very high	11 Å²	11	77.3 Å²	77.3	9%	0.091	38%	0.375	C	S	.	.	H	α-helix	trans	-60.1	-36.5	176.3	0	0	0	0	0	112	F48 L51 D55 R56 Q61 V62 W66	F48-A59 HydrophobicContact CE1-CB 3.79Å; F48-A59 HydrophobicContact CE2-CB 4.39Å; F48-A59 HydrophobicContact CZ-CB 3.6Å; L51-A59 HydrophobicContact CD1-CB 4.22Å; D55-A59 WeakPolarHBondContact O-CB 3.39Å; D55-A59 PolarHBondContact O-N 2.97Å; R56-A59 PolarHBondContact O-N 3.2Å; A59-Q61 PolarHBondContact O-N 3.25Å; A59-Q61 VanDerWaalsContact O-N 3.17Å; A59-V62 WeakPolarHBondContact O-CB 3.39Å; A59-V62 WeakPolarHBondContact O-CG2 3.32Å; A59-V62 PolarHBondContact O-N 3.18Å; A59-V62 VanDerWaalsContact O-N 3.16Å; A59-W66 HydrophobicContact CB-CE3 3.99Å; A59-W66 HydrophobicContact CB-CZ3 4.11Å
60	S	92.5	Very high	91.4	Very high	9 Å²	9	73.9 Å²	73.9	6%	0.063	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-15.4	176.7	84.3	0	0	0	0	114	R56 A57 H58 N67 F70	R56-S60 WeakPolarHBondContact O-CB 3.26Å; R56-S60 PolarHBondContact O-N 3.04Å; A57-S60 PolarHBondContact O-N 3.28Å; A57-S60 PolarHBondContact O-OG 2.75Å; H58-S60 VanDerWaalsContact C-N 3.26Å; H58-S60 PolarHBondContact O-N 3.41Å; S60-N67 WeakPolarHBondContact O-CA 3.37Å; S60-N67 VanDerWaalsContact O-CB 3.23Å; S60-N67 WeakPolarHBondContact O-CB 3.44Å; S60-N67 PolarHBondContact O-ND2 3.01Å; S60-N67 VanDerWaalsContact O-ND2 3.08Å; S60-F70 VanDerWaalsContact CB-CB 3.49Å
61	Q	92.6	Very high	91.3	Very high	150 Å²	150	66.5 Å²	66.5	70%	0.701	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-9.9	178.3	-64.8	175.6	2.6	0	0	112.9	H58 A59	H58-Q61 WeakPolarHBondContact O-CB 3.12Å; H58-Q61 PolarHBondContact O-N 3.02Å; A59-Q61 PolarHBondContact O-N 3.25Å; A59-Q61 VanDerWaalsContact O-N 3.17Å
62	V	93.8	Very high	91.5	Very high	100 Å²	100	66.1 Å²	66.1	61%	0.606	33%	0.33	S	S	*	.	S	Bend	trans	-63.6	-47.7	-177.7	174.9	0	0	0	0	111.5	A59 W66	A59-V62 WeakPolarHBondContact O-CB 3.39Å; A59-V62 WeakPolarHBondContact O-CG2 3.32Å; A59-V62 PolarHBondContact O-N 3.18Å; A59-V62 VanDerWaalsContact O-N 3.16Å; V62-W66 HydrophobicContact CB-CE3 4.45Å
63	C	92.8	Very high	91.8	Very high	40 Å²	40	64.6 Å²	64.6	27%	0.27	32%	0.32	S	S	.	.			trans	-158.4	168.5	177.3	72.5	0	0	0	0	112.2	N65 W66 N67	C63-N65 VanDerWaalsContact C-N 3.31Å; C63-N65 PolarHBondContact O-N 3.13Å; C63-W66 PolarHBondContact O-N 2.91Å; C63-N67 PolarHBondContact O-N 3.43Å
64	R	92.3	Very high	92.1	Very high	222 Å²	222	65.5 Å²	65.5	84%	0.838	33%	0.326	S	S	*	.	H	α-helix	trans	-59.5	-37.7	-179.4	-68.5	-176.5	-174.7	169.9	1.9	113.3	N67 Q68	R64-N67 WeakPolarHBondContact O-CB 3.03Å; R64-N67 PolarHBondContact O-N 2.8Å; R64-Q68 WeakPolarHBondContact O-CG 3.49Å; R64-Q68 PolarHBondContact O-N 2.77Å; R64-Q68 VanDerWaalsContact O-N 3.07Å
65	N	93.6	Very high	92.6	Very high	32 Å²	32	60.6 Å²	60.6	17%	0.171	30%	0.3	C	S	.	.	H	α-helix	trans	-65.8	-46.5	-179.1	-174.7	31.6	0	0	0	111.1	G37 L39 Q41 I44 C63 N67 Q68 V69	G37-N65 VanDerWaalsContact O-CB 3.3Å; G37-N65 WeakPolarHBondContact O-CB 3.27Å; G37-N65 PolarHBondContact O-ND2 2.97Å; L39-N65 PolarHBondContact O-ND2 2.75Å; Q41-N65 WeakPolarHBondContact CG-OD1 3.15Å; Q41-N65 PolarHBondContact NE2-OD1 3.41Å; I44-N65 WeakPolarHBondContact CD1-ND2 3.32Å; C63-N65 VanDerWaalsContact C-N 3.31Å; C63-N65 PolarHBondContact O-N 3.13Å; N65-N67 VanDerWaalsContact C-N 3.28Å; N65-N67 PolarHBondContact O-N 3.14Å; N65-Q68 PolarHBondContact O-N 2.9Å; N65-V69 PolarHBondContact O-N 3.04Å
66	W	94.7	Very high	92.8	Very high	47 Å²	47	57.2 Å²	57.2	18%	0.178	28%	0.282	C	S	.	.	H	α-helix	trans	-65.5	-33.7	175.8	-71	41.9	0	0	0	111.8	W36 I44 F48 A59 V62 C63 V69 F70	W36-W66 PolarHBondContact O-NE1 3.27Å; W36-W66 VanDerWaalsContact O-NE1 3.14Å; I44-W66 VanDerWaalsContact CD1-CD1 3.42Å; I44-W66 HydrophobicContact CD1-CG 4.14Å; I44-W66 HydrophobicContact CG2-CD2 4.12Å; I44-W66 HydrophobicContact CG2-CG 4.14Å; F48-W66 HydrophobicContact CE1-CD2 4.37Å; F48-W66 AromaticContact CE1-CE3 3.7Å; F48-W66 HydrophobicContact CE1-CE3 3.7Å; F48-W66 HydrophobicContact CE1-CZ3 4.15Å; F48-W66 HydrophobicContact CZ-CB 4.35Å; F48-W66 HydrophobicContact CZ-CE3 4.07Å; A59-W66 HydrophobicContact CB-CE3 3.99Å; A59-W66 HydrophobicContact CB-CZ3 4.11Å; V62-W66 HydrophobicContact CB-CE3 4.45Å; C63-W66 PolarHBondContact O-N 2.91Å; W66-V69 PolarHBondContact O-N 2.86Å; W66-F70 PolarHBondContact O-N 3.36Å; W66-F70 VanDerWaalsContact O-N 3.1Å
67	N	93.7	Very high	92.9	Very high	66 Å²	66	58.8 Å²	58.8	35%	0.353	29%	0.287	S	S	.	.	H	α-helix	trans	-62.6	-39.4	173.7	-167.3	-101.7	0	0	0	113.2	S60 C63 R64 N65 V69 F70	S60-N67 WeakPolarHBondContact O-CA 3.37Å; S60-N67 VanDerWaalsContact O-CB 3.23Å; S60-N67 WeakPolarHBondContact O-CB 3.44Å; S60-N67 PolarHBondContact O-ND2 3.01Å; S60-N67 VanDerWaalsContact O-ND2 3.08Å; C63-N67 PolarHBondContact O-N 3.43Å; R64-N67 WeakPolarHBondContact O-CB 3.03Å; R64-N67 PolarHBondContact O-N 2.8Å; N65-N67 VanDerWaalsContact C-N 3.28Å; N65-N67 PolarHBondContact O-N 3.14Å; N67-V69 VanDerWaalsContact C-N 3.34Å; N67-F70 WeakPolarHBondContact O-CB 3.47Å; N67-F70 PolarHBondContact O-N 3.17Å
68	Q	92.5	Very high	93.3	Very high	112 Å²	112	61.6 Å²	61.6	52%	0.523	30%	0.304	S	S	.	.	H	α-helix	trans	-63.9	-42.4	176.2	-71.3	171.2	-4.5	0	0	111.1	R64 N65 F70 H71	R64-Q68 WeakPolarHBondContact O-CG 3.49Å; R64-Q68 PolarHBondContact O-N 2.77Å; R64-Q68 VanDerWaalsContact O-N 3.07Å; N65-Q68 PolarHBondContact O-N 2.9Å; Q68-F70 VanDerWaalsContact C-N 3.3Å; Q68-F70 PolarHBondContact O-N 3.25Å; Q68-H71 PolarHBondContact O-N 3.29Å; Q68-H71 VanDerWaalsContact O-N 3.13Å
69	V	94.6	Very high	93.5	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.5	-37.6	178.3	176.8	0	0	0	0	111.8	Q41 I44 L45 N65 W66 N67 H71 M72 L75	Q41-V69 HydrophobicContact CB-CG2 3.72Å; Q41-V69 HydrophobicContact CG-CG2 3.73Å; I44-V69 HydrophobicContact CB-CB 4.37Å; I44-V69 HydrophobicContact CB-CG1 4.07Å; I44-V69 HydrophobicContact CB-CG2 4Å; I44-V69 HydrophobicContact CD1-CG2 4.23Å; I44-V69 HydrophobicContact CG2-CB 3.93Å; I44-V69 HydrophobicContact CG2-CG1 3.75Å; I44-V69 HydrophobicContact CG2-CG2 4.04Å; L45-V69 HydrophobicContact CB-CG1 4.02Å; N65-V69 PolarHBondContact O-N 3.04Å; W66-V69 PolarHBondContact O-N 2.86Å; N67-V69 VanDerWaalsContact C-N 3.34Å; V69-H71 PolarHBondContact O-N 2.77Å; V69-M72 HydrophobicContact CB-SD 4.33Å; V69-M72 HydrophobicContact CG1-SD 3.96Å; V69-M72 HydrophobicContact CG2-SD 4.34Å; V69-M72 WeakPolarHBondContact O-CB 3.33Å; V69-M72 WeakPolarHBondContact O-CG 3.4Å; V69-M72 PolarHBondContact O-N 3.14Å; V69-L75 VanDerWaalsContact O-CD1 3.31Å; V69-L75 WeakPolarHBondContact O-CD1 3.21Å
70	F	93.5	Very high	93.6	Very high	12 Å²	12	60.2 Å²	60.2	5%	0.053	30%	0.296	C	S	.	.	H	α-helix	trans	-54.3	-28	176.1	-176.8	-108.9	0	0	0	113.2	F48 R56 A57 S60 W66 N67 Q68 W76	F48-F70 HydrophobicContact CD2-CD2 4.4Å; F48-F70 HydrophobicContact CE2-CB 3.97Å; F48-F70 HydrophobicContact CE2-CD2 4.07Å; R56-F70 HydrophobicContact CB-CD2 3.85Å; R56-F70 HydrophobicContact CB-CE2 3.67Å; R56-F70 WeakPolarHBondContact O-CD2 3.24Å; A57-F70 HydrophobicContact CB-CE2 4.32Å; A57-F70 HydrophobicContact CB-CZ 4.26Å; S60-F70 VanDerWaalsContact CB-CB 3.49Å; W66-F70 PolarHBondContact O-N 3.36Å; W66-F70 VanDerWaalsContact O-N 3.1Å; N67-F70 WeakPolarHBondContact O-CB 3.47Å; N67-F70 PolarHBondContact O-N 3.17Å; Q68-F70 VanDerWaalsContact C-N 3.3Å; Q68-F70 PolarHBondContact O-N 3.25Å; F70-W76 HydrophobicContact CD1-CZ2 4.16Å; F70-W76 HydrophobicContact CE1-CH2 4.12Å; F70-W76 AromaticContact CE1-CZ2 3.55Å; F70-W76 HydrophobicContact CE1-CZ2 3.55Å; F70-W76 HydrophobicContact CE2-CZ2 4.08Å; F70-W76 AromaticContact CZ-CH2 3.82Å; F70-W76 HydrophobicContact CZ-CH2 3.82Å; F70-W76 AromaticContact CZ-CZ2 3.5Å; F70-W76 HydrophobicContact CZ-CZ2 3.5Å; F70-W76 PolarHBondContact O-NE1 3.08Å
71	H	92.5	Very high	93.7	Very high	43 Å²	43	59.8 Å²	59.8	20%	0.199	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	10.1	-179.8	-69.1	-44.6	0	0	0	114.6	Q68 V69 Q101 R105 H106	Q68-H71 PolarHBondContact O-N 3.29Å; Q68-H71 VanDerWaalsContact O-N 3.13Å; V69-H71 PolarHBondContact O-N 2.77Å; H71-Q101 PolarHBondContact CE1-NE2 2.92Å; H71-R105 PolarHBondContact NE2-NH1 3.24Å; H71-H106 AromaticContact ND1-CE1 3.79Å; H71-H106 AromaticContact ND1-NE2 3.53Å
72	M	94.1	Very high	93.8	Very high	40 Å²	40	54.6 Å²	54.6	20%	0.197	27%	0.269	C	S	.	.			trans	-68.6	138.6	176.8	-71.8	-179.3	76.2	0	0	112	L45 V69 D74 L75	L45-M72 HydrophobicContact CB-SD 4.22Å; L45-M72 HydrophobicContact CD1-CB 4.36Å; L45-M72 HydrophobicContact CD1-SD 4.26Å; L45-M72 HydrophobicContact CD2-CE 3.77Å; L45-M72 HydrophobicContact CD2-SD 4.25Å; L45-M72 HydrophobicContact CG-SD 4.47Å; V69-M72 HydrophobicContact CB-SD 4.33Å; V69-M72 HydrophobicContact CG1-SD 3.96Å; V69-M72 HydrophobicContact CG2-SD 4.34Å; V69-M72 WeakPolarHBondContact O-CB 3.33Å; V69-M72 WeakPolarHBondContact O-CG 3.4Å; V69-M72 PolarHBondContact O-N 3.14Å; M72-D74 PolarHBondContact O-N 2.59Å; M72-D74 VanDerWaalsContact O-N 3.1Å; M72-L75 PolarHBondContact O-N 2.74Å
73	P	93.1	Very high	93.8	Very high	42 Å²	42	50.4 Å²	50.4	27%	0.273	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-52.3	-36.6	-177.3	-28	34.3	0	0	0	114.7	L75 W76 R77 H109	P73-L75 PolarHBondContact O-N 3.07Å; P73-W76 PolarHBondContact O-N 3.32Å; P73-W76 VanDerWaalsContact O-N 3.07Å; P73-R77 PolarHBondContact O-N 2.94Å; P73-H109 HydrophobicContact CB-CB 4.25Å
74	D	92.4	Very high	93.7	Very high	79 Å²	79	49 Å²	49	42%	0.422	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-54.4	-33.5	178.6	-76.8	-116.3	0	0	0	114	L45 K49 M72 W76	L45-D74 HydrophobicContact CD1-CB 3.92Å; L45-D74 HydrophobicContact CD2-CB 4.13Å; K49-D74 IonicContact NZ-OD1 3.77Å; K49-D74 PolarHBondContact NZ-OD1 2.87Å; M72-D74 PolarHBondContact O-N 2.59Å; M72-D74 VanDerWaalsContact O-N 3.1Å; D74-W76 VanDerWaalsContact C-N 3.34Å
75	L	93.8	Very high	93.4	Very high	11 Å²	11	42.1 Å²	42.1	6%	0.058	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-82.4	-14.3	-178.6	-63.8	179.6	0	0	0	113.4	L45 F48 K49 V69 M72 P73	L45-L75 HydrophobicContact CD1-CD1 4.1Å; L45-L75 HydrophobicContact CD1-CD2 3.66Å; L45-L75 HydrophobicContact CD1-CG 3.57Å; F48-L75 HydrophobicContact CB-CD1 3.84Å; F48-L75 HydrophobicContact CB-CD2 3.82Å; F48-L75 HydrophobicContact CB-CG 4.5Å; F48-L75 HydrophobicContact CD2-CD1 3.69Å; F48-L75 HydrophobicContact CG-CD1 4.2Å; K49-L75 HydrophobicContact CG-CD2 4.08Å; V69-L75 VanDerWaalsContact O-CD1 3.31Å; V69-L75 WeakPolarHBondContact O-CD1 3.21Å; M72-L75 PolarHBondContact O-N 2.74Å; P73-L75 PolarHBondContact O-N 3.07Å
76	W	94.4	Very high	93	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.015	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-116.7	16.5	-174	-60.3	94.6	0	0	0	113	L53 F70 P73 D74 C78 F79 L98 I102 H106 H109 L110	L53-W76 HydrophobicContact CD1-CH2 3.94Å; L53-W76 HydrophobicContact CD1-CZ3 4.22Å; F70-W76 HydrophobicContact CD1-CZ2 4.16Å; F70-W76 HydrophobicContact CE1-CH2 4.12Å; F70-W76 AromaticContact CE1-CZ2 3.55Å; F70-W76 HydrophobicContact CE1-CZ2 3.55Å; F70-W76 HydrophobicContact CE2-CZ2 4.08Å; F70-W76 AromaticContact CZ-CH2 3.82Å; F70-W76 HydrophobicContact CZ-CH2 3.82Å; F70-W76 AromaticContact CZ-CZ2 3.5Å; F70-W76 HydrophobicContact CZ-CZ2 3.5Å; F70-W76 PolarHBondContact O-NE1 3.08Å; P73-W76 PolarHBondContact O-N 3.32Å; P73-W76 VanDerWaalsContact O-N 3.07Å; D74-W76 VanDerWaalsContact C-N 3.34Å; W76-C78 PolarHBondContact O-N 3.33Å; W76-F79 HydrophobicContact CE3-CD2 4.16Å; W76-F79 HydrophobicContact CE3-CE2 4.48Å; W76-F79 HydrophobicContact CZ3-CD2 4.01Å; W76-F79 AromaticContact CZ3-CE2 3.87Å; W76-F79 HydrophobicContact CZ3-CE2 3.87Å; W76-L98 HydrophobicContact CH2-CD1 4.1Å; W76-L98 HydrophobicContact CZ3-CD1 4.41Å; W76-I102 HydrophobicContact CE3-CG1 4.06Å; W76-I102 HydrophobicContact CZ3-CD1 4.03Å; W76-I102 HydrophobicContact CZ3-CG1 3.64Å; W76-H106 HydrophobicContact CB-CB 3.94Å; W76-H106 AromaticContact CD1-CD2 3.97Å; W76-H106 AromaticContact CD1-CE1 3.38Å; W76-H106 AromaticContact CD1-CG 3.95Å; W76-H106 AromaticContact CD1-ND1 3.61Å; W76-H106 AromaticContact CD1-NE2 3.61Å; W76-H106 HydrophobicContact CD2-CB 4.49Å; W76-H106 AromaticContact CD2-CD2 3.39Å; W76-H106 AromaticContact CD2-CG 3.84Å; W76-H106 AromaticContact CD2-NE2 3.56Å; W76-H106 AromaticContact CE2-CD2 3.61Å; W76-H106 AromaticContact CE2-CE1 3.87Å; W76-H106 AromaticContact CE2-NE2 3.28Å; W76-H106 VanDerWaalsContact CE2-NE2 3.28Å; W76-H106 AromaticContact CE3-CD2 3.74Å; W76-H106 HydrophobicContact CG-CB 4.16Å; W76-H106 AromaticContact CG-CD2 3.66Å; W76-H106 AromaticContact CG-CE1 3.81Å; W76-H106 AromaticContact CG-CG 3.6Å; W76-H106 AromaticContact CG-ND1 3.72Å; W76-H106 AromaticContact CG-NE2 3.78Å; W76-H106 AromaticContact CZ2-NE2 3.77Å; W76-H106 AromaticContact NE1-CD2 3.96Å; W76-H106 AromaticContact NE1-CE1 3.44Å; W76-H106 PolarHBondContact NE1-CE1 3.2Å; W76-H106 AromaticContact NE1-NE2 3.33Å; W76-H106 PolarHBondContact NE1-NE2 3.42Å; W76-H109 HydrophobicContact CB-CB 4.39Å; W76-L110 WeakPolarHBondContact O-CD2 3.29Å
77	R	94.5	Very high	92.3	Very high	83 Å²	83	48.7 Å²	48.7	31%	0.313	27%	0.269	S	S	.	.	S	Bend	trans	-67.1	-28.4	173.3	-61.9	-51.9	-170.2	173.6	-3.9	112.5	P73 H109 Q111 Y112	P73-R77 PolarHBondContact O-N 2.94Å; R77-H109 WeakPolarHBondContact CD-O 3.39Å; R77-H109 PolarHBondContact NH1-O 3.42Å; R77-Q111 VanDerWaalsContact NH1-NE2 3.18Å; R77-Q111 PolarHBondContact O-N 3.27Å; R77-Y112 PolarHBondContact O-N 3.28Å
78	C	94.2	Very high	91.4	Very high	87 Å²	87	48 Å²	48	59%	0.588	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	131.4	-177	-171.8	0	0	0	0	110.3	W76 Y112	W76-C78 PolarHBondContact O-N 3.33Å; C78-Y112 VanDerWaalsContact CA-O 3.29Å; C78-Y112 WeakPolarHBondContact CA-O 3.4Å
79	F	94.6	Very high	90.8	Very high	14 Å²	14	43.8 Å²	43.8	6%	0.061	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	138.3	173.3	-157.8	-88.4	0	0	0	111.6	L53 W76 F81 T94 L98 I102 L110 Y112 V113 S114	L53-F79 HydrophobicContact CD1-CE2 4.41Å; L53-F79 HydrophobicContact CD2-CE2 3.47Å; L53-F79 VanDerWaalsContact CD2-CE2 3.47Å; L53-F79 HydrophobicContact CD2-CZ 3.79Å; W76-F79 HydrophobicContact CE3-CD2 4.16Å; W76-F79 HydrophobicContact CE3-CE2 4.48Å; W76-F79 HydrophobicContact CZ3-CD2 4.01Å; W76-F79 AromaticContact CZ3-CE2 3.87Å; W76-F79 HydrophobicContact CZ3-CE2 3.87Å; F79-F81 AromaticContact CD1-CD1 3.95Å; F79-F81 HydrophobicContact CD1-CD1 3.95Å; F79-F81 HydrophobicContact CD1-CD2 4.02Å; F79-F81 AromaticContact CD1-CE1 3.86Å; F79-F81 HydrophobicContact CD1-CE1 3.86Å; F79-F81 AromaticContact CD1-CE2 3.93Å; F79-F81 HydrophobicContact CD1-CE2 3.93Å; F79-F81 HydrophobicContact CD1-CG 4.02Å; F79-F81 AromaticContact CD1-CZ 3.86Å; F79-F81 HydrophobicContact CD1-CZ 3.86Å; F79-F81 AromaticContact CE1-CD1 3.79Å; F79-F81 HydrophobicContact CE1-CD1 3.79Å; F79-F81 AromaticContact CE1-CE1 3.88Å; F79-F81 HydrophobicContact CE1-CE1 3.88Å; F79-F81 HydrophobicContact CE1-CG 4.19Å; F79-F81 HydrophobicContact CE1-CZ 4.35Å; F79-T94 HydrophobicContact CE1-CG2 4.09Å; F79-T94 HydrophobicContact CZ-CG2 4.12Å; F79-L98 HydrophobicContact CZ-CD2 4.14Å; F79-L98 HydrophobicContact CZ-CG 4.5Å; F79-I102 HydrophobicContact CD1-CD1 3.9Å; F79-I102 HydrophobicContact CD2-CD1 3.74Å; F79-I102 HydrophobicContact CE1-CD1 3.54Å; F79-I102 HydrophobicContact CE2-CD1 3.34Å; F79-I102 HydrophobicContact CE2-CG1 4.4Å; F79-I102 HydrophobicContact CG-CD1 4Å; F79-I102 HydrophobicContact CZ-CD1 3.25Å; F79-L110 HydrophobicContact CB-CD2 3.79Å; F79-Y112 PolarHBondContact N-O 2.88Å; F79-V113 WeakPolarHBondContact O-CA 3.39Å; F79-S114 PolarHBondContact O-N 2.99Å; F79-S114 VanDerWaalsContact O-N 3.15Å
80	E	94.8	Very high	90.1	Very high	72 Å²	72	55.5 Å²	55.5	34%	0.336	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.9	173.5	178.5	158	-101.1	0	0	109	E82 S114 K116	E80-E82 PolarHBondContact O-N 3.36Å; E80-S114 CarbonylContact C-O 3.43Å; E80-S114 WeakPolarHBondContact CA-O 3.36Å; E80-S114 VanDerWaalsContact CB-OG 3.3Å; E80-S114 WeakPolarHBondContact CB-OG 3.47Å; E80-S114 WeakPolarHBondContact CG-OG 3.47Å; E80-S114 PolarHBondContact OE1-OG 3.18Å; E80-K116 HydrophobicContact CG-CD 4.08Å; E80-K116 HydrophobicContact CG-CG 4.43Å; E80-K116 WeakPolarHBondContact OE1-CE 3.35Å; E80-K116 IonicContact OE1-NZ 2.81Å; E80-K116 WeakPolarHBondContact OE2-CE 3.37Å; E80-K116 IonicContact OE2-NZ 3.49Å; E80-K116 PolarHBondContact OE2-NZ 3.42Å
81	F	94.8	Very high	89.5	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	109.9	175.5	-66.4	-82.9	0	0	0	109.3	F79 L83 I99 I102 V113 S114 F115 K116 I130	F79-F81 AromaticContact CD1-CD1 3.95Å; F79-F81 HydrophobicContact CD1-CD1 3.95Å; F79-F81 HydrophobicContact CD1-CD2 4.02Å; F79-F81 AromaticContact CD1-CE1 3.86Å; F79-F81 HydrophobicContact CD1-CE1 3.86Å; F79-F81 AromaticContact CD1-CE2 3.93Å; F79-F81 HydrophobicContact CD1-CE2 3.93Å; F79-F81 HydrophobicContact CD1-CG 4.02Å; F79-F81 AromaticContact CD1-CZ 3.86Å; F79-F81 HydrophobicContact CD1-CZ 3.86Å; F79-F81 AromaticContact CE1-CD1 3.79Å; F79-F81 HydrophobicContact CE1-CD1 3.79Å; F79-F81 AromaticContact CE1-CE1 3.88Å; F79-F81 HydrophobicContact CE1-CE1 3.88Å; F79-F81 HydrophobicContact CE1-CG 4.19Å; F79-F81 HydrophobicContact CE1-CZ 4.35Å; F81-L83 HydrophobicContact CB-CD2 4.44Å; F81-L83 HydrophobicContact CB-CG 4.27Å; F81-L83 PolarHBondContact O-N 3.35Å; F81-I99 HydrophobicContact CD1-CG1 4.15Å; F81-I99 HydrophobicContact CE1-CG1 4.21Å; F81-I99 HydrophobicContact CE1-CG2 4.21Å; F81-I102 HydrophobicContact CE1-CD1 4.18Å; F81-I102 HydrophobicContact CZ-CG2 4.06Å; F81-V113 HydrophobicContact CD2-CG1 3.91Å; F81-V113 HydrophobicContact CE2-CG1 3.8Å; F81-S114 PolarHBondContact N-O 3.01Å; F81-F115 HydrophobicContact CB-CD1 3.63Å; F81-F115 HydrophobicContact CB-CE1 3.93Å; F81-F115 HydrophobicContact CB-CG 4.32Å; F81-F115 AromaticContact CD2-CD1 3.94Å; F81-F115 HydrophobicContact CD2-CD1 3.94Å; F81-F115 AromaticContact CD2-CE1 3.5Å; F81-F115 HydrophobicContact CD2-CE1 3.5Å; F81-F115 HydrophobicContact CD2-CE2 4.21Å; F81-F115 HydrophobicContact CD2-CG 4.46Å; F81-F115 AromaticContact CD2-CZ 3.66Å; F81-F115 HydrophobicContact CD2-CZ 3.66Å; F81-F115 HydrophobicContact CE2-CE1 4.15Å; F81-F115 AromaticContact CE2-CZ 3.98Å; F81-F115 HydrophobicContact CE2-CZ 3.98Å; F81-F115 HydrophobicContact CG-CD1 4.01Å; F81-F115 AromaticContact CG-CE1 3.77Å; F81-F115 HydrophobicContact CG-CE1 3.77Å; F81-F115 HydrophobicContact CG-CZ 4.39Å; F81-F115 WeakPolarHBondContact O-CA 3.47Å; F81-K116 PolarHBondContact O-N 3.12Å; F81-I130 HydrophobicContact CD1-CD1 4.22Å; F81-I130 HydrophobicContact CE1-CG2 4.48Å; F81-I130 HydrophobicContact CE2-CG2 4.37Å; F81-I130 HydrophobicContact CZ-CG2 4.2Å
82	E	94.7	Very high	89.1	Confident	41 Å²	41	67.2 Å²	67.2	19%	0.192	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	107	167.4	-64.3	-73.8	-176.8	0	0	108.4	E80 A93 T94 K116	E80-E82 PolarHBondContact O-N 3.36Å; E82-A93 WeakPolarHBondContact O-CA 3.37Å; E82-T94 PolarHBondContact N-OG1 3.44Å; E82-T94 PolarHBondContact O-N 3.24Å; E82-T94 PolarHBondContact O-OG1 3.02Å; E82-T94 VanDerWaalsContact O-OG1 3.12Å; E82-K116 WeakPolarHBondContact OE1-CD 3.42Å; E82-K116 IonicContact OE1-NZ 2.62Å; E82-K116 PolarHBondContact OE1-NZ 3.13Å; E82-K116 VanDerWaalsContact OE2-CB 3.29Å; E82-K116 WeakPolarHBondContact OE2-CB 3.05Å; E82-K116 VanDerWaalsContact OE2-CD 3.27Å; E82-K116 WeakPolarHBondContact OE2-CD 3.38Å
83	L	93.9	Very high	88.9	Confident	12 Å²	12	67.8 Å²	67.8	6%	0.063	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	100.8	-179.7	-58.6	-179.3	0	0	0	108.7	F81 I99 F115 K116 V117 D118 S123 A126 A127 I130	F81-L83 HydrophobicContact CB-CD2 4.44Å; F81-L83 HydrophobicContact CB-CG 4.27Å; F81-L83 PolarHBondContact O-N 3.35Å; L83-I99 HydrophobicContact CD2-CD1 4.09Å; L83-F115 HydrophobicContact CD1-CD1 3.8Å; L83-F115 HydrophobicContact CD1-CE1 4.44Å; L83-K116 PolarHBondContact N-O 2.84Å; L83-V117 HydrophobicContact CB-CG2 4.43Å; L83-V117 HydrophobicContact CD1-CG2 4.38Å; L83-V117 WeakPolarHBondContact O-CA 3.29Å; L83-D118 PolarHBondContact O-N 3.05Å; L83-D118 VanDerWaalsContact O-N 3.16Å; L83-S123 WeakPolarHBondContact O-CB 3.31Å; L83-S123 PolarHBondContact O-OG 3.39Å; L83-A126 HydrophobicContact CD1-CB 4.39Å; L83-A127 HydrophobicContact CD1-CB 3.58Å; L83-I130 HydrophobicContact CD1-CD1 4.21Å; L83-I130 HydrophobicContact CD2-CD1 4.13Å
84	N	91	Very high	88.7	Confident	11 Å²	11	66.6 Å²	66.6	6%	0.059	35%	0.354	C	S	.	.			trans	-144.5	153.8	-177.4	53.7	59.4	0	0	0	111.5	L91 K92 A93 D118	N84-L91 PolarHBondContact OD1-O 3.07Å; N84-L91 VanDerWaalsContact OD1-O 3.11Å; N84-K92 PolarHBondContact ND2-O 3.15Å; N84-A93 VanDerWaalsContact OD1-CA 3.29Å; N84-A93 WeakPolarHBondContact OD1-CA 3.45Å; N84-A93 WeakPolarHBondContact OD1-CB 3.33Å; N84-A93 PolarHBondContact OD1-N 3.11Å; N84-D118 VanDerWaalsContact CA-OD2 3.3Å; N84-D118 WeakPolarHBondContact CA-OD2 3.24Å; N84-D118 HydrophobicContact CB-CB 3.95Å; N84-D118 WeakPolarHBondContact CB-OD2 3.24Å
85	Q	86.6	Confident	88.6	Confident	76 Å²	76	68.7 Å²	68.7	36%	0.355	36%	0.361	S	S	.	.			trans	-107	143.9	174.9	-60.3	-59.1	-32.3	0	0	110	A87 T88 S89 D118 S120	Q85-A87 PolarHBondContact O-N 3.18Å; Q85-T88 PolarHBondContact O-N 2.93Å; Q85-T88 PolarHBondContact O-OG1 3.11Å; Q85-S89 PolarHBondContact O-N 3.02Å; Q85-D118 PolarHBondContact N-OD2 2.84Å; Q85-S120 VanDerWaalsContact CG-OG 3.27Å; Q85-S120 WeakPolarHBondContact CG-OG 3.42Å
86	P	85.2	Confident	88.4	Confident	121 Å²	121	72 Å²	72	79%	0.786	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-23.9	174.4	-24.8	33.9	0	0	0	113.8	T88	P86-T88 VanDerWaalsContact C-N 3.33Å
87	A	79.6	Confident	88.1	Confident	97 Å²	97	76.9 Å²	76.9	80%	0.802	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-24.5	178	0	0	0	0	0	113.5	Q85	Q85-A87 PolarHBondContact O-N 3.18Å
88	T	75.4	Confident	87.9	Confident	52 Å²	52	74.7 Å²	74.7	32%	0.319	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	-2.1	-169.7	41.6	0	0	0	0	113.6	Q85 P86 D118	Q85-T88 PolarHBondContact O-N 2.93Å; Q85-T88 PolarHBondContact O-OG1 3.11Å; P86-T88 VanDerWaalsContact C-N 3.33Å; T88-D118 WeakPolarHBondContact CB-OD2 3.4Å; T88-D118 VanDerWaalsContact OG1-CG 3.3Å; T88-D118 PolarHBondContact OG1-OD2 2.86Å
89	S	79.9	Confident	87.8	Confident	23 Å²	23	71.6 Å²	71.6	16%	0.161	38%	0.378	C	S	.	.			trans	-149.5	146.3	179.9	-172.4	0	0	0	0	112.9	Q85 L91	Q85-S89 PolarHBondContact O-N 3.02Å; S89-L91 PolarHBondContact OG-N 3.44Å; S89-L91 VanDerWaalsContact OG-N 3.12Å
90	Y	78.1	Confident	87.7	Confident	245 Å²	245	76.9 Å²	76.9	96%	0.961	40%	0.401	S	S	*	.	S	Bend	trans	-88.8	-7	170.8	-57.4	-77.7	0	0	0	112.9
91	L	82.1	Confident	87.5	Confident	109 Å²	109	76 Å²	76	57%	0.571	40%	0.397	S	S	*	.	S	Bend	trans	-83.7	161.7	-179.8	-59.8	177.5	0	0	0	111.1	N84 S89	N84-L91 PolarHBondContact OD1-O 3.07Å; N84-L91 VanDerWaalsContact OD1-O 3.11Å; S89-L91 PolarHBondContact OG-N 3.44Å; S89-L91 VanDerWaalsContact OG-N 3.12Å
92	K	83.6	Confident	87.4	Confident	193 Å²	193	76 Å²	76	84%	0.839	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-89.8	131.7	176	-67	-172.8	179.6	-179.6	0	110.3	N84	N84-K92 PolarHBondContact ND2-O 3.15Å
93	A	89.5	Confident	87.3	Confident	51 Å²	51	75.2 Å²	75.2	42%	0.421	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-71.3	157.7	173.2	0	0	0	0	0	111.8	E82 N84 H95	E82-A93 WeakPolarHBondContact O-CA 3.37Å; N84-A93 VanDerWaalsContact OD1-CA 3.29Å; N84-A93 WeakPolarHBondContact OD1-CA 3.45Å; N84-A93 WeakPolarHBondContact OD1-CB 3.33Å; N84-A93 PolarHBondContact OD1-N 3.11Å; A93-H95 PolarHBondContact O-N 3.41Å
94	T	89.8	Confident	87.3	Confident	18 Å²	18	83.4 Å²	83.4	11%	0.11	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-63.7	128.4	167.3	-51.7	0	0	0	0	109.1	F79 E82 L98 I99	F79-T94 HydrophobicContact CE1-CG2 4.09Å; F79-T94 HydrophobicContact CZ-CG2 4.12Å; E82-T94 PolarHBondContact N-OG1 3.44Å; E82-T94 PolarHBondContact O-N 3.24Å; E82-T94 PolarHBondContact O-OG1 3.02Å; E82-T94 VanDerWaalsContact O-OG1 3.12Å; T94-L98 HydrophobicContact CG2-CD2 4.08Å; T94-L98 HydrophobicContact CG2-CG 4.45Å; T94-I99 HydrophobicContact CG2-CD1 4.31Å; T94-I99 HydrophobicContact CG2-CG1 3.73Å
95	H	89.3	Confident	87.4	Confident	122 Å²	122	89.2 Å²	89.2	57%	0.565	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-61.1	133.1	-176.9	-169	-85	0	0	0	111.5	A93 E97 L98 I99	A93-H95 PolarHBondContact O-N 3.41Å; H95-E97 VanDerWaalsContact C-N 3.31Å; H95-E97 PolarHBondContact ND1-N 3.14Å; H95-E97 PolarHBondContact O-N 3.08Å; H95-L98 HydrophobicContact CB-CB 4.31Å; H95-L98 WeakPolarHBondContact O-CA 3.5Å; H95-L98 VanDerWaalsContact O-CB 3.3Å; H95-L98 WeakPolarHBondContact O-CB 3.17Å; H95-L98 PolarHBondContact O-N 2.87Å; H95-I99 PolarHBondContact O-N 3.25Å
96	P	90.1	Very high	87.7	Confident	81 Å²	81	85.8 Å²	85.8	53%	0.526	43%	0.433	S	S	.	.	H	α-helix	trans	-56.2	-38.8	-175.1	-29.1	35.4	0	0	0	114.8	L98 I99 K100	P96-L98 VanDerWaalsContact C-N 3.28Å; P96-L98 PolarHBondContact O-N 2.89Å; P96-I99 WeakPolarHBondContact O-CB 3.38Å; P96-I99 PolarHBondContact O-N 3.14Å; P96-K100 WeakPolarHBondContact O-CG 3.42Å; P96-K100 PolarHBondContact O-N 3.41Å; P96-K100 VanDerWaalsContact O-N 3.07Å
97	E	88.4	Confident	88	Confident	107 Å²	107	80.6 Å²	80.6	50%	0.5	40%	0.4	S	S	.	.	H	α-helix	trans	-67.1	-29.5	177.2	-64.4	-55.1	114.7	0	0	113	H95 K100 Q101	H95-E97 VanDerWaalsContact C-N 3.31Å; H95-E97 PolarHBondContact ND1-N 3.14Å; H95-E97 PolarHBondContact O-N 3.08Å; E97-K100 IonicContact OE1-NZ 2.74Å; E97-K100 PolarHBondContact OE1-NZ 2.98Å; E97-Q101 WeakPolarHBondContact O-CB 3.18Å; E97-Q101 PolarHBondContact O-N 3.48Å
98	L	89.9	Confident	88.7	Confident	36 Å²	36	80.5 Å²	80.5	19%	0.188	39%	0.386	C	S	.	.	H	α-helix	trans	-70.3	-41.3	175	179.5	60.4	0	0	0	110.5	L53 W76 F79 T94 H95 P96 K100 Q101 I102	L53-L98 HydrophobicContact CD2-CD2 4.02Å; W76-L98 HydrophobicContact CH2-CD1 4.1Å; W76-L98 HydrophobicContact CZ3-CD1 4.41Å; F79-L98 HydrophobicContact CZ-CD2 4.14Å; F79-L98 HydrophobicContact CZ-CG 4.5Å; T94-L98 HydrophobicContact CG2-CD2 4.08Å; T94-L98 HydrophobicContact CG2-CG 4.45Å; H95-L98 HydrophobicContact CB-CB 4.31Å; H95-L98 WeakPolarHBondContact O-CA 3.5Å; H95-L98 VanDerWaalsContact O-CB 3.3Å; H95-L98 WeakPolarHBondContact O-CB 3.17Å; H95-L98 PolarHBondContact O-N 2.87Å; P96-L98 VanDerWaalsContact C-N 3.28Å; P96-L98 PolarHBondContact O-N 2.89Å; L98-K100 PolarHBondContact O-N 2.95Å; L98-Q101 WeakPolarHBondContact O-CB 3.23Å; L98-Q101 PolarHBondContact O-N 3.03Å; L98-Q101 VanDerWaalsContact O-N 3.16Å; L98-I102 HydrophobicContact CD1-CD1 4.15Å; L98-I102 HydrophobicContact CD1-CG1 4.3Å; L98-I102 HydrophobicContact CG-CD1 3.89Å; L98-I102 HydrophobicContact CG-CG1 4.49Å; L98-I102 WeakPolarHBondContact O-CD1 3.21Å; L98-I102 VanDerWaalsContact O-CG1 3.25Å; L98-I102 WeakPolarHBondContact O-CG1 3.41Å; L98-I102 PolarHBondContact O-N 2.94Å
99	I	92.6	Very high	89.6	Confident	23 Å²	23	79.6 Å²	79.6	12%	0.118	38%	0.378	C	S	.	.	H	α-helix	trans	-57.2	-50.8	174.2	-60.8	174.3	0	0	0	110	F81 L83 T94 H95 P96 Q101 I102 I103 I130	F81-I99 HydrophobicContact CD1-CG1 4.15Å; F81-I99 HydrophobicContact CE1-CG1 4.21Å; F81-I99 HydrophobicContact CE1-CG2 4.21Å; L83-I99 HydrophobicContact CD2-CD1 4.09Å; T94-I99 HydrophobicContact CG2-CD1 4.31Å; T94-I99 HydrophobicContact CG2-CG1 3.73Å; H95-I99 PolarHBondContact O-N 3.25Å; P96-I99 WeakPolarHBondContact O-CB 3.38Å; P96-I99 PolarHBondContact O-N 3.14Å; I99-Q101 VanDerWaalsContact C-N 3.29Å; I99-Q101 PolarHBondContact O-N 3.49Å; I99-I102 PolarHBondContact O-N 3.26Å; I99-I103 HydrophobicContact CG2-CD1 3.85Å; I99-I103 WeakPolarHBondContact O-CG1 3.38Å; I99-I103 PolarHBondContact O-N 2.95Å; I99-I130 HydrophobicContact CD1-CD1 4.18Å; I99-I130 HydrophobicContact CG2-CD1 3.67Å; I99-I130 HydrophobicContact CG2-CG1 3.77Å
100	K	92.1	Very high	90.4	Very high	124 Å²	124	78.6 Å²	78.6	54%	0.539	37%	0.371	S	S	.	.	H	α-helix	trans	-57.5	-41.9	176	-68.8	176.2	-171.5	165.7	0	112.1	P96 E97 L98 K104	P96-K100 WeakPolarHBondContact O-CG 3.42Å; P96-K100 PolarHBondContact O-N 3.41Å; P96-K100 VanDerWaalsContact O-N 3.07Å; E97-K100 IonicContact OE1-NZ 2.74Å; E97-K100 PolarHBondContact OE1-NZ 2.98Å; L98-K100 PolarHBondContact O-N 2.95Å; K100-K104 WeakPolarHBondContact O-CB 3.4Å; K100-K104 PolarHBondContact O-N 3.41Å
101	Q	91.5	Very high	91.2	Very high	55 Å²	55	68.8 Å²	68.8	26%	0.257	33%	0.334	S	S	.	.	H	α-helix	trans	-64.2	-42.8	178.7	-173.8	179.5	35	0	0	112	H71 E97 L98 I99 K104 R105	H71-Q101 PolarHBondContact CE1-NE2 2.92Å; E97-Q101 WeakPolarHBondContact O-CB 3.18Å; E97-Q101 PolarHBondContact O-N 3.48Å; L98-Q101 WeakPolarHBondContact O-CB 3.23Å; L98-Q101 PolarHBondContact O-N 3.03Å; L98-Q101 VanDerWaalsContact O-N 3.16Å; I99-Q101 VanDerWaalsContact C-N 3.29Å; I99-Q101 PolarHBondContact O-N 3.49Å; Q101-K104 PolarHBondContact O-N 2.93Å; Q101-R105 HydrophobicContact CG-CG 4.48Å; Q101-R105 WeakPolarHBondContact O-CB 3.29Å; Q101-R105 PolarHBondContact O-N 3.06Å
102	I	92.3	Very high	92	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-63	-51.3	179	-69.5	161.1	0	0	0	110.3	W76 F79 F81 L98 I99 K104 R105 H106 S107 L110	W76-I102 HydrophobicContact CE3-CG1 4.06Å; W76-I102 HydrophobicContact CZ3-CD1 4.03Å; W76-I102 HydrophobicContact CZ3-CG1 3.64Å; F79-I102 HydrophobicContact CD1-CD1 3.9Å; F79-I102 HydrophobicContact CD2-CD1 3.74Å; F79-I102 HydrophobicContact CE1-CD1 3.54Å; F79-I102 HydrophobicContact CE2-CD1 3.34Å; F79-I102 HydrophobicContact CE2-CG1 4.4Å; F79-I102 HydrophobicContact CG-CD1 4Å; F79-I102 HydrophobicContact CZ-CD1 3.25Å; F81-I102 HydrophobicContact CE1-CD1 4.18Å; F81-I102 HydrophobicContact CZ-CG2 4.06Å; L98-I102 HydrophobicContact CD1-CD1 4.15Å; L98-I102 HydrophobicContact CD1-CG1 4.3Å; L98-I102 HydrophobicContact CG-CD1 3.89Å; L98-I102 HydrophobicContact CG-CG1 4.49Å; L98-I102 WeakPolarHBondContact O-CD1 3.21Å; L98-I102 VanDerWaalsContact O-CG1 3.25Å; L98-I102 WeakPolarHBondContact O-CG1 3.41Å; L98-I102 PolarHBondContact O-N 2.94Å; I99-I102 PolarHBondContact O-N 3.26Å; I102-K104 VanDerWaalsContact C-N 3.28Å; I102-K104 PolarHBondContact O-N 2.67Å; I102-R105 PolarHBondContact O-N 3.32Å; I102-H106 CarbonylContact O-C 3.6Å; I102-H106 WeakPolarHBondContact O-CA 3.39Å; I102-H106 WeakPolarHBondContact O-CB 3.47Å; I102-H106 PolarHBondContact O-N 3.03Å; I102-S107 PolarHBondContact O-N 3.14Å; I102-L110 HydrophobicContact CG2-CD1 3.88Å; I102-L110 HydrophobicContact CG2-CD2 4.33Å; I102-L110 HydrophobicContact CG2-CG 4.46Å
103	I	93.1	Very high	92.7	Very high	23 Å²	23	59 Å²	59	12%	0.118	29%	0.285	C	S	.	.	H	α-helix	trans	-58.6	-44.4	179.7	-64.4	168.9	0	0	0	110.2	I99 S107 I130 Q133	I99-I103 HydrophobicContact CG2-CD1 3.85Å; I99-I103 WeakPolarHBondContact O-CG1 3.38Å; I99-I103 PolarHBondContact O-N 2.95Å; I103-S107 VanDerWaalsContact O-CB 3.25Å; I103-S107 WeakPolarHBondContact O-CB 3.31Å; I103-S107 PolarHBondContact O-OG 2.99Å; I103-I130 HydrophobicContact CD1-CG1 4.35Å; I103-I130 HydrophobicContact CD1-CG2 4.16Å; I103-Q133 HydrophobicContact CD1-CB 4.43Å; I103-Q133 HydrophobicContact CG2-CB 3.89Å
104	K	93.5	Very high	93	Very high	185 Å²	185	57.7 Å²	57.7	80%	0.804	27%	0.273	S	S	*	.	H	α-helix	trans	-72.8	-39.5	-176.5	-173.4	174.2	-177.2	174.8	0	114.1	K100 Q101 I102	K100-K104 WeakPolarHBondContact O-CB 3.4Å; K100-K104 PolarHBondContact O-N 3.41Å; Q101-K104 PolarHBondContact O-N 2.93Å; I102-K104 VanDerWaalsContact C-N 3.28Å; I102-K104 PolarHBondContact O-N 2.67Å
105	R	92.6	Very high	93.4	Very high	133 Å²	133	56.9 Å²	56.9	50%	0.502	27%	0.268	S	S	.	.	H	α-helix	trans	-105.8	-24.8	-170.4	-65.5	-168.4	174.6	-176	-1.6	114.4	H71 Q101 I102	H71-R105 PolarHBondContact NE2-NH1 3.24Å; Q101-R105 HydrophobicContact CG-CG 4.48Å; Q101-R105 WeakPolarHBondContact O-CB 3.29Å; Q101-R105 PolarHBondContact O-N 3.06Å; I102-R105 PolarHBondContact O-N 3.32Å
106	H	93.8	Very high	93.8	Very high	3 Å²	3	53.8 Å²	53.8	1%	0.014	25%	0.253	C	S	.	.	H	α-helix	trans	-130	4.8	-165.4	-55.7	-54.3	0	0	0	114.3	H71 W76 I102 N108 H109 L110	H71-H106 AromaticContact ND1-CE1 3.79Å; H71-H106 AromaticContact ND1-NE2 3.53Å; W76-H106 HydrophobicContact CB-CB 3.94Å; W76-H106 AromaticContact CD1-CD2 3.97Å; W76-H106 AromaticContact CD1-CE1 3.38Å; W76-H106 AromaticContact CD1-CG 3.95Å; W76-H106 AromaticContact CD1-ND1 3.61Å; W76-H106 AromaticContact CD1-NE2 3.61Å; W76-H106 HydrophobicContact CD2-CB 4.49Å; W76-H106 AromaticContact CD2-CD2 3.39Å; W76-H106 AromaticContact CD2-CG 3.84Å; W76-H106 AromaticContact CD2-NE2 3.56Å; W76-H106 AromaticContact CE2-CD2 3.61Å; W76-H106 AromaticContact CE2-CE1 3.87Å; W76-H106 AromaticContact CE2-NE2 3.28Å; W76-H106 VanDerWaalsContact CE2-NE2 3.28Å; W76-H106 AromaticContact CE3-CD2 3.74Å; W76-H106 HydrophobicContact CG-CB 4.16Å; W76-H106 AromaticContact CG-CD2 3.66Å; W76-H106 AromaticContact CG-CE1 3.81Å; W76-H106 AromaticContact CG-CG 3.6Å; W76-H106 AromaticContact CG-ND1 3.72Å; W76-H106 AromaticContact CG-NE2 3.78Å; W76-H106 AromaticContact CZ2-NE2 3.77Å; W76-H106 AromaticContact NE1-CD2 3.96Å; W76-H106 AromaticContact NE1-CE1 3.44Å; W76-H106 PolarHBondContact NE1-CE1 3.2Å; W76-H106 AromaticContact NE1-NE2 3.33Å; W76-H106 PolarHBondContact NE1-NE2 3.42Å; I102-H106 CarbonylContact O-C 3.6Å; I102-H106 WeakPolarHBondContact O-CA 3.39Å; I102-H106 WeakPolarHBondContact O-CB 3.47Å; I102-H106 PolarHBondContact O-N 3.03Å; H106-N108 VanDerWaalsContact C-N 3.29Å; H106-N108 PolarHBondContact O-N 3.27Å; H106-H109 HydrophobicContact CB-CB 4.43Å; H106-H109 AromaticContact ND1-ND1 3.36Å; H106-H109 PolarHBondContact ND1-ND1 2.7Å; H106-H109 WeakPolarHBondContact O-CA 3.42Å; H106-H109 WeakPolarHBondContact O-CB 3.48Å; H106-H109 PolarHBondContact O-N 3.42Å; H106-L110 WeakPolarHBondContact O-CG 3.49Å; H106-L110 PolarHBondContact O-N 3.24Å
107	S	91.4	Very high	94.1	Very high	12 Å²	12	49.9 Å²	49.9	8%	0.084	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-44.2	179.2	42.6	0	0	0	0	112.8	I102 I103 H109 L110 C137	I102-S107 PolarHBondContact O-N 3.14Å; I103-S107 VanDerWaalsContact O-CB 3.25Å; I103-S107 WeakPolarHBondContact O-CB 3.31Å; I103-S107 PolarHBondContact O-OG 2.99Å; S107-H109 PolarHBondContact O-N 2.89Å; S107-L110 PolarHBondContact O-N 3.06Å; S107-C137 PolarHBondContact O-SG 3.32Å
108	N	93.6	Very high	94.4	Very high	96 Å²	96	44.9 Å²	44.9	51%	0.513	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-12.4	175.1	63.2	-17.9	0	0	0	114.6	H106 N136	H106-N108 VanDerWaalsContact C-N 3.29Å; H106-N108 PolarHBondContact O-N 3.27Å; N108-N136 WeakPolarHBondContact CA-O 3.48Å
109	H	94.9	Very high	94.6	Very high	33 Å²	33	44 Å²	44	15%	0.153	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-31.5	177.5	-54.8	146.8	0	0	0	111.9	P73 W76 R77 H106 S107 Q111	P73-H109 HydrophobicContact CB-CB 4.25Å; W76-H109 HydrophobicContact CB-CB 4.39Å; R77-H109 WeakPolarHBondContact CD-O 3.39Å; R77-H109 PolarHBondContact NH1-O 3.42Å; H106-H109 HydrophobicContact CB-CB 4.43Å; H106-H109 AromaticContact ND1-ND1 3.36Å; H106-H109 PolarHBondContact ND1-ND1 2.7Å; H106-H109 WeakPolarHBondContact O-CA 3.42Å; H106-H109 WeakPolarHBondContact O-CB 3.48Å; H106-H109 PolarHBondContact O-N 3.42Å; S107-H109 PolarHBondContact O-N 2.89Å; H109-Q111 PolarHBondContact O-N 2.89Å
110	L	95.4	Very high	94.8	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	20%	0.198	C	C	.	.			trans	-57.7	132.7	-178.8	-68.4	170.8	0	0	0	111.7	W76 F79 I102 H106 S107 V113 L139	W76-L110 WeakPolarHBondContact O-CD2 3.29Å; F79-L110 HydrophobicContact CB-CD2 3.79Å; I102-L110 HydrophobicContact CG2-CD1 3.88Å; I102-L110 HydrophobicContact CG2-CD2 4.33Å; I102-L110 HydrophobicContact CG2-CG 4.46Å; H106-L110 WeakPolarHBondContact O-CG 3.49Å; H106-L110 PolarHBondContact O-N 3.24Å; S107-L110 PolarHBondContact O-N 3.06Å; L110-V113 HydrophobicContact CB-CG2 4.01Å; L110-V113 HydrophobicContact CD1-CG2 4.17Å; L110-V113 HydrophobicContact CD2-CG2 4.07Å; L110-V113 HydrophobicContact CG-CG2 4.32Å; L110-L139 HydrophobicContact CB-CD2 4.02Å
111	Q	96.7	Very high	94.9	Very high	39 Å²	39	41.2 Å²	41.2	18%	0.182	19%	0.189	C	C	.	.			trans	-130.5	-33.5	175.6	-69.2	-178.4	10.7	0	0	111.9	R77 H109 K140 T141	R77-Q111 VanDerWaalsContact NH1-NE2 3.18Å; R77-Q111 PolarHBondContact O-N 3.27Å; H109-Q111 PolarHBondContact O-N 2.89Å; Q111-K140 HydrophobicContact CB-CD 4.39Å; Q111-K140 HydrophobicContact CB-CG 4.46Å; Q111-K140 PolarHBondContact O-N 3.04Å; Q111-T141 PolarHBondContact O-N 3.28Å
112	Y	97.5	Very high	95.2	Very high	94 Å²	94	44 Å²	44	37%	0.369	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	105.8	-177.1	-52.5	-87.5	0	0	0	108.3	R77 C78 F79 K140 T141	R77-Y112 PolarHBondContact O-N 3.28Å; C78-Y112 VanDerWaalsContact CA-O 3.29Å; C78-Y112 WeakPolarHBondContact CA-O 3.4Å; F79-Y112 PolarHBondContact N-O 2.88Å; Y112-K140 HydrophobicContact CE1-CB 4.08Å; Y112-K140 HydrophobicContact CE1-CD 4.35Å; Y112-K140 WeakPolarHBondContact OH-CD 3.3Å; Y112-T141 WeakPolarHBondContact CD1-OG1 3.11Å
113	V	97.8	Very high	95.3	Very high	3 Å²	3	44 Å²	44	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	132	-175.8	176.5	0	0	0	0	110.1	F79 F81 L110 F115 L139 T141 L142 G143	F79-V113 WeakPolarHBondContact O-CA 3.39Å; F81-V113 HydrophobicContact CD2-CG1 3.91Å; F81-V113 HydrophobicContact CE2-CG1 3.8Å; L110-V113 HydrophobicContact CB-CG2 4.01Å; L110-V113 HydrophobicContact CD1-CG2 4.17Å; L110-V113 HydrophobicContact CD2-CG2 4.07Å; L110-V113 HydrophobicContact CG-CG2 4.32Å; V113-F115 HydrophobicContact CG1-CD2 4.02Å; V113-F115 HydrophobicContact CG1-CE2 3.44Å; V113-F115 VanDerWaalsContact CG1-CE2 3.44Å; V113-F115 HydrophobicContact CG1-CZ 4.04Å; V113-L139 HydrophobicContact CB-CD1 4.26Å; V113-L139 HydrophobicContact CB-CD2 4.29Å; V113-L139 HydrophobicContact CG2-CD1 4.34Å; V113-L139 HydrophobicContact CG2-CD2 3.6Å; V113-T141 PolarHBondContact N-O 3.23Å; V113-L142 HydrophobicContact CG1-CD1 4.48Å; V113-L142 CarbonylContact O-C 3.52Å; V113-L142 VanDerWaalsContact O-CA 3.3Å; V113-L142 WeakPolarHBondContact O-CA 3.45Å; V113-G143 PolarHBondContact O-N 3.13Å
114	S	97.8	Very high	95.6	Very high	23 Å²	23	42.9 Å²	42.9	16%	0.161	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	150.6	166.3	51.3	0	0	0	0	111.3	F79 E80 F81 G143	F79-S114 PolarHBondContact O-N 2.99Å; F79-S114 VanDerWaalsContact O-N 3.15Å; E80-S114 CarbonylContact C-O 3.43Å; E80-S114 WeakPolarHBondContact CA-O 3.36Å; E80-S114 VanDerWaalsContact CB-OG 3.3Å; E80-S114 WeakPolarHBondContact CB-OG 3.47Å; E80-S114 WeakPolarHBondContact CG-OG 3.47Å; E80-S114 PolarHBondContact OE1-OG 3.18Å; F81-S114 PolarHBondContact N-O 3.01Å; S114-G143 CarbonylContact C-O 3.54Å; S114-G143 WeakPolarHBondContact CA-O 3.47Å
115	F	97.9	Very high	95.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	119.1	171.5	-67.2	-96	0	0	0	107.7	F81 L83 V113 V117 A127 I130 L131 L142 G143 L144 I145	F81-F115 HydrophobicContact CB-CD1 3.63Å; F81-F115 HydrophobicContact CB-CE1 3.93Å; F81-F115 HydrophobicContact CB-CG 4.32Å; F81-F115 AromaticContact CD2-CD1 3.94Å; F81-F115 HydrophobicContact CD2-CD1 3.94Å; F81-F115 AromaticContact CD2-CE1 3.5Å; F81-F115 HydrophobicContact CD2-CE1 3.5Å; F81-F115 HydrophobicContact CD2-CE2 4.21Å; F81-F115 HydrophobicContact CD2-CG 4.46Å; F81-F115 AromaticContact CD2-CZ 3.66Å; F81-F115 HydrophobicContact CD2-CZ 3.66Å; F81-F115 HydrophobicContact CE2-CE1 4.15Å; F81-F115 AromaticContact CE2-CZ 3.98Å; F81-F115 HydrophobicContact CE2-CZ 3.98Å; F81-F115 HydrophobicContact CG-CD1 4.01Å; F81-F115 AromaticContact CG-CE1 3.77Å; F81-F115 HydrophobicContact CG-CE1 3.77Å; F81-F115 HydrophobicContact CG-CZ 4.39Å; F81-F115 WeakPolarHBondContact O-CA 3.47Å; L83-F115 HydrophobicContact CD1-CD1 3.8Å; L83-F115 HydrophobicContact CD1-CE1 4.44Å; V113-F115 HydrophobicContact CG1-CD2 4.02Å; V113-F115 HydrophobicContact CG1-CE2 3.44Å; V113-F115 VanDerWaalsContact CG1-CE2 3.44Å; V113-F115 HydrophobicContact CG1-CZ 4.04Å; F115-V117 HydrophobicContact CB-CG2 4.16Å; F115-A127 HydrophobicContact CD1-CB 4.04Å; F115-I130 HydrophobicContact CE1-CB 3.84Å; F115-I130 HydrophobicContact CE1-CD1 3.99Å; F115-I130 HydrophobicContact CE1-CG2 3.67Å; F115-I130 HydrophobicContact CZ-CB 4.16Å; F115-I130 HydrophobicContact CZ-CG2 3.66Å; F115-L131 HydrophobicContact CD2-CD2 4.37Å; F115-L131 HydrophobicContact CE2-CD2 3.59Å; F115-L131 HydrophobicContact CE2-CG 4.13Å; F115-L131 HydrophobicContact CZ-CD2 3.99Å; F115-L131 HydrophobicContact CZ-CG 4.16Å; F115-L142 HydrophobicContact CD2-CD1 4.13Å; F115-L142 HydrophobicContact CE2-CD1 4.01Å; F115-G143 PolarHBondContact N-O 3.07Å; F115-L144 HydrophobicContact CB-CD2 3.95Å; F115-L144 HydrophobicContact CD2-CD2 3.57Å; F115-L144 HydrophobicContact CE2-CD2 4.41Å; F115-L144 HydrophobicContact CG-CD2 4.03Å; F115-I145 PolarHBondContact O-N 3.47Å
116	K	96.8	Very high	96	Very high	57 Å²	57	32.4 Å²	32.4	25%	0.248	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	116.9	167.7	-79.7	170.5	172.3	169.2	0	107.9	E80 F81 E82 L83 I145 T147	E80-K116 HydrophobicContact CG-CD 4.08Å; E80-K116 HydrophobicContact CG-CG 4.43Å; E80-K116 WeakPolarHBondContact OE1-CE 3.35Å; E80-K116 IonicContact OE1-NZ 2.81Å; E80-K116 WeakPolarHBondContact OE2-CE 3.37Å; E80-K116 IonicContact OE2-NZ 3.49Å; E80-K116 PolarHBondContact OE2-NZ 3.42Å; F81-K116 PolarHBondContact O-N 3.12Å; E82-K116 WeakPolarHBondContact OE1-CD 3.42Å; E82-K116 IonicContact OE1-NZ 2.62Å; E82-K116 PolarHBondContact OE1-NZ 3.13Å; E82-K116 VanDerWaalsContact OE2-CB 3.29Å; E82-K116 WeakPolarHBondContact OE2-CB 3.05Å; E82-K116 VanDerWaalsContact OE2-CD 3.27Å; E82-K116 WeakPolarHBondContact OE2-CD 3.38Å; L83-K116 PolarHBondContact N-O 2.84Å; K116-I145 WeakPolarHBondContact CA-O 3.44Å; K116-I145 HydrophobicContact CG-CB 4.22Å; K116-I145 HydrophobicContact CG-CD1 4.29Å; K116-I145 HydrophobicContact CG-CG2 4.42Å; K116-T147 HydrophobicContact CB-CG2 3.74Å; K116-T147 HydrophobicContact CG-CG2 4.11Å
117	V	96.6	Very high	96.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	128	-172.4	-173.3	0	0	0	0	108.7	L83 F115 A124 A127 I145 T147 S151 F152	L83-V117 HydrophobicContact CB-CG2 4.43Å; L83-V117 HydrophobicContact CD1-CG2 4.38Å; L83-V117 WeakPolarHBondContact O-CA 3.29Å; F115-V117 HydrophobicContact CB-CG2 4.16Å; V117-A124 HydrophobicContact CG1-CB 4.07Å; V117-A127 HydrophobicContact CG2-CB 4.06Å; V117-I145 PolarHBondContact N-O 3.44Å; V117-T147 PolarHBondContact O-N 2.54Å; V117-T147 PolarHBondContact O-OG1 3.07Å; V117-S151 WeakPolarHBondContact CG1-OG 3.48Å; V117-F152 HydrophobicContact CB-CE2 4.04Å; V117-F152 HydrophobicContact CB-CZ 4.13Å; V117-F152 HydrophobicContact CG2-CE1 4.38Å; V117-F152 HydrophobicContact CG2-CE2 3.82Å; V117-F152 HydrophobicContact CG2-CZ 3.48Å; V117-F152 VanDerWaalsContact CG2-CZ 3.48Å
118	D	94.5	Very high	96.5	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.157	C	C	.	.			trans	-79.4	-167.4	177.9	76.1	-8.3	0	0	0	113	L83 N84 Q85 T88 S120 S123 T147 S151	L83-D118 PolarHBondContact O-N 3.05Å; L83-D118 VanDerWaalsContact O-N 3.16Å; N84-D118 VanDerWaalsContact CA-OD2 3.3Å; N84-D118 WeakPolarHBondContact CA-OD2 3.24Å; N84-D118 HydrophobicContact CB-CB 3.95Å; N84-D118 WeakPolarHBondContact CB-OD2 3.24Å; Q85-D118 PolarHBondContact N-OD2 2.84Å; T88-D118 WeakPolarHBondContact CB-OD2 3.4Å; T88-D118 VanDerWaalsContact OG1-CG 3.3Å; T88-D118 PolarHBondContact OG1-OD2 2.86Å; D118-S120 PolarHBondContact O-N 2.67Å; D118-S120 VanDerWaalsContact O-N 3.16Å; D118-S120 WeakPolarHBondContact OD1-CB 3.46Å; D118-S120 PolarHBondContact OD1-N 2.87Å; D118-S120 VanDerWaalsContact OD1-N 3.1Å; D118-S123 WeakPolarHBondContact OD1-CB 3.44Å; D118-S123 PolarHBondContact OD1-OG 2.73Å; D118-T147 WeakPolarHBondContact CA-OG1 3.37Å; D118-S151 WeakPolarHBondContact O-CB 3.26Å; D118-S151 PolarHBondContact O-OG 2.88Å
119	S	94.4	Very high	96.7	Very high	17 Å²	17	31.4 Å²	31.4	12%	0.119	16%	0.155	C	C	.	.	S	Bend	trans	-74.2	2.4	-176.4	-58.6	0	0	0	0	114.6	A148 R149	S119-A148 WeakPolarHBondContact OG-CB 3.2Å; S119-R149 WeakPolarHBondContact OG-CB 3.4Å; S119-R149 PolarHBondContact OG-N 2.57Å
120	S	95.8	Very high	96.8	Very high	8 Å²	8	30.2 Å²	30.2	6%	0.056	15%	0.15	C	C	.	.			trans	-91.8	136.4	-176.1	134.5	0	0	0	0	111.1	Q85 D118 E122 S123 A124 S151	Q85-S120 VanDerWaalsContact CG-OG 3.27Å; Q85-S120 WeakPolarHBondContact CG-OG 3.42Å; D118-S120 PolarHBondContact O-N 2.67Å; D118-S120 VanDerWaalsContact O-N 3.16Å; D118-S120 WeakPolarHBondContact OD1-CB 3.46Å; D118-S120 PolarHBondContact OD1-N 2.87Å; D118-S120 VanDerWaalsContact OD1-N 3.1Å; S120-E122 VanDerWaalsContact C-N 3.27Å; S120-E122 WeakPolarHBondContact CB-OE2 3.27Å; S120-E122 PolarHBondContact O-N 2.96Å; S120-E122 PolarHBondContact OG-N 3.08Å; S120-E122 PolarHBondContact OG-OE2 2.9Å; S120-S123 WeakPolarHBondContact O-CB 3.36Å; S120-S123 PolarHBondContact O-N 3.48Å; S120-S123 PolarHBondContact OG-N 3.15Å; S120-S123 VanDerWaalsContact OG-N 3.11Å; S120-S123 PolarHBondContact OG-OG 3.39Å; S120-A124 PolarHBondContact O-N 3.27Å; S120-S151 WeakPolarHBondContact O-CB 3.45Å
121	K	96	Very high	96.9	Very high	82 Å²	82	30.1 Å²	30.1	36%	0.357	15%	0.149	S	C	.	.	H	α-helix	trans	-62.7	-37.8	175.7	-173.6	-175.5	176	-167.2	0	111.3	S123 A124 E125 D154 L155	K121-S123 VanDerWaalsContact C-N 3.29Å; K121-S123 PolarHBondContact O-N 2.94Å; K121-A124 WeakPolarHBondContact O-CB 3.49Å; K121-A124 PolarHBondContact O-N 2.91Å; K121-A124 VanDerWaalsContact O-N 3.1Å; K121-E125 WeakPolarHBondContact CE-OE1 3.46Å; K121-E125 HydrophobicContact CG-CG 4.47Å; K121-E125 IonicContact NZ-OE1 3.63Å; K121-E125 WeakPolarHBondContact O-CG 2.95Å; K121-E125 PolarHBondContact O-N 3.09Å; K121-D154 HydrophobicContact CB-CB 4.44Å; K121-D154 HydrophobicContact CD-CB 4.44Å; K121-D154 WeakPolarHBondContact CE-O 3.38Å; K121-D154 HydrophobicContact CG-CB 4.19Å; K121-L155 HydrophobicContact CG-CD2 3.83Å
122	E	96	Very high	96.9	Very high	112 Å²	112	30.4 Å²	30.4	52%	0.523	16%	0.155	S	C	.	.	H	α-helix	trans	-61.7	-37.3	178	-56.8	75.7	-168.1	0	0	111.6	S120 E125 A126	S120-E122 VanDerWaalsContact C-N 3.27Å; S120-E122 WeakPolarHBondContact CB-OE2 3.27Å; S120-E122 PolarHBondContact O-N 2.96Å; S120-E122 PolarHBondContact OG-N 3.08Å; S120-E122 PolarHBondContact OG-OE2 2.9Å; E122-E125 PolarHBondContact O-N 2.75Å; E122-A126 WeakPolarHBondContact O-CB 3.33Å; E122-A126 PolarHBondContact O-N 2.88Å
123	S	96.3	Very high	96.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.1	-40.5	173.5	-60.5	0	0	0	0	111.8	L83 D118 S120 K121 A126 A127	L83-S123 WeakPolarHBondContact O-CB 3.31Å; L83-S123 PolarHBondContact O-OG 3.39Å; D118-S123 WeakPolarHBondContact OD1-CB 3.44Å; D118-S123 PolarHBondContact OD1-OG 2.73Å; S120-S123 WeakPolarHBondContact O-CB 3.36Å; S120-S123 PolarHBondContact O-N 3.48Å; S120-S123 PolarHBondContact OG-N 3.15Å; S120-S123 VanDerWaalsContact OG-N 3.11Å; S120-S123 PolarHBondContact OG-OG 3.39Å; K121-S123 VanDerWaalsContact C-N 3.29Å; K121-S123 PolarHBondContact O-N 2.94Å; S123-A126 PolarHBondContact O-N 2.82Å; S123-A127 PolarHBondContact O-N 3.37Å
124	A	97.4	Very high	96.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-69.3	-39.2	176.2	0	0	0	0	0	112.1	V117 S120 K121 A127 C128 F152 L155	V117-A124 HydrophobicContact CG1-CB 4.07Å; S120-A124 PolarHBondContact O-N 3.27Å; K121-A124 WeakPolarHBondContact O-CB 3.49Å; K121-A124 PolarHBondContact O-N 2.91Å; K121-A124 VanDerWaalsContact O-N 3.1Å; A124-A127 WeakPolarHBondContact O-CB 3.47Å; A124-A127 PolarHBondContact O-N 2.86Å; A124-C128 PolarHBondContact O-N 3.1Å; A124-C128 VanDerWaalsContact O-N 3.09Å; A124-F152 HydrophobicContact CB-CD1 3.96Å; A124-F152 HydrophobicContact CB-CE1 4.27Å; A124-F152 HydrophobicContact CB-CG 4.47Å; A124-L155 HydrophobicContact CB-CD1 3.84Å; A124-L155 HydrophobicContact CB-CD2 4.07Å; A124-L155 HydrophobicContact CB-CG 4Å
125	E	97.9	Very high	96.5	Very high	66 Å²	66	32.9 Å²	32.9	31%	0.308	17%	0.173	S	C	.	.	H	α-helix	trans	-60.8	-45.4	172.3	-71.5	177.3	168.2	0	0	111	K121 E122 A127 C128 D129 L155	K121-E125 WeakPolarHBondContact CE-OE1 3.46Å; K121-E125 HydrophobicContact CG-CG 4.47Å; K121-E125 IonicContact NZ-OE1 3.63Å; K121-E125 WeakPolarHBondContact O-CG 2.95Å; K121-E125 PolarHBondContact O-N 3.09Å; E122-E125 PolarHBondContact O-N 2.75Å; E125-A127 VanDerWaalsContact C-N 3.27Å; E125-A127 PolarHBondContact O-N 3.49Å; E125-C128 WeakPolarHBondContact O-CB 3.33Å; E125-C128 PolarHBondContact O-N 2.82Å; E125-C128 VanDerWaalsContact O-N 3.09Å; E125-D129 PolarHBondContact O-N 2.85Å; E125-L155 HydrophobicContact CB-CD2 4.48Å; E125-L155 HydrophobicContact CG-CD2 3.43Å; E125-L155 VanDerWaalsContact CG-CD2 3.43Å
126	A	97.3	Very high	96.1	Very high	32 Å²	32	38.5 Å²	38.5	26%	0.264	20%	0.203	S	C	.	.	H	α-helix	trans	-60.3	-35.7	175.7	0	0	0	0	0	112.5	L83 E122 S123 D129 I130	L83-A126 HydrophobicContact CD1-CB 4.39Å; E122-A126 WeakPolarHBondContact O-CB 3.33Å; E122-A126 PolarHBondContact O-N 2.88Å; S123-A126 PolarHBondContact O-N 2.82Å; A126-D129 PolarHBondContact O-N 3.38Å; A126-I130 WeakPolarHBondContact O-CD1 3.42Å; A126-I130 VanDerWaalsContact O-CG1 3.24Å; A126-I130 WeakPolarHBondContact O-CG1 3.14Å; A126-I130 PolarHBondContact O-N 2.62Å; A126-I130 VanDerWaalsContact O-N 3.1Å
127	A	97.9	Very high	95.8	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.3	-46.7	173.6	0	0	0	0	0	111.2	L83 F115 V117 S123 A124 E125 D129 I130 L131 F152	L83-A127 HydrophobicContact CD1-CB 3.58Å; F115-A127 HydrophobicContact CD1-CB 4.04Å; V117-A127 HydrophobicContact CG2-CB 4.06Å; S123-A127 PolarHBondContact O-N 3.37Å; A124-A127 WeakPolarHBondContact O-CB 3.47Å; A124-A127 PolarHBondContact O-N 2.86Å; E125-A127 VanDerWaalsContact C-N 3.27Å; E125-A127 PolarHBondContact O-N 3.49Å; A127-D129 PolarHBondContact O-N 3.22Å; A127-I130 PolarHBondContact O-N 3.47Å; A127-L131 WeakPolarHBondContact O-CB 3.39Å; A127-L131 VanDerWaalsContact O-CG 3.3Å; A127-L131 WeakPolarHBondContact O-CG 3.46Å; A127-L131 PolarHBondContact O-N 3.22Å; A127-F152 HydrophobicContact CB-CE1 3.85Å; A127-F152 HydrophobicContact CB-CZ 4.04Å
128	C	98.1	Very high	95.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.1	-39.7	176.4	-71.9	0	0	0	0	112.7	A124 E125 I130 L131 S132 L155 A163	A124-C128 PolarHBondContact O-N 3.1Å; A124-C128 VanDerWaalsContact O-N 3.09Å; E125-C128 WeakPolarHBondContact O-CB 3.33Å; E125-C128 PolarHBondContact O-N 2.82Å; E125-C128 VanDerWaalsContact O-N 3.09Å; C128-I130 VanDerWaalsContact C-N 3.31Å; C128-I130 PolarHBondContact O-N 2.86Å; C128-L131 PolarHBondContact O-N 2.87Å; C128-S132 WeakPolarHBondContact O-CB 3.42Å; C128-S132 PolarHBondContact O-N 2.98Å; C128-S132 PolarHBondContact O-OG 3.22Å; C128-L155 VanDerWaalsContact SG-CD1 3.55Å; C128-A163 HydrophobicContact CB-CB 3.78Å; C128-A163 WeakPolarHBondContact O-CB 3.48Å
129	D	97.6	Very high	95.8	Very high	90 Å²	90	38.7 Å²	38.7	48%	0.481	21%	0.211	S	C	.	.	H	α-helix	trans	-62	-39.5	175.8	-74.1	-20	0	0	0	111.9	E125 A126 A127 Q133	E125-D129 PolarHBondContact O-N 2.85Å; A126-D129 PolarHBondContact O-N 3.38Å; A127-D129 PolarHBondContact O-N 3.22Å; D129-Q133 WeakPolarHBondContact O-CG 3.29Å; D129-Q133 PolarHBondContact O-NE2 3.31Å
130	I	97.5	Very high	96	Very high	8 Å²	8	41.2 Å²	41.2	4%	0.041	22%	0.22	C	C	.	.	H	α-helix	trans	-70.7	-49.2	176.3	-64.3	162.8	0	0	0	110.1	F81 L83 I99 I103 F115 A126 A127 C128 S132 Q133 L134	F81-I130 HydrophobicContact CD1-CD1 4.22Å; F81-I130 HydrophobicContact CE1-CG2 4.48Å; F81-I130 HydrophobicContact CE2-CG2 4.37Å; F81-I130 HydrophobicContact CZ-CG2 4.2Å; L83-I130 HydrophobicContact CD1-CD1 4.21Å; L83-I130 HydrophobicContact CD2-CD1 4.13Å; I99-I130 HydrophobicContact CD1-CD1 4.18Å; I99-I130 HydrophobicContact CG2-CD1 3.67Å; I99-I130 HydrophobicContact CG2-CG1 3.77Å; I103-I130 HydrophobicContact CD1-CG1 4.35Å; I103-I130 HydrophobicContact CD1-CG2 4.16Å; F115-I130 HydrophobicContact CE1-CB 3.84Å; F115-I130 HydrophobicContact CE1-CD1 3.99Å; F115-I130 HydrophobicContact CE1-CG2 3.67Å; F115-I130 HydrophobicContact CZ-CB 4.16Å; F115-I130 HydrophobicContact CZ-CG2 3.66Å; A126-I130 WeakPolarHBondContact O-CD1 3.42Å; A126-I130 VanDerWaalsContact O-CG1 3.24Å; A126-I130 WeakPolarHBondContact O-CG1 3.14Å; A126-I130 PolarHBondContact O-N 2.62Å; A126-I130 VanDerWaalsContact O-N 3.1Å; A127-I130 PolarHBondContact O-N 3.47Å; C128-I130 VanDerWaalsContact C-N 3.31Å; C128-I130 PolarHBondContact O-N 2.86Å; I130-S132 PolarHBondContact O-N 2.94Å; I130-Q133 WeakPolarHBondContact O-CB 3.37Å; I130-Q133 PolarHBondContact O-N 3.37Å; I130-L134 HydrophobicContact CG2-CD2 4.34Å; I130-L134 WeakPolarHBondContact O-CG 3.48Å
131	L	97.3	Very high	96.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-53.8	-42.3	178.5	-75	173.1	0	0	0	111.7	F115 A127 C128 Q133 L134 L142 L144 A163 V167	F115-L131 HydrophobicContact CD2-CD2 4.37Å; F115-L131 HydrophobicContact CE2-CD2 3.59Å; F115-L131 HydrophobicContact CE2-CG 4.13Å; F115-L131 HydrophobicContact CZ-CD2 3.99Å; F115-L131 HydrophobicContact CZ-CG 4.16Å; A127-L131 WeakPolarHBondContact O-CB 3.39Å; A127-L131 VanDerWaalsContact O-CG 3.3Å; A127-L131 WeakPolarHBondContact O-CG 3.46Å; A127-L131 PolarHBondContact O-N 3.22Å; C128-L131 PolarHBondContact O-N 2.87Å; L131-Q133 PolarHBondContact O-N 3.12Å; L131-Q133 VanDerWaalsContact O-N 3.13Å; L131-L134 HydrophobicContact CD2-CD1 4.08Å; L131-L134 WeakPolarHBondContact O-CB 3.38Å; L131-L134 PolarHBondContact O-N 3.13Å; L131-L142 HydrophobicContact CD2-CD1 4.05Å; L131-L142 HydrophobicContact CD2-CD2 4.34Å; L131-L144 HydrophobicContact CD1-CD1 4.43Å; L131-L144 HydrophobicContact CD1-CD2 4.18Å; L131-A163 HydrophobicContact CB-CB 4.08Å; L131-V167 HydrophobicContact CD2-CG2 3.85Å
132	S	97.2	Very high	96.2	Very high	45 Å²	45	38.5 Å²	38.5	32%	0.315	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-19.2	178.9	-60.4	0	0	0	0	113.7	C128 I130 A163	C128-S132 WeakPolarHBondContact O-CB 3.42Å; C128-S132 PolarHBondContact O-N 2.98Å; C128-S132 PolarHBondContact O-OG 3.22Å; I130-S132 PolarHBondContact O-N 2.94Å; S132-A163 WeakPolarHBondContact OG-CB 3.48Å
133	Q	96.3	Very high	96.4	Very high	103 Å²	103	33.3 Å²	33.3	48%	0.481	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-5	178.1	-67.2	172.9	72.8	0	0	113.4	I103 D129 I130 L131 V135	I103-Q133 HydrophobicContact CD1-CB 4.43Å; I103-Q133 HydrophobicContact CG2-CB 3.89Å; D129-Q133 WeakPolarHBondContact O-CG 3.29Å; D129-Q133 PolarHBondContact O-NE2 3.31Å; I130-Q133 WeakPolarHBondContact O-CB 3.37Å; I130-Q133 PolarHBondContact O-N 3.37Å; L131-Q133 PolarHBondContact O-N 3.12Å; L131-Q133 VanDerWaalsContact O-N 3.13Å; Q133-V135 PolarHBondContact O-N 2.99Å
134	L	93.4	Very high	96.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-80.6	28.5	-176.1	-57.6	-172.2	0	0	0	114	I130 L131 N136 C137 L139 V167	I130-L134 HydrophobicContact CG2-CD2 4.34Å; I130-L134 WeakPolarHBondContact O-CG 3.48Å; L131-L134 HydrophobicContact CD2-CD1 4.08Å; L131-L134 WeakPolarHBondContact O-CB 3.38Å; L131-L134 PolarHBondContact O-N 3.13Å; L134-N136 PolarHBondContact O-N 2.9Å; L134-C137 HydrophobicContact CB-CB 4.14Å; L134-C137 WeakPolarHBondContact O-CB 3.41Å; L134-C137 PolarHBondContact O-N 3.17Å; L134-L139 HydrophobicContact CD1-CD1 4.24Å; L134-V167 HydrophobicContact CD1-CG2 4.37Å
135	V	94.3	Very high	96.4	Very high	70 Å²	70	36.5 Å²	36.5	42%	0.424	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-59.6	-34.2	-177.2	-175.8	0	0	0	0	112.4	Q133 C137 V166 N170	Q133-V135 PolarHBondContact O-N 2.99Å; V135-C137 VanDerWaalsContact C-N 3.33Å; V135-V166 HydrophobicContact CG2-CG1 3.84Å; V135-N170 WeakPolarHBondContact O-CB 3.33Å
136	N	90.4	Very high	96.3	Very high	118 Å²	118	34.3 Å²	34.3	63%	0.631	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-91.4	7.1	-179	-61.4	-38.9	0	0	0	113.5	N108 L134	N108-N136 WeakPolarHBondContact CA-O 3.48Å; L134-N136 PolarHBondContact O-N 2.9Å
137	C	90.4	Very high	96	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.02	20%	0.203	C	C	.	.			trans	-87.9	143.2	-178.5	-58.8	0	0	0	0	111.1	S107 L134 V135 L139 S171	S107-C137 PolarHBondContact O-SG 3.32Å; L134-C137 HydrophobicContact CB-CB 4.14Å; L134-C137 WeakPolarHBondContact O-CB 3.41Å; L134-C137 PolarHBondContact O-N 3.17Å; V135-C137 VanDerWaalsContact C-N 3.33Å; C137-L139 HydrophobicContact CB-CD2 3.98Å; C137-L139 HydrophobicContact CB-CG 3.95Å; C137-S171 PolarHBondContact O-OG 3.12Å
138	S	93.8	Very high	95.6	Very high	59 Å²	59	39.1 Å²	39.1	41%	0.413	23%	0.228	S	C	.	.			trans	-116.2	72.7	168.7	-163.6	0	0	0	0	108.5	S173	S138-S173 PolarHBondContact OG-OG 3.42Å
139	L	97.1	Very high	95.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.256	C	S	.	.			trans	-69.1	140.5	-175.4	-59.4	-174.9	0	0	0	110.7	L110 V113 L134 C137 L142 V167 S171 S173 L174	L110-L139 HydrophobicContact CB-CD2 4.02Å; V113-L139 HydrophobicContact CB-CD1 4.26Å; V113-L139 HydrophobicContact CB-CD2 4.29Å; V113-L139 HydrophobicContact CG2-CD1 4.34Å; V113-L139 HydrophobicContact CG2-CD2 3.6Å; L134-L139 HydrophobicContact CD1-CD1 4.24Å; C137-L139 HydrophobicContact CB-CD2 3.98Å; C137-L139 HydrophobicContact CB-CG 3.95Å; L139-L142 HydrophobicContact CD1-CD1 4.42Å; L139-V167 HydrophobicContact CD1-CG1 3.94Å; L139-V167 HydrophobicContact CD1-CG2 4.4Å; L139-S171 WeakPolarHBondContact CB-OG 3.45Å; L139-S171 PolarHBondContact N-OG 2.61Å; L139-S173 CarbonylContact O-C 3.54Å; L139-S173 VanDerWaalsContact O-C 3.3Å; L139-S173 PolarHBondContact O-OG 3.32Å; L139-L174 HydrophobicContact CB-CD1 4.35Å; L139-L174 WeakPolarHBondContact O-CA 3.41Å; L139-L174 PolarHBondContact O-N 3.19Å
140	K	98.1	Very high	95.1	Very high	69 Å²	69	44.7 Å²	44.7	30%	0.3	25%	0.248	S	C	.	.	S	Bend	trans	-99.1	-32	167.6	-66.7	178.3	179.4	165.2	0	111.3	Q111 Y112 S173 S175 S176	Q111-K140 HydrophobicContact CB-CD 4.39Å; Q111-K140 HydrophobicContact CB-CG 4.46Å; Q111-K140 PolarHBondContact O-N 3.04Å; Y112-K140 HydrophobicContact CE1-CB 4.08Å; Y112-K140 HydrophobicContact CE1-CD 4.35Å; Y112-K140 WeakPolarHBondContact OH-CD 3.3Å; K140-S173 WeakPolarHBondContact CA-O 3.45Å; K140-S175 WeakPolarHBondContact O-CA 3.28Å; K140-S175 PolarHBondContact O-N 3.02Å; K140-S175 PolarHBondContact O-OG 3.38Å; K140-S176 PolarHBondContact O-N 2.93Å
141	T	98.4	Very high	95	Very high	33 Å²	33	44.3 Å²	44.3	20%	0.202	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	131	177.9	-60.2	0	0	0	0	110	Q111 Y112 V113 S176	Q111-T141 PolarHBondContact O-N 3.28Å; Y112-T141 WeakPolarHBondContact CD1-OG1 3.11Å; V113-T141 PolarHBondContact N-O 3.23Å; T141-S176 VanDerWaalsContact CA-O 3.32Å; T141-S176 WeakPolarHBondContact CA-O 3.33Å
142	L	98.6	Very high	95	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	130.7	165.9	177.4	64.7	0	0	0	109.2	V113 F115 L131 L139 L144 L164 V167 L174 S176 L177 K178	V113-L142 HydrophobicContact CG1-CD1 4.48Å; V113-L142 CarbonylContact O-C 3.52Å; V113-L142 VanDerWaalsContact O-CA 3.3Å; V113-L142 WeakPolarHBondContact O-CA 3.45Å; F115-L142 HydrophobicContact CD2-CD1 4.13Å; F115-L142 HydrophobicContact CE2-CD1 4.01Å; L131-L142 HydrophobicContact CD2-CD1 4.05Å; L131-L142 HydrophobicContact CD2-CD2 4.34Å; L139-L142 HydrophobicContact CD1-CD1 4.42Å; L142-L144 HydrophobicContact CD1-CD2 4.17Å; L142-L164 HydrophobicContact CD2-CD1 3.68Å; L142-V167 HydrophobicContact CD2-CB 4.27Å; L142-V167 HydrophobicContact CD2-CG1 3.99Å; L142-V167 HydrophobicContact CD2-CG2 4.27Å; L142-L174 HydrophobicContact CB-CD1 4.15Å; L142-S176 PolarHBondContact N-O 3.14Å; L142-L177 HydrophobicContact CB-CD1 3.93Å; L142-L177 HydrophobicContact CD2-CD1 3.9Å; L142-L177 HydrophobicContact CG-CD1 4.12Å; L142-L177 WeakPolarHBondContact O-CA 3.37Å; L142-K178 PolarHBondContact O-N 2.78Å
143	G	98.5	Very high	95	Very high	4 Å²	4	45 Å²	45	4%	0.041	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128.3	170	0	0	0	0	0	111.7	V113 S114 F115 K178	V113-G143 PolarHBondContact O-N 3.13Å; S114-G143 CarbonylContact C-O 3.54Å; S114-G143 WeakPolarHBondContact CA-O 3.47Å; F115-G143 PolarHBondContact N-O 3.07Å; G143-K178 CarbonylContact C-O 3.53Å; G143-K178 WeakPolarHBondContact CA-O 3.31Å
144	L	98.3	Very high	95	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	117	168.6	-54.2	-176.8	0	0	0	106.7	F115 L131 L142 F152 F160 L164 K178 I179 T182	F115-L144 HydrophobicContact CB-CD2 3.95Å; F115-L144 HydrophobicContact CD2-CD2 3.57Å; F115-L144 HydrophobicContact CE2-CD2 4.41Å; F115-L144 HydrophobicContact CG-CD2 4.03Å; L131-L144 HydrophobicContact CD1-CD1 4.43Å; L131-L144 HydrophobicContact CD1-CD2 4.18Å; L142-L144 HydrophobicContact CD1-CD2 4.17Å; L144-F152 HydrophobicContact CB-CE2 3.96Å; L144-F152 HydrophobicContact CB-CZ 4.11Å; L144-F152 HydrophobicContact CD1-CZ 4.46Å; L144-F152 HydrophobicContact CD2-CZ 4.38Å; L144-F160 HydrophobicContact CD1-CE2 3.73Å; L144-F160 HydrophobicContact CD1-CZ 3.65Å; L144-L164 HydrophobicContact CD1-CD1 4.31Å; L144-K178 PolarHBondContact N-O 3.27Å; L144-I179 HydrophobicContact CD1-CG2 4.12Å; L144-I179 HydrophobicContact CG-CG2 4.32Å; L144-T182 HydrophobicContact CB-CG2 4.45Å; L144-T182 HydrophobicContact CD1-CG2 4.34Å
145	I	97.1	Very high	95.1	Very high	64 Å²	64	44.8 Å²	44.8	33%	0.328	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	110.2	-169.4	-55.1	169.5	0	0	0	107.8	F115 K116 V117 T147	F115-I145 PolarHBondContact O-N 3.47Å; K116-I145 WeakPolarHBondContact CA-O 3.44Å; K116-I145 HydrophobicContact CG-CB 4.22Å; K116-I145 HydrophobicContact CG-CD1 4.29Å; K116-I145 HydrophobicContact CG-CG2 4.42Å; V117-I145 PolarHBondContact N-O 3.44Å; I145-T147 PolarHBondContact O-N 3.19Å
146	S	94.9	Very high	95.3	Very high	21 Å²	21	44.8 Å²	44.8	15%	0.147	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	114.8	168.5	-59.6	0	0	0	0	108.7	A148	S146-A148 VanDerWaalsContact C-N 3.31Å
147	T	91.3	Very high	95.6	Very high	69 Å²	69	43.3 Å²	43.3	42%	0.423	24%	0.237	S	C	.	.	S	Bend	trans	-81.3	-13.9	-177	67.2	0	0	0	0	113.2	K116 V117 D118 I145	K116-T147 HydrophobicContact CB-CG2 3.74Å; K116-T147 HydrophobicContact CG-CG2 4.11Å; V117-T147 PolarHBondContact O-N 2.54Å; V117-T147 PolarHBondContact O-OG1 3.07Å; D118-T147 WeakPolarHBondContact CA-OG1 3.37Å; I145-T147 PolarHBondContact O-N 3.19Å
148	A	89.2	Confident	95.9	Very high	63 Å²	63	47.5 Å²	47.5	52%	0.521	27%	0.266	S	S	.	.	S	Bend	trans	-150.9	-116.8	-179.5	0	0	0	0	0	109.3	S119 S146	S119-A148 WeakPolarHBondContact OG-CB 3.2Å; S146-A148 VanDerWaalsContact C-N 3.31Å
149	R	90.6	Very high	96.1	Very high	159 Å²	159	47.3 Å²	47.3	60%	0.6	26%	0.259	S	S	*	.	S	Bend	trans	-66.8	143.8	173.8	-68.9	-174.9	-74.4	146	-3	110.9	S119 S151	S119-R149 WeakPolarHBondContact OG-CB 3.4Å; S119-R149 PolarHBondContact OG-N 2.57Å; R149-S151 VanDerWaalsContact C-N 3.31Å; R149-S151 PolarHBondContact O-N 3.12Å
150	P	93.9	Very high	96.2	Very high	49 Å²	49	47.3 Å²	47.3	32%	0.318	26%	0.259	S	S	.	.			trans	-77.8	75.5	-175	33.4	-37.9	0	0	0	112.4	F152 M153 D181	P150-F152 PolarHBondContact O-N 2.79Å; P150-F152 VanDerWaalsContact O-N 3.14Å; P150-M153 HydrophobicContact CB-CG 4.29Å; P150-M153 WeakPolarHBondContact O-CB 3.42Å; P150-M153 PolarHBondContact O-N 3.31Å; P150-D181 HydrophobicContact CB-CB 3.54Å
151	S	96.3	Very high	96.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-63	-19	-174.7	53.4	0	0	0	0	114.5	V117 D118 S120 R149 M153 D154	V117-S151 WeakPolarHBondContact CG1-OG 3.48Å; D118-S151 WeakPolarHBondContact O-CB 3.26Å; D118-S151 PolarHBondContact O-OG 2.88Å; S120-S151 WeakPolarHBondContact O-CB 3.45Å; R149-S151 VanDerWaalsContact C-N 3.31Å; R149-S151 PolarHBondContact O-N 3.12Å; S151-M153 PolarHBondContact O-N 2.61Å; S151-D154 WeakPolarHBondContact O-CB 3.22Å; S151-D154 PolarHBondContact O-N 3.36Å
152	F	97.4	Very high	96.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-60.9	-28.7	170.5	-70.9	-65.9	0	0	0	113	V117 A124 A127 L144 P150 D154 L155 F160 T182	V117-F152 HydrophobicContact CB-CE2 4.04Å; V117-F152 HydrophobicContact CB-CZ 4.13Å; V117-F152 HydrophobicContact CG2-CE1 4.38Å; V117-F152 HydrophobicContact CG2-CE2 3.82Å; V117-F152 HydrophobicContact CG2-CZ 3.48Å; V117-F152 VanDerWaalsContact CG2-CZ 3.48Å; A124-F152 HydrophobicContact CB-CD1 3.96Å; A124-F152 HydrophobicContact CB-CE1 4.27Å; A124-F152 HydrophobicContact CB-CG 4.47Å; A127-F152 HydrophobicContact CB-CE1 3.85Å; A127-F152 HydrophobicContact CB-CZ 4.04Å; L144-F152 HydrophobicContact CB-CE2 3.96Å; L144-F152 HydrophobicContact CB-CZ 4.11Å; L144-F152 HydrophobicContact CD1-CZ 4.46Å; L144-F152 HydrophobicContact CD2-CZ 4.38Å; P150-F152 PolarHBondContact O-N 2.79Å; P150-F152 VanDerWaalsContact O-N 3.14Å; F152-D154 VanDerWaalsContact C-N 3.27Å; F152-D154 PolarHBondContact O-N 2.98Å; F152-L155 HydrophobicContact CD1-CD1 4.2Å; F152-L155 WeakPolarHBondContact O-CB 3.47Å; F152-L155 PolarHBondContact O-N 3.22Å; F152-F160 HydrophobicContact CB-CD2 4.45Å; F152-F160 HydrophobicContact CB-CE2 4.33Å; F152-F160 AromaticContact CD1-CD2 3.71Å; F152-F160 HydrophobicContact CD1-CD2 3.71Å; F152-F160 AromaticContact CD1-CE2 3.53Å; F152-F160 HydrophobicContact CD1-CE2 3.53Å; F152-F160 HydrophobicContact CE1-CD2 4.34Å; F152-F160 AromaticContact CE1-CE2 3.96Å; F152-F160 HydrophobicContact CE1-CE2 3.96Å; F152-F160 HydrophobicContact CG-CD2 4.39Å; F152-F160 HydrophobicContact CG-CE2 4.03Å; F152-T182 HydrophobicContact CB-CG2 4.42Å; F152-T182 HydrophobicContact CD2-CG2 4.25Å; F152-T182 HydrophobicContact CG-CG2 4.41Å
153	M	96.5	Very high	96.1	Very high	60 Å²	60	46.7 Å²	46.7	30%	0.296	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-73	-19.4	175.5	-62.4	-61.8	-166.1	0	0	113	P150 S151 L155 D181 T182 P183 S207 P209	P150-M153 HydrophobicContact CB-CG 4.29Å; P150-M153 WeakPolarHBondContact O-CB 3.42Å; P150-M153 PolarHBondContact O-N 3.31Å; S151-M153 PolarHBondContact O-N 2.61Å; M153-L155 PolarHBondContact O-N 3.08Å; M153-D181 VanDerWaalsContact CE-C 3.42Å; M153-T182 WeakPolarHBondContact CE-O 3.29Å; M153-P183 HydrophobicContact SD-CB 3.96Å; M153-S207 WeakPolarHBondContact CE-O 3.34Å; M153-P209 HydrophobicContact CE-CG 3.9Å; M153-P209 HydrophobicContact SD-CG 4.29Å
154	D	96.3	Very high	96.1	Very high	88 Å²	88	46.5 Å²	46.5	47%	0.471	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-79.4	-9.2	176.5	-59.9	-36.7	0	0	0	112.2	K121 S151 F152	K121-D154 HydrophobicContact CB-CB 4.44Å; K121-D154 HydrophobicContact CD-CB 4.44Å; K121-D154 WeakPolarHBondContact CE-O 3.38Å; K121-D154 HydrophobicContact CG-CB 4.19Å; S151-D154 WeakPolarHBondContact O-CB 3.22Å; S151-D154 PolarHBondContact O-N 3.36Å; F152-D154 VanDerWaalsContact C-N 3.27Å; F152-D154 PolarHBondContact O-N 2.98Å
155	L	96.8	Very high	96.1	Very high	9 Å²	9	48.3 Å²	48.3	5%	0.047	27%	0.271	C	S	.	.	S	Bend	trans	-82.1	149.3	177.3	-57.7	-175.5	0	0	0	111.5	K121 A124 E125 C128 F152 M153 K157 F160	K121-L155 HydrophobicContact CG-CD2 3.83Å; A124-L155 HydrophobicContact CB-CD1 3.84Å; A124-L155 HydrophobicContact CB-CD2 4.07Å; A124-L155 HydrophobicContact CB-CG 4Å; E125-L155 HydrophobicContact CB-CD2 4.48Å; E125-L155 HydrophobicContact CG-CD2 3.43Å; E125-L155 VanDerWaalsContact CG-CD2 3.43Å; C128-L155 VanDerWaalsContact SG-CD1 3.55Å; F152-L155 HydrophobicContact CD1-CD1 4.2Å; F152-L155 WeakPolarHBondContact O-CB 3.47Å; F152-L155 PolarHBondContact O-N 3.22Å; M153-L155 PolarHBondContact O-N 3.08Å; L155-K157 PolarHBondContact O-N 3Å; L155-F160 HydrophobicContact CD1-CB 4.49Å; L155-F160 HydrophobicContact CD1-CD2 4.45Å
156	P	97.2	Very high	96.1	Very high	71 Å²	71	46.6 Å²	46.6	46%	0.461	26%	0.264	S	S	.	.			trans	-57	125.6	164.6	-20	31.9	0	0	0	109.7	S158 H159 F160	P156-S158 PolarHBondContact O-N 3.24Å; P156-S158 VanDerWaalsContact O-N 3.13Å; P156-H159 HydrophobicContact CB-CB 4.27Å; P156-H159 WeakPolarHBondContact O-CB 3.37Å; P156-H159 PolarHBondContact O-N 2.86Å; P156-F160 PolarHBondContact O-N 2.91Å
157	K	96.5	Very high	96.2	Very high	87 Å²	87	45.6 Å²	45.6	38%	0.378	26%	0.257	S	S	.	.	H	α-helix	trans	-47.8	-47.5	-177.4	-175.1	175.4	70.2	148.3	0	112.6	L155 H159 F160 I161 P183 D185	L155-K157 PolarHBondContact O-N 3Å; K157-H159 VanDerWaalsContact C-N 3.26Å; K157-H159 PolarHBondContact O-N 3.09Å; K157-F160 PolarHBondContact O-N 3.49Å; K157-I161 HydrophobicContact CG-CG1 3.98Å; K157-I161 VanDerWaalsContact O-CG1 3.23Å; K157-I161 WeakPolarHBondContact O-CG1 3.42Å; K157-I161 PolarHBondContact O-N 3.03Å; K157-P183 HydrophobicContact CG-CB 4.32Å; K157-P183 WeakPolarHBondContact CG-O 3.43Å; K157-D185 WeakPolarHBondContact CE-OD2 3.47Å; K157-D185 IonicContact NZ-OD2 2.79Å; K157-D185 PolarHBondContact NZ-OD2 2.83Å
158	S	97.1	Very high	96.5	Very high	91 Å²	91	42.3 Å²	42.3	64%	0.636	24%	0.237	S	C	*	.	H	α-helix	trans	-59.1	-34.1	179.8	53.3	0	0	0	0	113.9	P156 S162	P156-S158 PolarHBondContact O-N 3.24Å; P156-S158 VanDerWaalsContact O-N 3.13Å; S158-S162 WeakPolarHBondContact O-CB 3.43Å; S158-S162 PolarHBondContact O-N 2.86Å; S158-S162 PolarHBondContact O-OG 3.38Å
159	H	97.9	Very high	96.9	Very high	55 Å²	55	42 Å²	42	26%	0.255	23%	0.228	S	C	.	.	H	α-helix	trans	-69.1	-44.3	178.1	-178.1	-156.7	0	0	0	111.2	P156 K157 S162 A163	P156-H159 HydrophobicContact CB-CB 4.27Å; P156-H159 WeakPolarHBondContact O-CB 3.37Å; P156-H159 PolarHBondContact O-N 2.86Å; K157-H159 VanDerWaalsContact C-N 3.26Å; K157-H159 PolarHBondContact O-N 3.09Å; H159-S162 PolarHBondContact O-OG 3Å; H159-A163 PolarHBondContact O-N 3.41Å
160	F	98.4	Very high	97.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.9	-46.9	176	177.7	-94.2	0	0	0	111.7	L144 F152 L155 P156 K157 S162 A163 L164 T182 P183 V184	L144-F160 HydrophobicContact CD1-CE2 3.73Å; L144-F160 HydrophobicContact CD1-CZ 3.65Å; F152-F160 HydrophobicContact CB-CD2 4.45Å; F152-F160 HydrophobicContact CB-CE2 4.33Å; F152-F160 AromaticContact CD1-CD2 3.71Å; F152-F160 HydrophobicContact CD1-CD2 3.71Å; F152-F160 AromaticContact CD1-CE2 3.53Å; F152-F160 HydrophobicContact CD1-CE2 3.53Å; F152-F160 HydrophobicContact CE1-CD2 4.34Å; F152-F160 AromaticContact CE1-CE2 3.96Å; F152-F160 HydrophobicContact CE1-CE2 3.96Å; F152-F160 HydrophobicContact CG-CD2 4.39Å; F152-F160 HydrophobicContact CG-CE2 4.03Å; L155-F160 HydrophobicContact CD1-CB 4.49Å; L155-F160 HydrophobicContact CD1-CD2 4.45Å; P156-F160 PolarHBondContact O-N 2.91Å; K157-F160 PolarHBondContact O-N 3.49Å; F160-S162 VanDerWaalsContact C-N 3.35Å; F160-S162 PolarHBondContact O-N 3.01Å; F160-A163 PolarHBondContact O-N 2.99Å; F160-L164 HydrophobicContact CE1-CB 4.48Å; F160-L164 HydrophobicContact CE1-CD2 3.79Å; F160-L164 HydrophobicContact CZ-CD2 4.12Å; F160-L164 WeakPolarHBondContact O-CB 3.2Å; F160-L164 PolarHBondContact O-N 2.76Å; F160-T182 HydrophobicContact CE1-CG2 4.4Å; F160-T182 HydrophobicContact CE2-CG2 4.14Å; F160-T182 HydrophobicContact CZ-CG2 3.62Å; F160-P183 HydrophobicContact CB-CG 3.85Å; F160-P183 HydrophobicContact CD1-CG 3.6Å; F160-P183 HydrophobicContact CD2-CG 4.45Å; F160-P183 HydrophobicContact CE1-CG 4.28Å; F160-P183 HydrophobicContact CG-CG 3.7Å; F160-V184 HydrophobicContact CE1-CG1 3.74Å
161	I	98.3	Very high	97.2	Very high	25 Å²	25	34.9 Å²	34.9	13%	0.128	20%	0.2	C	C	.	.	H	α-helix	trans	-63.1	-40.1	-179.3	-61.4	-61.3	0	0	0	111.5	K157 L164 T165	K157-I161 HydrophobicContact CG-CG1 3.98Å; K157-I161 VanDerWaalsContact O-CG1 3.23Å; K157-I161 WeakPolarHBondContact O-CG1 3.42Å; K157-I161 PolarHBondContact O-N 3.03Å; I161-L164 PolarHBondContact O-N 3.11Å; I161-T165 VanDerWaalsContact O-CB 3.25Å; I161-T165 WeakPolarHBondContact O-CB 3.38Å; I161-T165 PolarHBondContact O-N 3Å; I161-T165 PolarHBondContact O-OG1 2.89Å
162	S	97.9	Very high	97.1	Very high	64 Å²	64	40.4 Å²	40.4	45%	0.448	22%	0.224	S	C	.	.	H	α-helix	trans	-63.6	-43.6	178.7	65	0	0	0	0	111.7	S158 H159 F160 T165 V166	S158-S162 WeakPolarHBondContact O-CB 3.43Å; S158-S162 PolarHBondContact O-N 2.86Å; S158-S162 PolarHBondContact O-OG 3.38Å; H159-S162 PolarHBondContact O-OG 3Å; F160-S162 VanDerWaalsContact C-N 3.35Å; F160-S162 PolarHBondContact O-N 3.01Å; S162-T165 PolarHBondContact O-N 2.84Å; S162-V166 PolarHBondContact O-N 2.88Å
163	A	98.1	Very high	97	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.7	-46.1	176.6	0	0	0	0	0	111.9	C128 L131 S132 H159 F160 T165 V166	C128-A163 HydrophobicContact CB-CB 3.78Å; C128-A163 WeakPolarHBondContact O-CB 3.48Å; L131-A163 HydrophobicContact CB-CB 4.08Å; S132-A163 WeakPolarHBondContact OG-CB 3.48Å; H159-A163 PolarHBondContact O-N 3.41Å; F160-A163 PolarHBondContact O-N 2.99Å; A163-T165 VanDerWaalsContact C-N 3.34Å; A163-T165 PolarHBondContact O-N 2.86Å; A163-V166 WeakPolarHBondContact O-CB 3.33Å; A163-V166 PolarHBondContact O-N 2.85Å
164	L	98.1	Very high	97	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.3	-35.8	179.5	-171.7	63.3	0	0	0	112.5	L142 L144 F160 I161 V166 V167 F168 V184	L142-L164 HydrophobicContact CD2-CD1 3.68Å; L144-L164 HydrophobicContact CD1-CD1 4.31Å; F160-L164 HydrophobicContact CE1-CB 4.48Å; F160-L164 HydrophobicContact CE1-CD2 3.79Å; F160-L164 HydrophobicContact CZ-CD2 4.12Å; F160-L164 WeakPolarHBondContact O-CB 3.2Å; F160-L164 PolarHBondContact O-N 2.76Å; I161-L164 PolarHBondContact O-N 3.11Å; L164-V166 PolarHBondContact O-N 3.2Å; L164-V167 PolarHBondContact O-N 3.33Å; L164-F168 HydrophobicContact CD1-CE1 4.02Å; L164-F168 HydrophobicContact CD1-CZ 4.14Å; L164-F168 HydrophobicContact CD2-CE1 4.2Å; L164-F168 HydrophobicContact CD2-CE2 3.86Å; L164-F168 HydrophobicContact CD2-CZ 3.47Å; L164-F168 VanDerWaalsContact CD2-CZ 3.47Å; L164-F168 HydrophobicContact CG-CD1 4.47Å; L164-F168 HydrophobicContact CG-CD2 4.5Å; L164-F168 HydrophobicContact CG-CE1 3.86Å; L164-F168 HydrophobicContact CG-CE2 3.91Å; L164-F168 HydrophobicContact CG-CZ 3.57Å; L164-F168 PolarHBondContact O-N 3.33Å; L164-V184 HydrophobicContact CD2-CG1 3.57Å
165	T	97.8	Very high	97.1	Very high	39 Å²	39	36.7 Å²	36.7	24%	0.239	21%	0.21	C	C	.	.	H	α-helix	trans	-59.2	-32.7	177.8	-64.9	0	0	0	0	112	I161 S162 A163 V167 F168 V169 V191	I161-T165 VanDerWaalsContact O-CB 3.25Å; I161-T165 WeakPolarHBondContact O-CB 3.38Å; I161-T165 PolarHBondContact O-N 3Å; I161-T165 PolarHBondContact O-OG1 2.89Å; S162-T165 PolarHBondContact O-N 2.84Å; A163-T165 VanDerWaalsContact C-N 3.34Å; A163-T165 PolarHBondContact O-N 2.86Å; T165-V167 PolarHBondContact O-N 2.7Å; T165-F168 PolarHBondContact O-N 2.96Å; T165-V169 HydrophobicContact CG2-CG2 3.85Å; T165-V169 WeakPolarHBondContact O-CB 3.22Å; T165-V169 WeakPolarHBondContact O-CG2 3.43Å; T165-V169 PolarHBondContact O-N 3.05Å; T165-V191 HydrophobicContact CG2-CG1 4.27Å
166	V	97.4	Very high	97.2	Very high	29 Å²	29	36.9 Å²	36.9	18%	0.176	21%	0.212	C	C	.	.	H	α-helix	trans	-56.5	-42.2	174.2	175.2	0	0	0	0	110.6	V135 S162 A163 L164 N170	V135-V166 HydrophobicContact CG2-CG1 3.84Å; S162-V166 PolarHBondContact O-N 2.88Å; A163-V166 WeakPolarHBondContact O-CB 3.33Å; A163-V166 PolarHBondContact O-N 2.85Å; L164-V166 PolarHBondContact O-N 3.2Å; V166-N170 WeakPolarHBondContact O-CB 3.41Å; V166-N170 PolarHBondContact O-N 3.2Å; V166-N170 VanDerWaalsContact O-N 3.09Å; V166-N170 PolarHBondContact O-ND2 3.31Å
167	V	96.9	Very high	97.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-70.1	-48.6	177.8	178.6	0	0	0	0	111	L131 L134 L139 L142 L164 T165 V169 N170 S171	L131-V167 HydrophobicContact CD2-CG2 3.85Å; L134-V167 HydrophobicContact CD1-CG2 4.37Å; L139-V167 HydrophobicContact CD1-CG1 3.94Å; L139-V167 HydrophobicContact CD1-CG2 4.4Å; L142-V167 HydrophobicContact CD2-CB 4.27Å; L142-V167 HydrophobicContact CD2-CG1 3.99Å; L142-V167 HydrophobicContact CD2-CG2 4.27Å; L164-V167 PolarHBondContact O-N 3.33Å; T165-V167 PolarHBondContact O-N 2.7Å; V167-V169 VanDerWaalsContact C-N 3.27Å; V167-V169 PolarHBondContact O-N 3.49Å; V167-N170 PolarHBondContact O-N 3.03Å; V167-S171 WeakPolarHBondContact O-CB 3.23Å; V167-S171 PolarHBondContact O-N 3.08Å
168	F	97.4	Very high	97.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-56.9	-42.1	-179.4	-65.6	-12.5	0	0	0	112.2	L164 T165 L174 L177 V191 L192 N195 N196	L164-F168 HydrophobicContact CD1-CE1 4.02Å; L164-F168 HydrophobicContact CD1-CZ 4.14Å; L164-F168 HydrophobicContact CD2-CE1 4.2Å; L164-F168 HydrophobicContact CD2-CE2 3.86Å; L164-F168 HydrophobicContact CD2-CZ 3.47Å; L164-F168 VanDerWaalsContact CD2-CZ 3.47Å; L164-F168 HydrophobicContact CG-CD1 4.47Å; L164-F168 HydrophobicContact CG-CD2 4.5Å; L164-F168 HydrophobicContact CG-CE1 3.86Å; L164-F168 HydrophobicContact CG-CE2 3.91Å; L164-F168 HydrophobicContact CG-CZ 3.57Å; L164-F168 PolarHBondContact O-N 3.33Å; T165-F168 PolarHBondContact O-N 2.96Å; F168-L174 HydrophobicContact CD1-CD2 4.15Å; F168-L174 HydrophobicContact CE1-CD2 4.37Å; F168-L177 HydrophobicContact CE1-CD1 4.23Å; F168-L177 HydrophobicContact CE1-CD2 3.61Å; F168-L177 HydrophobicContact CZ-CD2 3.84Å; F168-V191 HydrophobicContact CB-CG1 4.09Å; F168-V191 HydrophobicContact CD2-CG1 4.43Å; F168-L192 HydrophobicContact CD1-CB 4.41Å; F168-L192 HydrophobicContact CD1-CD1 3.81Å; F168-L192 HydrophobicContact CD2-CB 3.92Å; F168-L192 HydrophobicContact CE1-CB 4.39Å; F168-L192 HydrophobicContact CE1-CD1 3.84Å; F168-L192 HydrophobicContact CE2-CB 3.88Å; F168-L192 HydrophobicContact CG-CB 4.18Å; F168-L192 HydrophobicContact CG-CD1 4.31Å; F168-L192 HydrophobicContact CZ-CB 4.11Å; F168-L192 HydrophobicContact CZ-CD1 4.33Å; F168-L192 HydrophobicContact CZ-CD2 4.46Å; F168-N195 WeakPolarHBondContact O-CB 3.26Å; F168-N196 PolarHBondContact O-OD1 2.99Å
169	V	97.2	Very high	97.4	Very high	57 Å²	57	28.8 Å²	28.8	35%	0.345	16%	0.159	S	C	.	.	H	α-helix	trans	-74.9	-41.3	-178.5	174.4	0	0	0	0	111.8	T165 V167 K172 V191	T165-V169 HydrophobicContact CG2-CG2 3.85Å; T165-V169 WeakPolarHBondContact O-CB 3.22Å; T165-V169 WeakPolarHBondContact O-CG2 3.43Å; T165-V169 PolarHBondContact O-N 3.05Å; V167-V169 VanDerWaalsContact C-N 3.27Å; V167-V169 PolarHBondContact O-N 3.49Å; V169-K172 WeakPolarHBondContact O-CE 3.45Å; V169-K172 PolarHBondContact O-NZ 3.33Å; V169-V191 HydrophobicContact CG2-CG1 4.11Å
170	N	96	Very high	97.4	Very high	58 Å²	58	28.3 Å²	28.3	31%	0.31	16%	0.158	S	C	.	.	H	α-helix	trans	-91.2	-28.9	-171	-64.4	-65.8	0	0	0	113.6	V135 V166 V167 K172	V135-N170 WeakPolarHBondContact O-CB 3.33Å; V166-N170 WeakPolarHBondContact O-CB 3.41Å; V166-N170 PolarHBondContact O-N 3.2Å; V166-N170 VanDerWaalsContact O-N 3.09Å; V166-N170 PolarHBondContact O-ND2 3.31Å; V167-N170 PolarHBondContact O-N 3.03Å; N170-K172 PolarHBondContact O-N 3.43Å; N170-K172 VanDerWaalsContact O-N 3.16Å
171	S	95	Very high	97.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.171	C	C	.	.			trans	-88	83.4	-178.2	-65.8	0	0	0	0	112	C137 L139 V167 S173 L174 N196	C137-S171 PolarHBondContact O-OG 3.12Å; L139-S171 WeakPolarHBondContact CB-OG 3.45Å; L139-S171 PolarHBondContact N-OG 2.61Å; V167-S171 WeakPolarHBondContact O-CB 3.23Å; V167-S171 PolarHBondContact O-N 3.08Å; S171-S173 PolarHBondContact O-N 3.3Å; S171-S173 VanDerWaalsContact O-N 3.08Å; S171-L174 PolarHBondContact O-N 2.68Å; S171-N196 PolarHBondContact O-ND2 2.8Å
172	K	93.9	Very high	97.2	Very high	116 Å²	116	29.5 Å²	29.5	50%	0.504	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-2.8	-178.1	-55.3	-51.3	-169.2	-173.8	0	115.8	V169 N170 N195	V169-K172 WeakPolarHBondContact O-CE 3.45Å; V169-K172 PolarHBondContact O-NZ 3.33Å; N170-K172 PolarHBondContact O-N 3.43Å; N170-K172 VanDerWaalsContact O-N 3.16Å; K172-N195 PolarHBondContact NZ-OD1 3.43Å
173	S	95.4	Very high	97.2	Very high	37 Å²	37	26.7 Å²	26.7	26%	0.259	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.8	20.1	-179.4	61.5	0	0	0	0	113.5	S138 L139 K140 S171 S175	S138-S173 PolarHBondContact OG-OG 3.42Å; L139-S173 CarbonylContact O-C 3.54Å; L139-S173 VanDerWaalsContact O-C 3.3Å; L139-S173 PolarHBondContact O-OG 3.32Å; K140-S173 WeakPolarHBondContact CA-O 3.45Å; S171-S173 PolarHBondContact O-N 3.3Å; S171-S173 VanDerWaalsContact O-N 3.08Å; S173-S175 PolarHBondContact O-N 2.72Å; S173-S175 VanDerWaalsContact O-N 3.16Å
174	L	98.1	Very high	97.2	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.144	C	C	.	.			trans	-66	116.9	-175.8	-170.8	65.9	0	0	0	110.2	L139 L142 F168 S171 L177 L192 N196 T199 L200	L139-L174 HydrophobicContact CB-CD1 4.35Å; L139-L174 WeakPolarHBondContact O-CA 3.41Å; L139-L174 PolarHBondContact O-N 3.19Å; L142-L174 HydrophobicContact CB-CD1 4.15Å; F168-L174 HydrophobicContact CD1-CD2 4.15Å; F168-L174 HydrophobicContact CE1-CD2 4.37Å; S171-L174 PolarHBondContact O-N 2.68Å; L174-L177 HydrophobicContact CD2-CD1 4.43Å; L174-L192 HydrophobicContact CD2-CD1 3.94Å; L174-N196 HydrophobicContact CB-CB 4.42Å; L174-T199 CarbonylContact O-C 3.53Å; L174-T199 WeakPolarHBondContact O-CB 3.45Å; L174-T199 PolarHBondContact O-OG1 2.79Å; L174-L200 PolarHBondContact O-N 2.82Å
175	S	98.3	Very high	97.2	Very high	32 Å²	32	27.5 Å²	27.5	22%	0.224	15%	0.149	C	C	.	.			trans	-114.2	-26.9	-173.4	68.4	0	0	0	0	113.8	K140 S173 T199 K201 L202	K140-S175 WeakPolarHBondContact O-CA 3.28Å; K140-S175 PolarHBondContact O-N 3.02Å; K140-S175 PolarHBondContact O-OG 3.38Å; S173-S175 PolarHBondContact O-N 2.72Å; S173-S175 VanDerWaalsContact O-N 3.16Å; S175-T199 VanDerWaalsContact CA-O 3.29Å; S175-T199 WeakPolarHBondContact CA-O 3.27Å; S175-T199 WeakPolarHBondContact CB-O 3.3Å; S175-K201 WeakPolarHBondContact O-CA 3.41Å; S175-K201 PolarHBondContact O-N 2.81Å; S175-L202 PolarHBondContact O-N 2.85Å
176	S	98.7	Very high	97.2	Very high	14 Å²	14	27.3 Å²	27.3	10%	0.098	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	125.1	-179.9	170.6	0	0	0	0	109.5	K140 T141 L142 L202	K140-S176 PolarHBondContact O-N 2.93Å; T141-S176 VanDerWaalsContact CA-O 3.32Å; T141-S176 WeakPolarHBondContact CA-O 3.33Å; L142-S176 PolarHBondContact N-O 3.14Å; S176-L202 WeakPolarHBondContact CA-O 3.46Å
177	L	98.8	Very high	97.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	122.2	177.2	-174.5	62.7	0	0	0	109.6	L142 F168 L174 I179 L192 L200 L202 L203 K204	L142-L177 HydrophobicContact CB-CD1 3.93Å; L142-L177 HydrophobicContact CD2-CD1 3.9Å; L142-L177 HydrophobicContact CG-CD1 4.12Å; L142-L177 WeakPolarHBondContact O-CA 3.37Å; F168-L177 HydrophobicContact CE1-CD1 4.23Å; F168-L177 HydrophobicContact CE1-CD2 3.61Å; F168-L177 HydrophobicContact CZ-CD2 3.84Å; L174-L177 HydrophobicContact CD2-CD1 4.43Å; L177-I179 HydrophobicContact CD1-CG2 3.61Å; L177-I179 HydrophobicContact CD2-CD1 3.94Å; L177-I179 HydrophobicContact CD2-CG1 4.36Å; L177-I179 HydrophobicContact CD2-CG2 4.33Å; L177-I179 HydrophobicContact CG-CD1 4.29Å; L177-I179 HydrophobicContact CG-CG1 4.17Å; L177-I179 HydrophobicContact CG-CG2 3.8Å; L177-L192 HydrophobicContact CD2-CD1 4.18Å; L177-L192 HydrophobicContact CD2-CD2 3.69Å; L177-L200 HydrophobicContact CB-CD1 4.33Å; L177-L202 PolarHBondContact N-O 3.39Å; L177-L203 HydrophobicContact CB-CD1 4.11Å; L177-L203 HydrophobicContact CD2-CD1 3.95Å; L177-L203 HydrophobicContact CG-CD1 4.21Å; L177-L203 WeakPolarHBondContact O-CA 3.29Å; L177-K204 PolarHBondContact O-N 3.32Å
178	K	98.6	Very high	97.4	Very high	79 Å²	79	30 Å²	30	34%	0.343	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	115	171.6	-55	178.6	-177.1	174	0	108.1	L142 G143 L144 L202 K204	L142-K178 PolarHBondContact O-N 2.78Å; G143-K178 CarbonylContact C-O 3.53Å; G143-K178 WeakPolarHBondContact CA-O 3.31Å; L144-K178 PolarHBondContact N-O 3.27Å; K178-L202 HydrophobicContact CG-CD2 4.01Å; K178-K204 HydrophobicContact CB-CB 4.39Å; K178-K204 HydrophobicContact CD-CD 4.48Å; K178-K204 HydrophobicContact CG-CB 4.26Å; K178-K204 HydrophobicContact CG-CD 4.29Å; K178-K204 HydrophobicContact CG-CG 4.43Å
179	I	97.9	Very high	97.4	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.165	C	C	.	.			trans	-141.3	34.1	-172.1	51.6	165.8	0	0	0	109.9	L144 L177 T182 V184 L203 K204 M205 C208	L144-I179 HydrophobicContact CD1-CG2 4.12Å; L144-I179 HydrophobicContact CG-CG2 4.32Å; L177-I179 HydrophobicContact CD1-CG2 3.61Å; L177-I179 HydrophobicContact CD2-CD1 3.94Å; L177-I179 HydrophobicContact CD2-CG1 4.36Å; L177-I179 HydrophobicContact CD2-CG2 4.33Å; L177-I179 HydrophobicContact CG-CD1 4.29Å; L177-I179 HydrophobicContact CG-CG1 4.17Å; L177-I179 HydrophobicContact CG-CG2 3.8Å; I179-T182 HydrophobicContact CB-CG2 4.18Å; I179-T182 WeakPolarHBondContact O-CB 3.47Å; I179-T182 WeakPolarHBondContact O-CG2 3.27Å; I179-T182 PolarHBondContact O-OG1 2.98Å; I179-V184 HydrophobicContact CD1-CB 4.39Å; I179-V184 HydrophobicContact CD1-CG1 3.82Å; I179-V184 HydrophobicContact CD1-CG2 3.96Å; I179-L203 HydrophobicContact CD1-CD1 4.33Å; I179-L203 HydrophobicContact CG1-CD1 4.46Å; I179-K204 WeakPolarHBondContact CG1-O 3.29Å; I179-K204 PolarHBondContact N-O 2.99Å; I179-M205 HydrophobicContact CD1-CB 4.16Å; I179-M205 HydrophobicContact CG1-CB 3.9Å; I179-C208 PolarHBondContact O-SG 3.05Å; I179-C208 VanDerWaalsContact O-SG 3.39Å
180	D	96.9	Very high	97.5	Very high	44 Å²	44	33.3 Å²	33.3	24%	0.235	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	145.2	174.3	-55.6	-50.6	0	0	0	109.8	T182 M205 S206	D180-T182 VanDerWaalsContact C-N 3.35Å; D180-T182 PolarHBondContact O-N 3.48Å; D180-M205 WeakPolarHBondContact OD1-CA 3.37Å; D180-M205 PolarHBondContact OD1-N 2.89Å; D180-S206 CarbonylContact C-O 3.45Å; D180-S206 VanDerWaalsContact CA-O 3.24Å; D180-S206 WeakPolarHBondContact CA-O 3.08Å; D180-S206 PolarHBondContact OD1-N 3.08Å
181	D	96.4	Very high	97.6	Very high	51 Å²	51	32.8 Å²	32.8	27%	0.273	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	40.6	-179.9	-48.2	-64.8	0	0	0	114.7	P150 M153 S206 S207	P150-D181 HydrophobicContact CB-CB 3.54Å; M153-D181 VanDerWaalsContact CE-C 3.42Å; D181-S206 PolarHBondContact N-O 3.08Å; D181-S207 WeakPolarHBondContact OD1-CB 3.34Å; D181-S207 PolarHBondContact OD1-OG 3.04Å
182	T	97.6	Very high	97.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.173	C	C	.	.			trans	-120	153.2	178.3	65.5	0	0	0	0	113.4	L144 F152 M153 F160 I179 D180 V184	L144-T182 HydrophobicContact CB-CG2 4.45Å; L144-T182 HydrophobicContact CD1-CG2 4.34Å; F152-T182 HydrophobicContact CB-CG2 4.42Å; F152-T182 HydrophobicContact CD2-CG2 4.25Å; F152-T182 HydrophobicContact CG-CG2 4.41Å; M153-T182 WeakPolarHBondContact CE-O 3.29Å; F160-T182 HydrophobicContact CE1-CG2 4.4Å; F160-T182 HydrophobicContact CE2-CG2 4.14Å; F160-T182 HydrophobicContact CZ-CG2 3.62Å; I179-T182 HydrophobicContact CB-CG2 4.18Å; I179-T182 WeakPolarHBondContact O-CB 3.47Å; I179-T182 WeakPolarHBondContact O-CG2 3.27Å; I179-T182 PolarHBondContact O-OG1 2.98Å; D180-T182 VanDerWaalsContact C-N 3.35Å; D180-T182 PolarHBondContact O-N 3.48Å; T182-V184 PolarHBondContact O-N 2.82Å
183	P	97.6	Very high	97.9	Very high	4 Å²	4	27.3 Å²	27.3	3%	0.026	15%	0.149	C	C	.	.			trans	-81.5	31.5	-179.1	35.6	-37.8	0	0	0	113	M153 K157 F160	M153-P183 HydrophobicContact SD-CB 3.96Å; K157-P183 HydrophobicContact CG-CB 4.32Å; K157-P183 WeakPolarHBondContact CG-O 3.43Å; F160-P183 HydrophobicContact CB-CG 3.85Å; F160-P183 HydrophobicContact CD1-CG 3.6Å; F160-P183 HydrophobicContact CD2-CG 4.45Å; F160-P183 HydrophobicContact CE1-CG 4.28Å; F160-P183 HydrophobicContact CG-CG 3.7Å
184	V	97.8	Very high	98	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.168	C	C	.	.			trans	-58.9	148.8	174	-71.3	0	0	0	0	111.7	F160 L164 I179 T182 C208 H210 V211	F160-V184 HydrophobicContact CE1-CG1 3.74Å; L164-V184 HydrophobicContact CD2-CG1 3.57Å; I179-V184 HydrophobicContact CD1-CB 4.39Å; I179-V184 HydrophobicContact CD1-CG1 3.82Å; I179-V184 HydrophobicContact CD1-CG2 3.96Å; T182-V184 PolarHBondContact O-N 2.82Å; V184-C208 HydrophobicContact CG2-CB 3.78Å; V184-C208 VanDerWaalsContact CG2-SG 3.5Å; V184-H210 CarbonylContact O-C 3.57Å; V184-H210 WeakPolarHBondContact O-CB 3.38Å; V184-V211 HydrophobicContact CG2-CG2 3.96Å; V184-V211 WeakPolarHBondContact O-CG2 3.38Å
185	D	98	Very high	98	Very high	17 Å²	17	31.4 Å²	31.4	9%	0.091	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-134.6	167.9	-178.6	63	14.4	0	0	0	113.4	K157 P187 S188 L189 H210	K157-D185 WeakPolarHBondContact CE-OD2 3.47Å; K157-D185 IonicContact NZ-OD2 2.79Å; K157-D185 PolarHBondContact NZ-OD2 2.83Å; D185-P187 WeakPolarHBondContact OD1-CD 3.45Å; D185-S188 PolarHBondContact N-OG 2.95Å; D185-S188 VanDerWaalsContact N-OG 3.1Å; D185-S188 PolarHBondContact O-N 3.41Å; D185-S188 PolarHBondContact O-OG 3.12Å; D185-S188 WeakPolarHBondContact OD1-CB 3.39Å; D185-S188 PolarHBondContact OD1-N 2.91Å; D185-S188 PolarHBondContact OD1-OG 3.3Å; D185-L189 PolarHBondContact O-N 3.38Å; D185-H210 WeakPolarHBondContact CA-O 3.49Å; D185-H210 HydrophobicContact CB-CB 3.95Å
186	D	98.4	Very high	98	Very high	36 Å²	36	30 Å²	30	19%	0.193	17%	0.169	C	C	.	.	H	α-helix	trans	-53.2	-43	-178.4	-60.8	-3.9	0	0	0	113.9	S188 L189 K190 V211 S212 G215	D186-S188 VanDerWaalsContact C-N 3.35Å; D186-S188 PolarHBondContact O-N 2.8Å; D186-L189 PolarHBondContact O-N 3.16Å; D186-K190 WeakPolarHBondContact O-CG 3.1Å; D186-K190 PolarHBondContact O-N 3.38Å; D186-V211 VanDerWaalsContact OD1-CA 3.29Å; D186-V211 WeakPolarHBondContact OD1-CA 3.4Å; D186-S212 PolarHBondContact OD1-N 3.46Å; D186-S212 WeakPolarHBondContact OD2-CB 3.4Å; D186-S212 PolarHBondContact OD2-OG 3.43Å; D186-G215 VanDerWaalsContact CG-CA 3.46Å; D186-G215 WeakPolarHBondContact OD1-CA 3.3Å
187	P	98.6	Very high	98	Very high	83 Å²	83	30.5 Å²	30.5	54%	0.539	17%	0.173	S	C	.	.	H	α-helix	trans	-57	-44.2	173.3	-26.5	35.5	0	0	0	113.4	D185 L189 K190 V191	D185-P187 WeakPolarHBondContact OD1-CD 3.45Å; P187-L189 VanDerWaalsContact C-N 3.34Å; P187-L189 PolarHBondContact O-N 3.01Å; P187-K190 WeakPolarHBondContact O-CB 3.5Å; P187-K190 PolarHBondContact O-N 3.46Å; P187-V191 WeakPolarHBondContact O-CG2 3.5Å; P187-V191 PolarHBondContact O-N 3.3Å; P187-V191 VanDerWaalsContact O-N 3.13Å
188	S	98.1	Very high	97.9	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.014	21%	0.211	C	C	.	.	H	α-helix	trans	-65.7	-36	178.2	72.3	0	0	0	0	112.9	D185 D186 K190 V191 L192	D185-S188 PolarHBondContact N-OG 2.95Å; D185-S188 VanDerWaalsContact N-OG 3.1Å; D185-S188 PolarHBondContact O-N 3.41Å; D185-S188 PolarHBondContact O-OG 3.12Å; D185-S188 WeakPolarHBondContact OD1-CB 3.39Å; D185-S188 PolarHBondContact OD1-N 2.91Å; D185-S188 PolarHBondContact OD1-OG 3.3Å; D186-S188 VanDerWaalsContact C-N 3.35Å; D186-S188 PolarHBondContact O-N 2.8Å; S188-K190 VanDerWaalsContact C-N 3.35Å; S188-V191 WeakPolarHBondContact O-CB 3.36Å; S188-V191 PolarHBondContact O-N 3.22Å; S188-L192 PolarHBondContact O-N 3.48Å
189	L	98.4	Very high	97.9	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-65.6	-36.9	173	-67.7	-177.4	0	0	0	112	D185 D186 P187 V191 L192 V193 M205 V211 V219	D185-L189 PolarHBondContact O-N 3.38Å; D186-L189 PolarHBondContact O-N 3.16Å; P187-L189 VanDerWaalsContact C-N 3.34Å; P187-L189 PolarHBondContact O-N 3.01Å; L189-V191 VanDerWaalsContact C-N 3.28Å; L189-V191 PolarHBondContact O-N 3.08Å; L189-L192 HydrophobicContact CD2-CD2 4.26Å; L189-L192 WeakPolarHBondContact O-CB 2.92Å; L189-L192 PolarHBondContact O-N 3.47Å; L189-V193 VanDerWaalsContact O-CG2 3.25Å; L189-V193 WeakPolarHBondContact O-CG2 3.48Å; L189-V193 PolarHBondContact O-N 3.33Å; L189-M205 HydrophobicContact CD1-CE 4.1Å; L189-V211 HydrophobicContact CD1-CB 4.44Å; L189-V211 HydrophobicContact CD1-CG1 3.67Å; L189-V211 HydrophobicContact CD1-CG2 3.87Å; L189-V219 HydrophobicContact CB-CG2 4.1Å; L189-V219 HydrophobicContact CD1-CG2 4.19Å; L189-V219 HydrophobicContact CD2-CG2 4.48Å
190	K	98.2	Very high	97.9	Very high	126 Å²	126	35.6 Å²	35.6	55%	0.548	21%	0.205	S	C	.	.	H	α-helix	trans	-61.8	-37.6	172.3	-72.5	178.2	179.9	179	0	112	D186 P187 S188 V193 A194	D186-K190 WeakPolarHBondContact O-CG 3.1Å; D186-K190 PolarHBondContact O-N 3.38Å; P187-K190 WeakPolarHBondContact O-CB 3.5Å; P187-K190 PolarHBondContact O-N 3.46Å; S188-K190 VanDerWaalsContact C-N 3.35Å; K190-V193 PolarHBondContact O-N 2.94Å; K190-A194 VanDerWaalsContact O-CB 3.28Å; K190-A194 WeakPolarHBondContact O-CB 3.07Å; K190-A194 PolarHBondContact O-N 3.25Å
191	V	98.4	Very high	98	Very high	47 Å²	47	38.8 Å²	38.8	29%	0.285	22%	0.217	S	C	.	.	H	α-helix	trans	-65.7	-43.5	174.5	177.7	0	0	0	0	110.9	T165 F168 V169 P187 S188 L189 A194 N195	T165-V191 HydrophobicContact CG2-CG1 4.27Å; F168-V191 HydrophobicContact CB-CG1 4.09Å; F168-V191 HydrophobicContact CD2-CG1 4.43Å; V169-V191 HydrophobicContact CG2-CG1 4.11Å; P187-V191 WeakPolarHBondContact O-CG2 3.5Å; P187-V191 PolarHBondContact O-N 3.3Å; P187-V191 VanDerWaalsContact O-N 3.13Å; S188-V191 WeakPolarHBondContact O-CB 3.36Å; S188-V191 PolarHBondContact O-N 3.22Å; L189-V191 VanDerWaalsContact C-N 3.28Å; L189-V191 PolarHBondContact O-N 3.08Å; V191-A194 PolarHBondContact O-N 3.02Å; V191-N195 PolarHBondContact O-N 3.21Å; V191-N195 PolarHBondContact O-ND2 3.27Å
192	L	98.3	Very high	98.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-55.7	-53	173.5	171.8	65.5	0	0	0	110.9	F168 L174 L177 S188 L189 A194 N195 N196 L200	F168-L192 HydrophobicContact CD1-CB 4.41Å; F168-L192 HydrophobicContact CD1-CD1 3.81Å; F168-L192 HydrophobicContact CD2-CB 3.92Å; F168-L192 HydrophobicContact CE1-CB 4.39Å; F168-L192 HydrophobicContact CE1-CD1 3.84Å; F168-L192 HydrophobicContact CE2-CB 3.88Å; F168-L192 HydrophobicContact CG-CB 4.18Å; F168-L192 HydrophobicContact CG-CD1 4.31Å; F168-L192 HydrophobicContact CZ-CB 4.11Å; F168-L192 HydrophobicContact CZ-CD1 4.33Å; F168-L192 HydrophobicContact CZ-CD2 4.46Å; L174-L192 HydrophobicContact CD2-CD1 3.94Å; L177-L192 HydrophobicContact CD2-CD1 4.18Å; L177-L192 HydrophobicContact CD2-CD2 3.69Å; S188-L192 PolarHBondContact O-N 3.48Å; L189-L192 HydrophobicContact CD2-CD2 4.26Å; L189-L192 WeakPolarHBondContact O-CB 2.92Å; L189-L192 PolarHBondContact O-N 3.47Å; L192-A194 PolarHBondContact O-N 3.19Å; L192-N195 PolarHBondContact O-N 3.25Å; L192-N196 HydrophobicContact CD1-CB 4.07Å; L192-N196 WeakPolarHBondContact O-CB 3.44Å; L192-N196 PolarHBondContact O-N 3.46Å; L192-L200 HydrophobicContact CD2-CD2 4.11Å
193	V	98	Very high	98.2	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-58.7	-48.6	-179.3	171.4	0	0	0	0	111.1	L189 K190 N195 N196 S197 V219 Q222	L189-V193 VanDerWaalsContact O-CG2 3.25Å; L189-V193 WeakPolarHBondContact O-CG2 3.48Å; L189-V193 PolarHBondContact O-N 3.33Å; K190-V193 PolarHBondContact O-N 2.94Å; V193-N195 PolarHBondContact O-N 3.47Å; V193-N195 VanDerWaalsContact O-N 3.07Å; V193-N196 PolarHBondContact O-N 3.16Å; V193-S197 VanDerWaalsContact O-CB 3.23Å; V193-S197 WeakPolarHBondContact O-CB 3.46Å; V193-S197 PolarHBondContact O-N 2.77Å; V193-S197 PolarHBondContact O-OG 2.86Å; V193-V219 HydrophobicContact CG2-CB 4.17Å; V193-V219 HydrophobicContact CG2-CG1 4.38Å; V193-V219 HydrophobicContact CG2-CG2 3.82Å; V193-Q222 HydrophobicContact CG1-CB 3.36Å; V193-Q222 HydrophobicContact CG1-CG 3.9Å
194	A	98.1	Very high	98.2	Very high	79 Å²	79	39.7 Å²	39.7	65%	0.653	22%	0.219	S	C	*	.	H	α-helix	trans	-61.4	-20.7	-178.8	0	0	0	0	0	114	K190 V191 L192	K190-A194 VanDerWaalsContact O-CB 3.28Å; K190-A194 WeakPolarHBondContact O-CB 3.07Å; K190-A194 PolarHBondContact O-N 3.25Å; V191-A194 PolarHBondContact O-N 3.02Å; L192-A194 PolarHBondContact O-N 3.19Å
195	N	97.9	Very high	98.2	Very high	44 Å²	44	39.7 Å²	39.7	24%	0.235	22%	0.219	C	C	.	.	H	α-helix	trans	-108.7	-22.2	-178.5	-72.5	-82.5	0	0	0	114.1	F168 K172 V191 L192 V193	F168-N195 WeakPolarHBondContact O-CB 3.26Å; K172-N195 PolarHBondContact NZ-OD1 3.43Å; V191-N195 PolarHBondContact O-N 3.21Å; V191-N195 PolarHBondContact O-ND2 3.27Å; L192-N195 PolarHBondContact O-N 3.25Å; V193-N195 PolarHBondContact O-N 3.47Å; V193-N195 VanDerWaalsContact O-N 3.07Å
196	N	97.8	Very high	98	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-138.6	12.6	-166.8	-59.5	122.1	0	0	0	114.6	F168 S171 L174 L192 V193 D198 T199 L200	F168-N196 PolarHBondContact O-OD1 2.99Å; S171-N196 PolarHBondContact O-ND2 2.8Å; L174-N196 HydrophobicContact CB-CB 4.42Å; L192-N196 HydrophobicContact CD1-CB 4.07Å; L192-N196 WeakPolarHBondContact O-CB 3.44Å; L192-N196 PolarHBondContact O-N 3.46Å; V193-N196 PolarHBondContact O-N 3.16Å; N196-D198 PolarHBondContact O-N 3.04Å; N196-T199 PolarHBondContact O-N 3.48Å; N196-T199 PolarHBondContact O-OG1 3.04Å; N196-L200 WeakPolarHBondContact O-CB 3.45Å; N196-L200 PolarHBondContact O-N 2.78Å
197	S	97.4	Very high	97.9	Very high	25 Å²	25	40 Å²	40	18%	0.175	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-37.6	177.6	52.3	0	0	0	0	113.6	V193 T199	V193-S197 VanDerWaalsContact O-CB 3.23Å; V193-S197 WeakPolarHBondContact O-CB 3.46Å; V193-S197 PolarHBondContact O-N 2.77Å; V193-S197 PolarHBondContact O-OG 2.86Å; S197-T199 VanDerWaalsContact C-N 3.31Å; S197-T199 PolarHBondContact O-N 2.96Å
198	D	97.5	Very high	97.8	Very high	150 Å²	150	36.1 Å²	36.1	80%	0.802	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-14.8	-178.1	-62.2	-31.1	0	0	0	113.6	N196	N196-D198 PolarHBondContact O-N 3.04Å
199	T	98.3	Very high	97.6	Very high	37 Å²	37	39.7 Å²	39.7	23%	0.227	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-25.9	-170.8	60.3	0	0	0	0	113.8	L174 S175 N196 S197 K201	L174-T199 CarbonylContact O-C 3.53Å; L174-T199 WeakPolarHBondContact O-CB 3.45Å; L174-T199 PolarHBondContact O-OG1 2.79Å; S175-T199 VanDerWaalsContact CA-O 3.29Å; S175-T199 WeakPolarHBondContact CA-O 3.27Å; S175-T199 WeakPolarHBondContact CB-O 3.3Å; N196-T199 PolarHBondContact O-N 3.48Å; N196-T199 PolarHBondContact O-OG1 3.04Å; S197-T199 VanDerWaalsContact C-N 3.31Å; S197-T199 PolarHBondContact O-N 2.96Å; T199-K201 PolarHBondContact O-N 3.37Å
200	L	98.6	Very high	97.5	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.244	C	C	.	.			trans	-66.3	125.1	-175.2	-166.7	69.5	0	0	0	111.3	L174 L177 L192 N196 V219 C223 G225 L226	L174-L200 PolarHBondContact O-N 2.82Å; L177-L200 HydrophobicContact CB-CD1 4.33Å; L192-L200 HydrophobicContact CD2-CD2 4.11Å; N196-L200 WeakPolarHBondContact O-CB 3.45Å; N196-L200 PolarHBondContact O-N 2.78Å; L200-V219 HydrophobicContact CD2-CG1 4.22Å; L200-C223 HydrophobicContact CD2-CB 4.38Å; L200-G225 CarbonylContact O-C 3.54Å; L200-G225 VanDerWaalsContact O-C 3.26Å; L200-L226 HydrophobicContact CD2-CD1 4.41Å; L200-L226 HydrophobicContact CG-CD1 4.31Å; L200-L226 PolarHBondContact O-N 3.2Å
201	K	98.8	Very high	97.5	Very high	110 Å²	110	38.4 Å²	38.4	48%	0.478	22%	0.22	S	C	.	.			trans	-123.9	-30.4	-179.3	-65.5	178.4	-175.7	180	0	112.8	S175 T199 R227 E228	S175-K201 WeakPolarHBondContact O-CA 3.41Å; S175-K201 PolarHBondContact O-N 2.81Å; T199-K201 PolarHBondContact O-N 3.37Å; K201-R227 PolarHBondContact O-N 3.44Å; K201-E228 PolarHBondContact O-N 3.29Å
202	L	98.8	Very high	97.5	Very high	22 Å²	22	38 Å²	38	12%	0.115	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	127	-179.7	180	164	0	0	0	109.5	S175 S176 L177 K178 K204 E228	S175-L202 PolarHBondContact O-N 2.85Å; S176-L202 WeakPolarHBondContact CA-O 3.46Å; L177-L202 PolarHBondContact N-O 3.39Å; K178-L202 HydrophobicContact CG-CD2 4.01Å; L202-K204 HydrophobicContact CD2-CD 4.41Å; L202-K204 HydrophobicContact CD2-CG 3.83Å; L202-E228 WeakPolarHBondContact CA-O 3.45Å; L202-E228 HydrophobicContact CB-CB 4.2Å; L202-E228 HydrophobicContact CD1-CB 4.38Å; L202-E228 HydrophobicContact CG-CB 3.96Å
203	L	98.8	Very high	97.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	118.2	171.7	-178.9	58.3	0	0	0	109.9	L177 I179 M205 I216 V219 L226 E228 L229 A230	L177-L203 HydrophobicContact CB-CD1 4.11Å; L177-L203 HydrophobicContact CD2-CD1 3.95Å; L177-L203 HydrophobicContact CG-CD1 4.21Å; L177-L203 WeakPolarHBondContact O-CA 3.29Å; I179-L203 HydrophobicContact CD1-CD1 4.33Å; I179-L203 HydrophobicContact CG1-CD1 4.46Å; L203-M205 HydrophobicContact CD1-CB 4.49Å; L203-M205 HydrophobicContact CD1-CG 4.42Å; L203-M205 HydrophobicContact CD1-SD 4.27Å; L203-M205 HydrophobicContact CD2-CG 4.42Å; L203-M205 HydrophobicContact CD2-SD 3.65Å; L203-M205 HydrophobicContact CG-CG 4.05Å; L203-M205 HydrophobicContact CG-SD 3.91Å; L203-I216 HydrophobicContact CD2-CD1 4.24Å; L203-V219 HydrophobicContact CD2-CG1 3.9Å; L203-L226 HydrophobicContact CB-CD1 4.06Å; L203-E228 PolarHBondContact N-O 3.09Å; L203-L229 HydrophobicContact CB-CD1 4.1Å; L203-L229 HydrophobicContact CD2-CD1 4.19Å; L203-L229 HydrophobicContact CG-CD1 4.2Å; L203-L229 CarbonylContact O-C 3.43Å; L203-L229 VanDerWaalsContact O-CA 3.3Å; L203-L229 WeakPolarHBondContact O-CA 3.34Å; L203-A230 PolarHBondContact O-N 2.66Å
204	K	98.6	Very high	97.4	Very high	52 Å²	52	44 Å²	44	23%	0.226	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	119.9	170.2	-62.1	-170.4	177.6	-168.1	0	109.1	L177 K178 I179 L202 A230	L177-K204 PolarHBondContact O-N 3.32Å; K178-K204 HydrophobicContact CB-CB 4.39Å; K178-K204 HydrophobicContact CD-CD 4.48Å; K178-K204 HydrophobicContact CG-CB 4.26Å; K178-K204 HydrophobicContact CG-CD 4.29Å; K178-K204 HydrophobicContact CG-CG 4.43Å; I179-K204 WeakPolarHBondContact CG1-O 3.29Å; I179-K204 PolarHBondContact N-O 2.99Å; L202-K204 HydrophobicContact CD2-CD 4.41Å; L202-K204 HydrophobicContact CD2-CG 3.83Å; K204-A230 HydrophobicContact CB-CB 4.09Å; K204-A230 HydrophobicContact CD-CB 4.43Å; K204-A230 HydrophobicContact CG-CB 3.83Å
205	M	97.3	Very high	97.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.233	C	C	.	.			trans	-152	45	-172.3	59	173.4	-65.8	0	0	111.7	I179 D180 L189 L203 C208 V211 I216 A230	I179-M205 HydrophobicContact CD1-CB 4.16Å; I179-M205 HydrophobicContact CG1-CB 3.9Å; D180-M205 WeakPolarHBondContact OD1-CA 3.37Å; D180-M205 PolarHBondContact OD1-N 2.89Å; L189-M205 HydrophobicContact CD1-CE 4.1Å; L203-M205 HydrophobicContact CD1-CB 4.49Å; L203-M205 HydrophobicContact CD1-CG 4.42Å; L203-M205 HydrophobicContact CD1-SD 4.27Å; L203-M205 HydrophobicContact CD2-CG 4.42Å; L203-M205 HydrophobicContact CD2-SD 3.65Å; L203-M205 HydrophobicContact CG-CG 4.05Å; L203-M205 HydrophobicContact CG-SD 3.91Å; M205-C208 HydrophobicContact CE-CB 4.23Å; M205-C208 PolarHBondContact O-SG 2.86Å; M205-V211 HydrophobicContact CE-CB 3.95Å; M205-V211 HydrophobicContact CE-CG1 3.82Å; M205-V211 HydrophobicContact CE-CG2 3.65Å; M205-I216 HydrophobicContact SD-CD1 3.91Å; M205-A230 PolarHBondContact N-O 3.33Å
206	S	94.7	Very high	97.4	Very high	9 Å²	9	38.2 Å²	38.2	6%	0.063	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	148.5	169.2	-65	0	0	0	0	110.2	D180 D181 D258	D180-S206 CarbonylContact C-O 3.45Å; D180-S206 VanDerWaalsContact CA-O 3.24Å; D180-S206 WeakPolarHBondContact CA-O 3.08Å; D180-S206 PolarHBondContact OD1-N 3.08Å; D181-S206 PolarHBondContact N-O 3.08Å; S206-D258 VanDerWaalsContact CB-OD2 3.25Å; S206-D258 WeakPolarHBondContact CB-OD2 3.42Å; S206-D258 PolarHBondContact OG-OD2 3.38Å
207	S	94.6	Very high	97.4	Very high	51 Å²	51	40.1 Å²	40.1	36%	0.357	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	43	-178.5	-50.9	0	0	0	0	114.3	M153 D181 P209 N232	M153-S207 WeakPolarHBondContact CE-O 3.34Å; D181-S207 WeakPolarHBondContact OD1-CB 3.34Å; D181-S207 PolarHBondContact OD1-OG 3.04Å; S207-P209 VanDerWaalsContact O-CD 3.29Å; S207-P209 WeakPolarHBondContact O-CD 3.4Å; S207-N232 VanDerWaalsContact CA-OD1 3.32Å; S207-N232 WeakPolarHBondContact CA-OD1 3.46Å; S207-N232 PolarHBondContact N-OD1 2.81Å
208	C	96.3	Very high	97.4	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.007	23%	0.231	C	C	.	.			trans	-106.1	88.5	175.2	-69.5	0	0	0	0	111	I179 V184 M205 H210 V211	I179-C208 PolarHBondContact O-SG 3.05Å; I179-C208 VanDerWaalsContact O-SG 3.39Å; V184-C208 HydrophobicContact CG2-CB 3.78Å; V184-C208 VanDerWaalsContact CG2-SG 3.5Å; M205-C208 HydrophobicContact CE-CB 4.23Å; M205-C208 PolarHBondContact O-SG 2.86Å; C208-H210 PolarHBondContact O-N 3.27Å; C208-H210 VanDerWaalsContact O-N 3.14Å; C208-V211 HydrophobicContact CB-CG2 4.18Å; C208-V211 PolarHBondContact O-N 2.71Å
209	P	94.7	Very high	97.5	Very high	78 Å²	78	33 Å²	33	51%	0.506	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-10.6	-165.3	30.6	-37.6	0	0	0	114.7	M153 S207	M153-P209 HydrophobicContact CE-CG 3.9Å; M153-P209 HydrophobicContact SD-CG 4.29Å; S207-P209 VanDerWaalsContact O-CD 3.29Å; S207-P209 WeakPolarHBondContact O-CD 3.4Å
210	H	96.9	Very high	97.5	Very high	92 Å²	92	31.2 Å²	31.2	43%	0.426	18%	0.183	S	C	.	.	B	Isolated β-bridge	trans	-103.6	6.1	-179	-54.4	-44.7	0	0	0	113.3	V184 D185 C208	V184-H210 CarbonylContact O-C 3.57Å; V184-H210 WeakPolarHBondContact O-CB 3.38Å; D185-H210 WeakPolarHBondContact CA-O 3.49Å; D185-H210 HydrophobicContact CB-CB 3.95Å; C208-H210 PolarHBondContact O-N 3.27Å; C208-H210 VanDerWaalsContact O-N 3.14Å
211	V	97.8	Very high	97.4	Very high	8 Å²	8	35.3 Å²	35.3	5%	0.048	20%	0.204	C	C	.	.			trans	-94.6	136.1	170.6	178.3	0	0	0	0	109.2	V184 D186 L189 M205 C208 L235	V184-V211 HydrophobicContact CG2-CG2 3.96Å; V184-V211 WeakPolarHBondContact O-CG2 3.38Å; D186-V211 VanDerWaalsContact OD1-CA 3.29Å; D186-V211 WeakPolarHBondContact OD1-CA 3.4Å; L189-V211 HydrophobicContact CD1-CB 4.44Å; L189-V211 HydrophobicContact CD1-CG1 3.67Å; L189-V211 HydrophobicContact CD1-CG2 3.87Å; M205-V211 HydrophobicContact CE-CB 3.95Å; M205-V211 HydrophobicContact CE-CG1 3.82Å; M205-V211 HydrophobicContact CE-CG2 3.65Å; C208-V211 HydrophobicContact CB-CG2 4.18Å; C208-V211 PolarHBondContact O-N 2.71Å; V211-L235 HydrophobicContact CB-CD1 4.45Å; V211-L235 HydrophobicContact CG1-CD1 4.22Å; V211-L235 HydrophobicContact CG1-CD2 4.45Å; V211-L235 VanDerWaalsContact O-CD2 3.32Å; V211-L235 WeakPolarHBondContact O-CD2 3.39Å
212	S	97.8	Very high	97.4	Very high	37 Å²	37	34.5 Å²	34.5	26%	0.259	20%	0.202	S	C	.	.			trans	-101.6	164.8	174.3	80.4	0	0	0	0	111.8	D186 A214 G215 I216	D186-S212 PolarHBondContact OD1-N 3.46Å; D186-S212 WeakPolarHBondContact OD2-CB 3.4Å; D186-S212 PolarHBondContact OD2-OG 3.43Å; S212-A214 PolarHBondContact O-N 3.2Å; S212-A214 PolarHBondContact OG-N 3.39Å; S212-G215 WeakPolarHBondContact O-CA 3.34Å; S212-G215 PolarHBondContact O-N 2.94Å; S212-G215 PolarHBondContact OG-N 2.97Å; S212-I216 PolarHBondContact O-N 2.93Å
213	P	97.8	Very high	97.3	Very high	60 Å²	60	33.4 Å²	33.4	39%	0.39	20%	0.197	S	C	.	.	H	α-helix	trans	-52.5	-34.6	170	-27.9	35.5	0	0	0	113.2	I216 L217 L235	P213-I216 VanDerWaalsContact O-CG2 3.25Å; P213-I216 WeakPolarHBondContact O-CG2 3.41Å; P213-L217 VanDerWaalsContact O-CB 3.29Å; P213-L217 WeakPolarHBondContact O-CB 3.23Å; P213-L217 PolarHBondContact O-N 3.15Å; P213-L235 HydrophobicContact CG-CD2 4.41Å
214	A	97.1	Very high	97.3	Very high	67 Å²	67	36.8 Å²	36.8	55%	0.554	21%	0.213	S	C	*	.	H	α-helix	trans	-69.5	-33.7	176.1	0	0	0	0	0	112.6	S212 C218	S212-A214 PolarHBondContact O-N 3.2Å; S212-A214 PolarHBondContact OG-N 3.39Å; A214-C218 PolarHBondContact O-N 3Å
215	G	97.5	Very high	97.3	Very high	2 Å²	2	35.5 Å²	35.5	2%	0.021	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-49.4	175.2	0	0	0	0	0	112.5	D186 S212 C218	D186-G215 VanDerWaalsContact CG-CA 3.46Å; D186-G215 WeakPolarHBondContact OD1-CA 3.3Å; S212-G215 WeakPolarHBondContact O-CA 3.34Å; S212-G215 PolarHBondContact O-N 2.94Å; S212-G215 PolarHBondContact OG-N 2.97Å; G215-C218 WeakPolarHBondContact O-CB 3.36Å; G215-C218 PolarHBondContact O-N 2.77Å
216	I	98.3	Very high	97.4	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-70.7	-34.7	178.7	-172.9	61.4	0	0	0	112.5	L203 M205 S212 P213 C218 V219 A220 L229 L231 L235 L240	L203-I216 HydrophobicContact CD2-CD1 4.24Å; M205-I216 HydrophobicContact SD-CD1 3.91Å; S212-I216 PolarHBondContact O-N 2.93Å; P213-I216 VanDerWaalsContact O-CG2 3.25Å; P213-I216 WeakPolarHBondContact O-CG2 3.41Å; I216-C218 VanDerWaalsContact C-N 3.27Å; I216-C218 PolarHBondContact O-N 2.98Å; I216-V219 HydrophobicContact CD1-CB 4.23Å; I216-V219 HydrophobicContact CD1-CG2 4.45Å; I216-V219 WeakPolarHBondContact O-CB 3.46Å; I216-V219 PolarHBondContact O-N 3.34Å; I216-A220 PolarHBondContact O-N 2.85Å; I216-L229 HydrophobicContact CD1-CD1 4.03Å; I216-L229 HydrophobicContact CD1-CD2 4.49Å; I216-L231 HydrophobicContact CD1-CD2 4.34Å; I216-L231 HydrophobicContact CG1-CD2 3.84Å; I216-L235 HydrophobicContact CG2-CB 4.16Å; I216-L240 HydrophobicContact CG1-CD1 4.15Å; I216-L240 HydrophobicContact CG1-CD2 4.19Å; I216-L240 HydrophobicContact CG2-CD2 4.14Å
217	L	98.4	Very high	97.6	Very high	41 Å²	41	39.3 Å²	39.3	22%	0.215	23%	0.227	C	C	.	.	H	α-helix	trans	-59	-41.6	175.8	-175.3	63.4	0	0	0	111.3	P213 V219 A220 D221 E239 A243	P213-L217 VanDerWaalsContact O-CB 3.29Å; P213-L217 WeakPolarHBondContact O-CB 3.23Å; P213-L217 PolarHBondContact O-N 3.15Å; L217-V219 PolarHBondContact O-N 3Å; L217-A220 PolarHBondContact O-N 3.21Å; L217-A220 VanDerWaalsContact O-N 3.15Å; L217-D221 WeakPolarHBondContact O-CB 3.19Å; L217-D221 PolarHBondContact O-N 3.06Å; L217-E239 HydrophobicContact CD1-CB 4.01Å; L217-E239 HydrophobicContact CD2-CB 3.97Å; L217-A243 HydrophobicContact CD1-CB 3.8Å
218	C	97.9	Very high	97.7	Very high	24 Å²	24	39.5 Å²	39.5	16%	0.162	22%	0.222	C	C	.	.	H	α-helix	trans	-57	-35.1	174.5	-176.2	0	0	0	0	113	A214 G215 I216 Q222	A214-C218 PolarHBondContact O-N 3Å; G215-C218 WeakPolarHBondContact O-CB 3.36Å; G215-C218 PolarHBondContact O-N 2.77Å; I216-C218 VanDerWaalsContact C-N 3.27Å; I216-C218 PolarHBondContact O-N 2.98Å; C218-Q222 PolarHBondContact SG-NE2 3.37Å; C218-Q222 VanDerWaalsContact SG-NE2 3.41Å
219	V	98.4	Very high	97.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-70.3	-49.8	175.4	-178.2	0	0	0	0	110.3	L189 V193 L200 L203 I216 L217 D221 Q222 C223	L189-V219 HydrophobicContact CB-CG2 4.1Å; L189-V219 HydrophobicContact CD1-CG2 4.19Å; L189-V219 HydrophobicContact CD2-CG2 4.48Å; V193-V219 HydrophobicContact CG2-CB 4.17Å; V193-V219 HydrophobicContact CG2-CG1 4.38Å; V193-V219 HydrophobicContact CG2-CG2 3.82Å; L200-V219 HydrophobicContact CD2-CG1 4.22Å; L203-V219 HydrophobicContact CD2-CG1 3.9Å; I216-V219 HydrophobicContact CD1-CB 4.23Å; I216-V219 HydrophobicContact CD1-CG2 4.45Å; I216-V219 WeakPolarHBondContact O-CB 3.46Å; I216-V219 PolarHBondContact O-N 3.34Å; L217-V219 PolarHBondContact O-N 3Å; V219-D221 VanDerWaalsContact C-N 3.3Å; V219-D221 PolarHBondContact O-N 3.49Å; V219-Q222 PolarHBondContact O-N 3.29Å; V219-C223 HydrophobicContact CG1-CB 4.22Å; V219-C223 WeakPolarHBondContact O-CB 3.49Å; V219-C223 PolarHBondContact O-N 2.9Å; V219-C223 PolarHBondContact O-SG 3.15Å
220	A	98.1	Very high	98.1	Very high	1 Å²	1	36 Å²	36	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-61.8	-36.5	-179.4	0	0	0	0	0	112.8	I216 L217 Q222 L240 A243 L244	I216-A220 PolarHBondContact O-N 2.85Å; L217-A220 PolarHBondContact O-N 3.21Å; L217-A220 VanDerWaalsContact O-N 3.15Å; A220-Q222 VanDerWaalsContact C-N 3.32Å; A220-Q222 PolarHBondContact O-N 3.26Å; A220-L240 HydrophobicContact CB-CD1 3.52Å; A220-A243 HydrophobicContact CB-CB 4.06Å; A220-L244 HydrophobicContact CB-CD2 3.93Å; A220-L244 HydrophobicContact CB-CG 4.2Å
221	D	97.3	Very high	98.1	Very high	85 Å²	85	31.6 Å²	31.6	46%	0.455	18%	0.179	S	C	.	.	H	α-helix	trans	-69.4	-26	-179.9	-81.7	-21.6	0	0	0	114	L217 V219 H224 A243	L217-D221 WeakPolarHBondContact O-CB 3.19Å; L217-D221 PolarHBondContact O-N 3.06Å; V219-D221 VanDerWaalsContact C-N 3.3Å; V219-D221 PolarHBondContact O-N 3.49Å; D221-H224 PolarHBondContact O-NE2 3.02Å; D221-A243 WeakPolarHBondContact OD1-CB 3.49Å
222	Q	97.8	Very high	98.1	Very high	93 Å²	93	31.7 Å²	31.7	44%	0.435	18%	0.18	S	C	.	.	H	α-helix	trans	-113.6	-32.9	-172.6	-66.9	-170.7	64.5	0	0	113.3	V193 C218 V219 A220 H224	V193-Q222 HydrophobicContact CG1-CB 3.36Å; V193-Q222 HydrophobicContact CG1-CG 3.9Å; C218-Q222 PolarHBondContact SG-NE2 3.37Å; C218-Q222 VanDerWaalsContact SG-NE2 3.41Å; V219-Q222 PolarHBondContact O-N 3.29Å; A220-Q222 VanDerWaalsContact C-N 3.32Å; A220-Q222 PolarHBondContact O-N 3.26Å; Q222-H224 VanDerWaalsContact C-N 3.28Å; Q222-H224 PolarHBondContact O-N 3.06Å; Q222-H224 PolarHBondContact O-ND1 3.24Å
223	C	98	Very high	98.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.169	C	C	.	.			trans	-85.6	65.4	-179.9	-60.7	0	0	0	0	111	L200 V219 G225 L226	L200-C223 HydrophobicContact CD2-CB 4.38Å; V219-C223 HydrophobicContact CG1-CB 4.22Å; V219-C223 WeakPolarHBondContact O-CB 3.49Å; V219-C223 PolarHBondContact O-N 2.9Å; V219-C223 PolarHBondContact O-SG 3.15Å; C223-G225 PolarHBondContact O-N 3.36Å; C223-L226 VanDerWaalsContact O-CB 3.29Å; C223-L226 WeakPolarHBondContact O-CB 3.45Å; C223-L226 PolarHBondContact O-N 3.04Å
224	H	98.1	Very high	97.9	Very high	71 Å²	71	31.5 Å²	31.5	33%	0.329	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-15.7	-176.4	-53.4	119.9	0	0	0	114.7	D221 Q222 V250	D221-H224 PolarHBondContact O-NE2 3.02Å; Q222-H224 VanDerWaalsContact C-N 3.28Å; Q222-H224 PolarHBondContact O-N 3.06Å; Q222-H224 PolarHBondContact O-ND1 3.24Å; H224-V250 WeakPolarHBondContact O-CB 3.34Å; H224-V250 WeakPolarHBondContact O-CG1 3.4Å; H224-V250 PolarHBondContact O-N 3.04Å
225	G	98.4	Very high	98	Very high	25 Å²	25	28.3 Å²	28.3	26%	0.258	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-0.5	176.5	0	0	0	0	0	115.1	L200 C223 R227	L200-G225 CarbonylContact O-C 3.54Å; L200-G225 VanDerWaalsContact O-C 3.26Å; C223-G225 PolarHBondContact O-N 3.36Å; G225-R227 PolarHBondContact O-N 3.44Å
226	L	98.7	Very high	98	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	14%	0.142	C	C	.	.			trans	-65.2	126.1	-176.2	-167.4	71.2	0	0	0	111.1	L200 L203 C223 L229 L244 H249 V250 L252	L200-L226 HydrophobicContact CD2-CD1 4.41Å; L200-L226 HydrophobicContact CG-CD1 4.31Å; L200-L226 PolarHBondContact O-N 3.2Å; L203-L226 HydrophobicContact CB-CD1 4.06Å; C223-L226 VanDerWaalsContact O-CB 3.29Å; C223-L226 WeakPolarHBondContact O-CB 3.45Å; C223-L226 PolarHBondContact O-N 3.04Å; L226-L229 HydrophobicContact CD2-CB 4.23Å; L226-L229 HydrophobicContact CD2-CD1 4.45Å; L226-L229 HydrophobicContact CD2-CD2 4.36Å; L226-L244 HydrophobicContact CD2-CD2 4.28Å; L226-H249 PolarHBondContact O-CE1 2.71Å; L226-V250 WeakPolarHBondContact O-CG1 3.39Å; L226-L252 VanDerWaalsContact O-CD1 3.28Å; L226-L252 WeakPolarHBondContact O-CD1 3.33Å
227	R	98.8	Very high	98	Very high	87 Å²	87	29 Å²	29	33%	0.328	15%	0.147	S	C	.	.			trans	-115.2	-29.8	-178.6	-69.2	172.9	-176.9	-88.2	-5.5	112.4	K201 G225 V250 L252 E253 H254	K201-R227 PolarHBondContact O-N 3.44Å; G225-R227 PolarHBondContact O-N 3.44Å; R227-V250 HydrophobicContact CG-CG1 3.95Å; R227-L252 WeakPolarHBondContact O-CG 3.39Å; R227-E253 HydrophobicContact CB-CB 4.5Å; R227-E253 HydrophobicContact CB-CG 4.34Å; R227-E253 WeakPolarHBondContact CD-OE1 3.45Å; R227-E253 IonicContact CZ-OE1 2.96Å; R227-E253 IonicContact NE-OE1 2.87Å; R227-E253 IonicContact NH1-OE1 3.8Å; R227-E253 PolarHBondContact NH1-OE1 2.94Å; R227-E253 PolarHBondContact O-N 3.27Å; R227-H254 PolarHBondContact O-N 3.38Å; R227-H254 VanDerWaalsContact O-N 3.09Å
228	E	98.8	Very high	98	Very high	55 Å²	55	28.5 Å²	28.5	26%	0.257	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	129.1	-178.8	-56.9	-166.6	-148.1	0	0	111	K201 L202 L203 H254	K201-E228 PolarHBondContact O-N 3.29Å; L202-E228 WeakPolarHBondContact CA-O 3.45Å; L202-E228 HydrophobicContact CB-CB 4.2Å; L202-E228 HydrophobicContact CD1-CB 4.38Å; L202-E228 HydrophobicContact CG-CB 3.96Å; L203-E228 PolarHBondContact N-O 3.09Å; E228-H254 VanDerWaalsContact CA-O 3.27Å; E228-H254 WeakPolarHBondContact CA-O 3.38Å; E228-H254 HydrophobicContact CB-CB 4.13Å; E228-H254 HydrophobicContact CG-CB 3.76Å; E228-H254 IonicContact OE2-ND1 3.85Å; E228-H254 PolarHBondContact OE2-ND1 2.95Å
229	L	98.9	Very high	98	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.016	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	132.1	176.9	-178.6	58.9	0	0	0	110.5	L203 I216 L226 L231 L244 H254 L255 R256	L203-L229 HydrophobicContact CB-CD1 4.1Å; L203-L229 HydrophobicContact CD2-CD1 4.19Å; L203-L229 HydrophobicContact CG-CD1 4.2Å; L203-L229 CarbonylContact O-C 3.43Å; L203-L229 VanDerWaalsContact O-CA 3.3Å; L203-L229 WeakPolarHBondContact O-CA 3.34Å; I216-L229 HydrophobicContact CD1-CD1 4.03Å; I216-L229 HydrophobicContact CD1-CD2 4.49Å; L226-L229 HydrophobicContact CD2-CB 4.23Å; L226-L229 HydrophobicContact CD2-CD1 4.45Å; L226-L229 HydrophobicContact CD2-CD2 4.36Å; L229-L231 HydrophobicContact CD1-CD2 4.14Å; L229-L231 HydrophobicContact CD2-CD2 3.65Å; L229-L231 HydrophobicContact CG-CD2 3.84Å; L229-L231 HydrophobicContact CG-CG 4.35Å; L229-L244 HydrophobicContact CD2-CD1 4.17Å; L229-H254 PolarHBondContact N-O 2.96Å; L229-L255 HydrophobicContact CB-CD1 4.01Å; L229-L255 HydrophobicContact CD2-CD1 4.21Å; L229-L255 HydrophobicContact CG-CD1 4.18Å; L229-L255 CarbonylContact O-C 3.3Å; L229-L255 WeakPolarHBondContact O-CA 3.25Å; L229-R256 PolarHBondContact O-N 2.88Å
230	A	98.8	Very high	98.1	Very high	3 Å²	3	32.7 Å²	32.7	3%	0.025	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	129	169.6	0	0	0	0	0	110.8	L203 K204 M205 R256	L203-A230 PolarHBondContact O-N 2.66Å; K204-A230 HydrophobicContact CB-CB 4.09Å; K204-A230 HydrophobicContact CD-CB 4.43Å; K204-A230 HydrophobicContact CG-CB 3.83Å; M205-A230 PolarHBondContact N-O 3.33Å; A230-R256 WeakPolarHBondContact CA-O 3.24Å; A230-R256 HydrophobicContact CB-CB 3.83Å; A230-R256 HydrophobicContact CB-CG 4.26Å
231	L	98.2	Very high	98.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	170	-177	53.4	78.4	0	0	0	112	I216 L229 L235 L236 L240 R256 I257 D258	I216-L231 HydrophobicContact CD1-CD2 4.34Å; I216-L231 HydrophobicContact CG1-CD2 3.84Å; L229-L231 HydrophobicContact CD1-CD2 4.14Å; L229-L231 HydrophobicContact CD2-CD2 3.65Å; L229-L231 HydrophobicContact CG-CD2 3.84Å; L229-L231 HydrophobicContact CG-CG 4.35Å; L231-L235 HydrophobicContact CB-CD1 4.39Å; L231-L235 HydrophobicContact CD1-CB 4.31Å; L231-L236 HydrophobicContact CD1-CB 4.31Å; L231-L240 HydrophobicContact CD2-CD2 3.85Å; L231-R256 PolarHBondContact N-O 2.79Å; L231-R256 VanDerWaalsContact N-O 3.15Å; L231-I257 HydrophobicContact CD1-CD1 3.52Å; L231-I257 HydrophobicContact CG-CD1 4.28Å; L231-I257 WeakPolarHBondContact O-CA 3.39Å; L231-D258 PolarHBondContact O-N 2.97Å
232	N	97.6	Very high	98.1	Very high	10 Å²	10	32.8 Å²	32.8	5%	0.053	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	151.8	172	-61.7	109.8	0	0	0	112.8	S207 H234 L235 D258	S207-N232 VanDerWaalsContact CA-OD1 3.32Å; S207-N232 WeakPolarHBondContact CA-OD1 3.46Å; S207-N232 PolarHBondContact N-OD1 2.81Å; N232-H234 VanDerWaalsContact CB-CE1 3.45Å; N232-H234 WeakPolarHBondContact CB-CE1 3.39Å; N232-H234 VanDerWaalsContact CB-ND1 3.31Å; N232-H234 WeakPolarHBondContact CB-ND1 3.22Å; N232-H234 PolarHBondContact O-N 2.72Å; N232-H234 VanDerWaalsContact O-N 3.14Å; N232-L235 PolarHBondContact O-N 2.75Å; N232-D258 CarbonylContact C-O 3.59Å; N232-D258 VanDerWaalsContact CA-O 3.28Å; N232-D258 WeakPolarHBondContact CA-O 3.25Å
233	Y	97.4	Very high	98.2	Very high	9 Å²	9	28.8 Å²	28.8	4%	0.035	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-55.3	-33.9	179.6	-172.9	-96.4	0	0	0	114.2	L235 L236 I257 D258 V259 F269 H270 F303	Y233-L235 PolarHBondContact O-N 2.94Å; Y233-L235 VanDerWaalsContact O-N 3.09Å; Y233-L236 HydrophobicContact CD2-CD2 3.95Å; Y233-L236 HydrophobicContact CE2-CD2 3.88Å; Y233-L236 WeakPolarHBondContact O-CB 3.49Å; Y233-L236 PolarHBondContact O-N 3.05Å; Y233-I257 HydrophobicContact CD2-CG2 3.88Å; Y233-I257 HydrophobicContact CG-CG2 4.42Å; Y233-D258 PolarHBondContact N-O 2.6Å; Y233-V259 HydrophobicContact CD2-CG2 4.2Å; Y233-V259 HydrophobicContact CG-CG1 4.12Å; Y233-V259 HydrophobicContact CG-CG2 4.33Å; Y233-F269 HydrophobicContact CD1-CB 4.45Å; Y233-F269 AromaticContact CD1-CD1 3.72Å; Y233-F269 HydrophobicContact CD1-CD1 3.72Å; Y233-F269 HydrophobicContact CE1-CB 4.02Å; Y233-F269 HydrophobicContact CE1-CD1 4.15Å; Y233-H270 AromaticContact CD1-CE1 3.7Å; Y233-H270 AromaticContact CE1-CE1 3.45Å; Y233-H270 VanDerWaalsContact CE1-CE1 3.45Å; Y233-H270 WeakPolarHBondContact CE1-CE1 3.31Å; Y233-H270 AromaticContact CE1-ND1 3.62Å; Y233-H270 AromaticContact CE1-NE2 3.95Å; Y233-H270 WeakPolarHBondContact CE1-O 3.29Å; Y233-H270 PolarHBondContact O-CE1 2.88Å; Y233-H270 VanDerWaalsContact O-CE1 3.29Å; Y233-H270 PolarHBondContact OH-O 2.82Å; Y233-F303 HydrophobicContact CD1-CZ 4.29Å; Y233-F303 HydrophobicContact CD2-CE1 4.02Å; Y233-F303 HydrophobicContact CD2-CZ 4.48Å; Y233-F303 HydrophobicContact CE1-CE1 4.11Å; Y233-F303 AromaticContact CE1-CZ 3.98Å; Y233-F303 HydrophobicContact CE1-CZ 3.98Å; Y233-F303 AromaticContact CE2-CE1 3.55Å; Y233-F303 HydrophobicContact CE2-CE1 3.55Å; Y233-F303 HydrophobicContact CE2-CZ 4.22Å; Y233-F303 HydrophobicContact CG-CE1 4.49Å; Y233-F303 AromaticContact CZ-CE1 3.58Å; Y233-F303 AromaticContact CZ-CZ 3.94Å
234	H	94.5	Very high	98.2	Very high	83 Å²	83	28.8 Å²	28.8	38%	0.384	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-62.4	-17.9	179.4	72.1	-98.9	0	0	0	113.7	N232	N232-H234 VanDerWaalsContact CB-CE1 3.45Å; N232-H234 WeakPolarHBondContact CB-CE1 3.39Å; N232-H234 VanDerWaalsContact CB-ND1 3.31Å; N232-H234 WeakPolarHBondContact CB-ND1 3.22Å; N232-H234 PolarHBondContact O-N 2.72Å; N232-H234 VanDerWaalsContact O-N 3.14Å
235	L	97.4	Very high	98.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-93.9	-14.3	174.1	-58.8	-179.7	0	0	0	113.3	V211 P213 I216 L231 N232 Y233	V211-L235 HydrophobicContact CB-CD1 4.45Å; V211-L235 HydrophobicContact CG1-CD1 4.22Å; V211-L235 HydrophobicContact CG1-CD2 4.45Å; V211-L235 VanDerWaalsContact O-CD2 3.32Å; V211-L235 WeakPolarHBondContact O-CD2 3.39Å; P213-L235 HydrophobicContact CG-CD2 4.41Å; I216-L235 HydrophobicContact CG2-CB 4.16Å; L231-L235 HydrophobicContact CB-CD1 4.39Å; L231-L235 HydrophobicContact CD1-CB 4.31Å; N232-L235 PolarHBondContact O-N 2.75Å; Y233-L235 PolarHBondContact O-N 2.94Å; Y233-L235 VanDerWaalsContact O-N 3.09Å
236	L	98.2	Very high	98.2	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.01	14%	0.137	C	C	.	.			trans	-73.5	127.3	177.9	-177.1	65.6	0	0	0	109.3	L231 Y233 L240 L241 I257 H270 I272 W277	L231-L236 HydrophobicContact CD1-CB 4.31Å; Y233-L236 HydrophobicContact CD2-CD2 3.95Å; Y233-L236 HydrophobicContact CE2-CD2 3.88Å; Y233-L236 WeakPolarHBondContact O-CB 3.49Å; Y233-L236 PolarHBondContact O-N 3.05Å; L236-L240 HydrophobicContact CD1-CD2 4.34Å; L236-L241 HydrophobicContact CD1-CD2 3.94Å; L236-L241 HydrophobicContact CD1-CG 3.98Å; L236-I257 HydrophobicContact CD1-CD1 4.07Å; L236-I257 HydrophobicContact CD2-CD1 4.14Å; L236-I257 HydrophobicContact CD2-CG1 4.31Å; L236-I257 HydrophobicContact CD2-CG2 4.4Å; L236-I257 HydrophobicContact CG-CD1 4.48Å; L236-H270 PolarHBondContact O-CE1 3.1Å; L236-H270 PolarHBondContact O-NE2 3.14Å; L236-I272 HydrophobicContact CD2-CD1 4.46Å; L236-I272 HydrophobicContact CD2-CG1 4.1Å; L236-I272 HydrophobicContact CG-CD1 4.08Å; L236-I272 HydrophobicContact CG-CG1 4.25Å; L236-W277 HydrophobicContact CD2-CH2 3.96Å; L236-W277 HydrophobicContact CD2-CZ2 3.97Å
237	S	98.3	Very high	98.1	Very high	17 Å²	17	36.6 Å²	36.6	12%	0.119	18%	0.181	C	C	.	.			trans	-138.7	168.2	175.8	84.7	0	0	0	0	111.7	E239 L240 L241	S237-E239 VanDerWaalsContact C-N 3.3Å; S237-E239 VanDerWaalsContact CB-OE2 3.22Å; S237-E239 WeakPolarHBondContact CB-OE2 3.36Å; S237-E239 PolarHBondContact OG-N 3.14Å; S237-E239 PolarHBondContact OG-OE2 2.87Å; S237-L240 PolarHBondContact O-N 3.44Å; S237-L240 PolarHBondContact OG-N 3.45Å; S237-L240 VanDerWaalsContact OG-N 3.14Å; S237-L241 PolarHBondContact O-N 2.77Å; S237-L241 VanDerWaalsContact O-N 3.08Å
238	D	98.7	Very high	98	Very high	30 Å²	30	40.2 Å²	40.2	16%	0.16	20%	0.2	C	C	.	.	H	α-helix	trans	-59.5	-43.8	172.8	-72.5	-60.4	0	0	0	110.9	L240 L241 L242 I272 Q273 S276	D238-L240 VanDerWaalsContact C-N 3.31Å; D238-L240 PolarHBondContact O-N 2.8Å; D238-L241 PolarHBondContact O-N 3.06Å; D238-L242 WeakPolarHBondContact O-CB 3.35Å; D238-L242 WeakPolarHBondContact O-CG 3.19Å; D238-L242 PolarHBondContact O-N 2.82Å; D238-I272 WeakPolarHBondContact OD1-CG2 3.21Å; D238-Q273 WeakPolarHBondContact OD1-CB 3.42Å; D238-Q273 PolarHBondContact OD1-N 3.44Å; D238-S276 WeakPolarHBondContact OD1-CB 3.28Å; D238-S276 PolarHBondContact OD1-OG 2.9Å
239	E	98.6	Very high	98	Very high	111 Å²	111	37.9 Å²	37.9	52%	0.519	19%	0.188	S	C	.	.	H	α-helix	trans	-60.2	-41.6	177.2	-57.5	73.6	-160.6	0	0	111.4	L217 S237 L242 A243	L217-E239 HydrophobicContact CD1-CB 4.01Å; L217-E239 HydrophobicContact CD2-CB 3.97Å; S237-E239 VanDerWaalsContact C-N 3.3Å; S237-E239 VanDerWaalsContact CB-OE2 3.22Å; S237-E239 WeakPolarHBondContact CB-OE2 3.36Å; S237-E239 PolarHBondContact OG-N 3.14Å; S237-E239 PolarHBondContact OG-OE2 2.87Å; E239-L242 PolarHBondContact O-N 3.06Å; E239-A243 WeakPolarHBondContact O-CB 3.39Å; E239-A243 PolarHBondContact O-N 3.22Å
240	L	98.8	Very high	98	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-64.1	-47.7	178.2	-179.9	61.1	0	0	0	111.5	I216 A220 L231 L236 S237 D238 L242 A243 L244	I216-L240 HydrophobicContact CG1-CD1 4.15Å; I216-L240 HydrophobicContact CG1-CD2 4.19Å; I216-L240 HydrophobicContact CG2-CD2 4.14Å; A220-L240 HydrophobicContact CB-CD1 3.52Å; L231-L240 HydrophobicContact CD2-CD2 3.85Å; L236-L240 HydrophobicContact CD1-CD2 4.34Å; S237-L240 PolarHBondContact O-N 3.44Å; S237-L240 PolarHBondContact OG-N 3.45Å; S237-L240 VanDerWaalsContact OG-N 3.14Å; D238-L240 VanDerWaalsContact C-N 3.31Å; D238-L240 PolarHBondContact O-N 2.8Å; L240-L242 VanDerWaalsContact C-N 3.3Å; L240-L242 PolarHBondContact O-N 2.81Å; L240-A243 PolarHBondContact O-N 2.82Å; L240-L244 HydrophobicContact CD1-CD1 4.26Å; L240-L244 HydrophobicContact CD1-CG 4.37Å; L240-L244 HydrophobicContact CG-CD1 4.15Å; L240-L244 VanDerWaalsContact O-CG 3.29Å; L240-L244 WeakPolarHBondContact O-CG 3.35Å; L240-L244 PolarHBondContact O-N 3.5Å
241	L	98.6	Very high	98	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.2	-40	177.4	-74.8	-177.6	0	0	0	111.6	L236 S237 D238 L244 S245 L255 I272 W277 F280	L236-L241 HydrophobicContact CD1-CD2 3.94Å; L236-L241 HydrophobicContact CD1-CG 3.98Å; S237-L241 PolarHBondContact O-N 2.77Å; S237-L241 VanDerWaalsContact O-N 3.08Å; D238-L241 PolarHBondContact O-N 3.06Å; L241-L244 PolarHBondContact O-N 3.44Å; L241-S245 VanDerWaalsContact O-CB 3.31Å; L241-S245 WeakPolarHBondContact O-CB 2.96Å; L241-S245 PolarHBondContact O-N 3.37Å; L241-S245 PolarHBondContact O-OG 3.46Å; L241-L255 HydrophobicContact CD2-CD2 4.06Å; L241-I272 HydrophobicContact CD1-CG2 3.6Å; L241-W277 HydrophobicContact CD1-CD2 3.84Å; L241-W277 HydrophobicContact CD1-CE3 3.78Å; L241-W277 HydrophobicContact CD1-CG 4.44Å; L241-W277 HydrophobicContact CD1-CH2 4.14Å; L241-W277 HydrophobicContact CD1-CZ2 4.2Å; L241-W277 HydrophobicContact CD1-CZ3 3.92Å; L241-W277 HydrophobicContact CD2-CE3 4.47Å; L241-W277 HydrophobicContact CD2-CZ3 4.06Å; L241-F280 HydrophobicContact CD2-CB 4.46Å; L241-F280 HydrophobicContact CD2-CD2 4.14Å; L241-F280 HydrophobicContact CD2-CG 4.16Å
242	L	98.7	Very high	98	Very high	88 Å²	88	47.4 Å²	47.4	46%	0.461	23%	0.228	S	C	.	.	H	α-helix	trans	-67.1	-39.9	177.4	-68.4	172.2	0	0	0	112.1	D238 E239 L240 S245 S246 A279	D238-L242 WeakPolarHBondContact O-CB 3.35Å; D238-L242 WeakPolarHBondContact O-CG 3.19Å; D238-L242 PolarHBondContact O-N 2.82Å; E239-L242 PolarHBondContact O-N 3.06Å; L240-L242 VanDerWaalsContact C-N 3.3Å; L240-L242 PolarHBondContact O-N 2.81Å; L242-S245 CarbonylContact O-C 3.57Å; L242-S245 WeakPolarHBondContact O-CA 3.31Å; L242-S245 PolarHBondContact O-N 3.07Å; L242-S246 PolarHBondContact O-N 2.9Å; L242-S246 VanDerWaalsContact O-N 3.12Å; L242-A279 HydrophobicContact CD2-CB 3.95Å
243	A	98.6	Very high	98	Very high	8 Å²	8	51.1 Å²	51.1	7%	0.066	25%	0.245	C	C	.	.	H	α-helix	trans	-60.2	-46.8	174.6	0	0	0	0	0	111.7	L217 A220 D221 E239 L240 S245 S246	L217-A243 HydrophobicContact CD1-CB 3.8Å; A220-A243 HydrophobicContact CB-CB 4.06Å; D221-A243 WeakPolarHBondContact OD1-CB 3.49Å; E239-A243 WeakPolarHBondContact O-CB 3.39Å; E239-A243 PolarHBondContact O-N 3.22Å; L240-A243 PolarHBondContact O-N 2.82Å; A243-S245 PolarHBondContact O-N 2.88Å; A243-S246 WeakPolarHBondContact O-CB 3.29Å; A243-S246 PolarHBondContact O-N 2.88Å; A243-S246 VanDerWaalsContact O-N 3.17Å; A243-S246 PolarHBondContact O-OG 3.45Å
244	L	98.6	Very high	98.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-65.4	-18.1	174.5	-66.1	171.4	0	0	0	113.3	A220 L226 L229 L240 L241 H249 L252 H283	A220-L244 HydrophobicContact CB-CD2 3.93Å; A220-L244 HydrophobicContact CB-CG 4.2Å; L226-L244 HydrophobicContact CD2-CD2 4.28Å; L229-L244 HydrophobicContact CD2-CD1 4.17Å; L240-L244 HydrophobicContact CD1-CD1 4.26Å; L240-L244 HydrophobicContact CD1-CG 4.37Å; L240-L244 HydrophobicContact CG-CD1 4.15Å; L240-L244 VanDerWaalsContact O-CG 3.29Å; L240-L244 WeakPolarHBondContact O-CG 3.35Å; L240-L244 PolarHBondContact O-N 3.5Å; L241-L244 PolarHBondContact O-N 3.44Å; L244-H249 WeakPolarHBondContact CD2-NE2 3.32Å; L244-L252 HydrophobicContact CD1-CD2 4.33Å; L244-L252 HydrophobicContact CD2-CD1 4.26Å; L244-H283 PolarHBondContact O-CD2 3Å
245	S	98.6	Very high	98.3	Very high	21 Å²	21	49 Å²	49	15%	0.147	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	4	178.5	-52.7	0	0	0	0	113.6	L241 L242 A243 F280	L241-S245 VanDerWaalsContact O-CB 3.31Å; L241-S245 WeakPolarHBondContact O-CB 2.96Å; L241-S245 PolarHBondContact O-N 3.37Å; L241-S245 PolarHBondContact O-OG 3.46Å; L242-S245 CarbonylContact O-C 3.57Å; L242-S245 WeakPolarHBondContact O-CA 3.31Å; L242-S245 PolarHBondContact O-N 3.07Å; A243-S245 PolarHBondContact O-N 2.88Å; S245-F280 WeakPolarHBondContact OG-CA 3.3Å; S245-F280 PolarHBondContact OG-N 3.22Å
246	S	97.9	Very high	98.4	Very high	42 Å²	42	52.4 Å²	52.4	29%	0.294	25%	0.248	S	C	.	.	S	Bend	trans	-71	152.5	-178.7	71.5	0	0	0	0	111.7	L242 A243 K248 H249 H283	L242-S246 PolarHBondContact O-N 2.9Å; L242-S246 VanDerWaalsContact O-N 3.12Å; A243-S246 WeakPolarHBondContact O-CB 3.29Å; A243-S246 PolarHBondContact O-N 2.88Å; A243-S246 VanDerWaalsContact O-N 3.17Å; A243-S246 PolarHBondContact O-OG 3.45Å; S246-K248 PolarHBondContact O-N 2.96Å; S246-K248 VanDerWaalsContact O-N 3.13Å; S246-H249 WeakPolarHBondContact O-CB 3.46Å; S246-H249 PolarHBondContact O-N 2.75Å; S246-H283 PolarHBondContact O-CE1 3.34Å; S246-H283 VanDerWaalsContact O-CE1 3.25Å
247	E	96.9	Very high	98.4	Very high	198 Å²	198	52.3 Å²	52.3	93%	0.925	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-26.2	-179	-64.3	-173	164.1	0	0	113.7	H249	E247-H249 VanDerWaalsContact C-N 3.33Å
248	K	96.7	Very high	98.4	Very high	164 Å²	164	52 Å²	52	71%	0.713	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-28.7	177.2	-64.5	-179	-178.1	175.7	0	112.1	S246	S246-K248 PolarHBondContact O-N 2.96Å; S246-K248 VanDerWaalsContact O-N 3.13Å
249	H	98.3	Very high	98.3	Very high	5 Å²	5	50.6 Å²	50.6	2%	0.023	24%	0.237	C	C	.	.	S	Bend	trans	-77.9	140.7	-173.2	-159	-76.8	0	0	0	110.7	L226 L244 S246 E247 H283	L226-H249 PolarHBondContact O-CE1 2.71Å; L244-H249 WeakPolarHBondContact CD2-NE2 3.32Å; S246-H249 WeakPolarHBondContact O-CB 3.46Å; S246-H249 PolarHBondContact O-N 2.75Å; E247-H249 VanDerWaalsContact C-N 3.33Å; H249-H283 PolarHBondContact O-CE1 3.35Å; H249-H283 PolarHBondContact O-NE2 2.99Å
250	V	98.4	Very high	98.1	Very high	37 Å²	37	48 Å²	48	22%	0.224	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-63.7	158.8	172.2	72.6	0	0	0	0	110.6	H224 L226 R227 L252 H283	H224-V250 WeakPolarHBondContact O-CB 3.34Å; H224-V250 WeakPolarHBondContact O-CG1 3.4Å; H224-V250 PolarHBondContact O-N 3.04Å; L226-V250 WeakPolarHBondContact O-CG1 3.39Å; R227-V250 HydrophobicContact CG-CG1 3.95Å; V250-L252 PolarHBondContact O-N 2.97Å; V250-H283 PolarHBondContact O-NE2 3.32Å
251	R	98.4	Very high	97.6	Very high	166 Å²	166	48.2 Å²	48.2	63%	0.626	23%	0.23	S	C	*	.	P	Polyproline II helix	trans	-64.1	124.5	171.7	-68	-173.1	173.9	103.9	1.5	109.8	H283 S284	R251-H283 PolarHBondContact NE-O 3.33Å; R251-S284 WeakPolarHBondContact CA-OG 3.41Å
252	L	98.6	Very high	96.6	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.021	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-72	138	177.2	-141.7	73.1	0	0	0	109.7	L226 R227 L244 V250 L255 F280 S284 V287	L226-L252 VanDerWaalsContact O-CD1 3.28Å; L226-L252 WeakPolarHBondContact O-CD1 3.33Å; R227-L252 WeakPolarHBondContact O-CG 3.39Å; L244-L252 HydrophobicContact CD1-CD2 4.33Å; L244-L252 HydrophobicContact CD2-CD1 4.26Å; V250-L252 PolarHBondContact O-N 2.97Å; L252-L255 HydrophobicContact CD2-CB 3.99Å; L252-F280 HydrophobicContact CB-CE2 4.26Å; L252-F280 HydrophobicContact CD2-CE2 3.69Å; L252-F280 HydrophobicContact CD2-CZ 3.82Å; L252-S284 PolarHBondContact N-OG 3.38Å; L252-V287 HydrophobicContact CB-CG2 4.08Å; L252-V287 WeakPolarHBondContact O-CB 3.39Å
253	E	98.7	Very high	95.5	Very high	88 Å²	88	55.2 Å²	55.2	41%	0.411	26%	0.263	S	S	.	.	S	Bend	trans	-101.6	-36.3	-179.5	-65.8	174.6	-163.8	0	0	110.4	R227 N288	R227-E253 HydrophobicContact CB-CB 4.5Å; R227-E253 HydrophobicContact CB-CG 4.34Å; R227-E253 WeakPolarHBondContact CD-OE1 3.45Å; R227-E253 IonicContact CZ-OE1 2.96Å; R227-E253 IonicContact NE-OE1 2.87Å; R227-E253 IonicContact NH1-OE1 3.8Å; R227-E253 PolarHBondContact NH1-OE1 2.94Å; R227-E253 PolarHBondContact O-N 3.27Å; E253-N288 PolarHBondContact O-N 3.08Å; E253-N288 PolarHBondContact O-ND2 3.22Å
254	H	98.8	Very high	94	Very high	46 Å²	46	58.3 Å²	58.3	21%	0.213	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	125.3	-176.4	-166.6	-173.7	0	0	0	111.7	R227 E228 L229 N288 V290	R227-H254 PolarHBondContact O-N 3.38Å; R227-H254 VanDerWaalsContact O-N 3.09Å; E228-H254 VanDerWaalsContact CA-O 3.27Å; E228-H254 WeakPolarHBondContact CA-O 3.38Å; E228-H254 HydrophobicContact CB-CB 4.13Å; E228-H254 HydrophobicContact CG-CB 3.76Å; E228-H254 IonicContact OE2-ND1 3.85Å; E228-H254 PolarHBondContact OE2-ND1 2.95Å; L229-H254 PolarHBondContact N-O 2.96Å; H254-N288 WeakPolarHBondContact CA-O 3.35Å; H254-V290 WeakPolarHBondContact NE2-CG2 3.5Å
255	L	98.8	Very high	92.5	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	118.9	166.6	-179.9	59.2	0	0	0	108.3	L229 L241 L252 I257 F280 N288 L289 V290	L229-L255 HydrophobicContact CB-CD1 4.01Å; L229-L255 HydrophobicContact CD2-CD1 4.21Å; L229-L255 HydrophobicContact CG-CD1 4.18Å; L229-L255 CarbonylContact O-C 3.3Å; L229-L255 WeakPolarHBondContact O-CA 3.25Å; L241-L255 HydrophobicContact CD2-CD2 4.06Å; L252-L255 HydrophobicContact CD2-CB 3.99Å; L255-I257 HydrophobicContact CD1-CD1 3.81Å; L255-I257 HydrophobicContact CD2-CD1 4.25Å; L255-I257 HydrophobicContact CG-CD1 3.88Å; L255-I257 HydrophobicContact CG-CG1 4.18Å; L255-F280 HydrophobicContact CB-CZ 4.06Å; L255-F280 HydrophobicContact CD2-CE1 4.09Å; L255-F280 HydrophobicContact CD2-CE2 4.28Å; L255-F280 HydrophobicContact CD2-CZ 3.69Å; L255-N288 PolarHBondContact N-O 3.17Å; L255-L289 HydrophobicContact CB-CD1 4.19Å; L255-L289 HydrophobicContact CD2-CD1 4.03Å; L255-L289 HydrophobicContact CG-CD1 4.02Å; L255-L289 WeakPolarHBondContact O-CA 3.5Å; L255-V290 PolarHBondContact O-N 2.9Å
256	R	98.8	Very high	91.1	Very high	72 Å²	72	67.5 Å²	67.5	27%	0.272	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	130.7	173.2	173.5	176	169.2	161.3	-9	110.2	L229 A230 L231 D258 V290 Y292	L229-R256 PolarHBondContact O-N 2.88Å; A230-R256 WeakPolarHBondContact CA-O 3.24Å; A230-R256 HydrophobicContact CB-CB 3.83Å; A230-R256 HydrophobicContact CB-CG 4.26Å; L231-R256 PolarHBondContact N-O 2.79Å; L231-R256 VanDerWaalsContact N-O 3.15Å; R256-D258 IonicContact CZ-OD1 3.06Å; R256-D258 IonicContact CZ-OD2 2.7Å; R256-D258 IonicContact NE-OD1 3.97Å; R256-D258 PolarHBondContact NE-OD1 3.04Å; R256-D258 IonicContact NE-OD2 3.68Å; R256-D258 PolarHBondContact NE-OD2 3.36Å; R256-D258 IonicContact NH2-OD1 2.67Å; R256-D258 PolarHBondContact NH2-OD1 2.75Å; R256-D258 IonicContact NH2-OD2 3.42Å; R256-V290 CarbonylContact C-O 3.6Å; R256-V290 VanDerWaalsContact CA-O 3.3Å; R256-V290 WeakPolarHBondContact CA-O 3.46Å; R256-V290 HydrophobicContact CB-CB 4.29Å; R256-V290 HydrophobicContact CG-CB 4.43Å; R256-V290 HydrophobicContact CG-CG1 4.41Å; R256-Y292 VanDerWaalsContact NH2-CE2 3.34Å
257	I	98.6	Very high	90.1	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	119.3	178.3	-51.5	-63.8	0	0	0	109.4	L231 Y233 L236 L255 V259 L289 V290 M291 Y292	L231-I257 HydrophobicContact CD1-CD1 3.52Å; L231-I257 HydrophobicContact CG-CD1 4.28Å; L231-I257 WeakPolarHBondContact O-CA 3.39Å; Y233-I257 HydrophobicContact CD2-CG2 3.88Å; Y233-I257 HydrophobicContact CG-CG2 4.42Å; L236-I257 HydrophobicContact CD1-CD1 4.07Å; L236-I257 HydrophobicContact CD2-CD1 4.14Å; L236-I257 HydrophobicContact CD2-CG1 4.31Å; L236-I257 HydrophobicContact CD2-CG2 4.4Å; L236-I257 HydrophobicContact CG-CD1 4.48Å; L255-I257 HydrophobicContact CD1-CD1 3.81Å; L255-I257 HydrophobicContact CD2-CD1 4.25Å; L255-I257 HydrophobicContact CG-CD1 3.88Å; L255-I257 HydrophobicContact CG-CG1 4.18Å; I257-V259 HydrophobicContact CG2-CG2 4.17Å; I257-L289 HydrophobicContact CG1-CD1 4.12Å; I257-V290 PolarHBondContact N-O 3.44Å; I257-M291 HydrophobicContact CB-CE 4.43Å; I257-M291 HydrophobicContact CB-CG 4.36Å; I257-M291 HydrophobicContact CG2-CE 4.43Å; I257-M291 WeakPolarHBondContact O-CA 3.03Å; I257-Y292 PolarHBondContact O-N 2.8Å
258	D	98	Very high	89.5	Confident	10 Å²	10	66.3 Å²	66.3	5%	0.053	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	113.7	172.7	-61.7	-49.6	0	0	0	109.4	S206 L231 N232 Y233 R256 V260	S206-D258 VanDerWaalsContact CB-OD2 3.25Å; S206-D258 WeakPolarHBondContact CB-OD2 3.42Å; S206-D258 PolarHBondContact OG-OD2 3.38Å; L231-D258 PolarHBondContact O-N 2.97Å; N232-D258 CarbonylContact C-O 3.59Å; N232-D258 VanDerWaalsContact CA-O 3.28Å; N232-D258 WeakPolarHBondContact CA-O 3.25Å; Y233-D258 PolarHBondContact N-O 2.6Å; R256-D258 IonicContact CZ-OD1 3.06Å; R256-D258 IonicContact CZ-OD2 2.7Å; R256-D258 IonicContact NE-OD1 3.97Å; R256-D258 PolarHBondContact NE-OD1 3.04Å; R256-D258 IonicContact NE-OD2 3.68Å; R256-D258 PolarHBondContact NE-OD2 3.36Å; R256-D258 IonicContact NH2-OD1 2.67Å; R256-D258 PolarHBondContact NH2-OD1 2.75Å; R256-D258 IonicContact NH2-OD2 3.42Å; D258-V260 HydrophobicContact CB-CG2 4.4Å
259	V	97	Very high	89.3	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	98	179.2	-160	0	0	0	0	108.2	Y233 I257 F269 M291 Y292 F293 F294 L295 F303	Y233-V259 HydrophobicContact CD2-CG2 4.2Å; Y233-V259 HydrophobicContact CG-CG1 4.12Å; Y233-V259 HydrophobicContact CG-CG2 4.33Å; I257-V259 HydrophobicContact CG2-CG2 4.17Å; V259-F269 HydrophobicContact CG1-CD1 4.18Å; V259-F269 HydrophobicContact CG1-CE1 3.89Å; V259-F269 HydrophobicContact CG1-CZ 4.29Å; V259-M291 HydrophobicContact CG2-CE 4.2Å; V259-Y292 PolarHBondContact N-O 3.48Å; V259-F293 HydrophobicContact CB-CD1 3.75Å; V259-F293 HydrophobicContact CB-CE1 4.04Å; V259-F293 HydrophobicContact CB-CG 4.33Å; V259-F293 HydrophobicContact CG1-CD1 4.04Å; V259-F293 HydrophobicContact CG1-CE1 4.16Å; V259-F293 HydrophobicContact CG2-CD1 3.83Å; V259-F293 HydrophobicContact CG2-CE1 3.67Å; V259-F293 HydrophobicContact CG2-CG 4.36Å; V259-F293 HydrophobicContact CG2-CZ 4.04Å; V259-F294 PolarHBondContact O-N 3.35Å; V259-L295 HydrophobicContact CG1-CD1 4.06Å; V259-L295 HydrophobicContact CG1-CD2 4.03Å; V259-L295 HydrophobicContact CG1-CG 4.32Å; V259-F303 HydrophobicContact CG1-CE1 4.11Å; V259-F303 HydrophobicContact CG1-CE2 4.21Å; V259-F303 HydrophobicContact CG1-CZ 3.53Å
260	V	93.9	Very high	89.1	Confident	57 Å²	57	63.3 Å²	63.3	35%	0.345	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.1	-173.4	-175.6	0	0	0	0	109.3	D258 F294	D258-V260 HydrophobicContact CB-CG2 4.4Å; V260-F294 HydrophobicContact CG2-CD2 4.07Å
261	S	89.6	Confident	89	Confident	5 Å²	5	65.2 Å²	65.2	4%	0.035	33%	0.332	C	S	.	.			trans	-87.3	108.9	167.8	-179	0	0	0	0	109.3	F294 E299	S261-F294 PolarHBondContact N-O 3.44Å; S261-F294 VanDerWaalsContact N-O 3.15Å; S261-E299 WeakPolarHBondContact CB-OE1 3.28Å; S261-E299 WeakPolarHBondContact CB-OE2 3.4Å; S261-E299 PolarHBondContact OG-OE1 2.83Å; S261-E299 PolarHBondContact OG-OE2 3.38Å
262	E	75.8	Confident	89	Confident	146 Å²	146	57.4 Å²	57.4	68%	0.682	30%	0.303	S	S	*	.	S	Bend	trans	-76.9	-34.6	175.7	-65.2	178	-177.9	0	0	111.3
263	N	75.8	Confident	88.9	Confident	89 Å²	89	62.8 Å²	62.8	48%	0.476	33%	0.328	S	S	.	.	S	Bend	trans	-132.1	101.1	-177.8	-64.1	-60.2	0	0	0	110.8	G265 Q266 T267	N263-G265 PolarHBondContact O-N 3.15Å; N263-Q266 HydrophobicContact CB-CB 4.39Å; N263-Q266 PolarHBondContact O-N 3.36Å; N263-T267 PolarHBondContact O-N 3.07Å; N263-T267 PolarHBondContact O-OG1 3.17Å
264	P	68.6	Low	88.9	Confident	73 Å²	73	62.2 Å²	62.2	47%	0.474	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	135.3	179.8	0.4	-7.8	0	0	0	112.5	Q266 Y296	P264-Q266 PolarHBondContact O-N 2.85Å; P264-Q266 VanDerWaalsContact O-N 3.12Å; P264-Y296 HydrophobicContact CB-CD2 3.66Å; P264-Y296 HydrophobicContact CB-CE2 3.35Å; P264-Y296 HydrophobicContact CB-CG 4.4Å; P264-Y296 HydrophobicContact CG-CD2 4.41Å; P264-Y296 HydrophobicContact CG-CE2 3.6Å
265	G	66.8	Low	88.9	Confident	60 Å²	60	63.1 Å²	63.1	62%	0.619	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	-0.9	171.5	0	0	0	0	0	115.4	N263	N263-G265 PolarHBondContact O-N 3.15Å
266	Q	68.6	Low	88.9	Confident	155 Å²	155	63.1 Å²	63.1	72%	0.724	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	-20.6	174.2	-63.4	-177.6	6.9	0	0	112.1	N263 P264 H268	N263-Q266 HydrophobicContact CB-CB 4.39Å; N263-Q266 PolarHBondContact O-N 3.36Å; P264-Q266 PolarHBondContact O-N 2.85Å; P264-Q266 VanDerWaalsContact O-N 3.12Å; Q266-H268 PolarHBondContact O-N 3.27Å; Q266-H268 PolarHBondContact O-ND1 3.44Å
267	T	77.4	Confident	88.8	Confident	40 Å²	40	60.2 Å²	60.2	25%	0.245	32%	0.324	C	S	.	.			trans	-83.2	114.5	-175	-51.2	0	0	0	0	110.4	N263 F269	N263-T267 PolarHBondContact O-N 3.07Å; N263-T267 PolarHBondContact O-OG1 3.17Å; T267-F269 HydrophobicContact CG2-CD1 4.49Å; T267-F269 HydrophobicContact CG2-CD2 4.36Å; T267-F269 HydrophobicContact CG2-CE1 4.05Å; T267-F269 HydrophobicContact CG2-CE2 3.87Å; T267-F269 HydrophobicContact CG2-CZ 3.69Å
268	H	83.1	Confident	88.8	Confident	174 Å²	174	62.8 Å²	62.8	81%	0.806	34%	0.338	S	S	*	.			trans	-104.6	107.9	170.2	-68.6	75	0	0	0	108.7	Q266	Q266-H268 PolarHBondContact O-N 3.27Å; Q266-H268 PolarHBondContact O-ND1 3.44Å
269	F	92.9	Very high	88.9	Confident	31 Å²	31	63.6 Å²	63.6	14%	0.136	35%	0.346	C	S	.	.			trans	-70.1	134	176.7	-65.6	-80.8	0	0	0	110.3	Y233 V259 T267 L295 E299 P302 F303	Y233-F269 HydrophobicContact CD1-CB 4.45Å; Y233-F269 AromaticContact CD1-CD1 3.72Å; Y233-F269 HydrophobicContact CD1-CD1 3.72Å; Y233-F269 HydrophobicContact CE1-CB 4.02Å; Y233-F269 HydrophobicContact CE1-CD1 4.15Å; V259-F269 HydrophobicContact CG1-CD1 4.18Å; V259-F269 HydrophobicContact CG1-CE1 3.89Å; V259-F269 HydrophobicContact CG1-CZ 4.29Å; T267-F269 HydrophobicContact CG2-CD1 4.49Å; T267-F269 HydrophobicContact CG2-CD2 4.36Å; T267-F269 HydrophobicContact CG2-CE1 4.05Å; T267-F269 HydrophobicContact CG2-CE2 3.87Å; T267-F269 HydrophobicContact CG2-CZ 3.69Å; F269-L295 HydrophobicContact CD2-CD1 4.48Å; F269-L295 HydrophobicContact CD2-CD2 4.48Å; F269-L295 HydrophobicContact CE1-CD2 4.28Å; F269-L295 HydrophobicContact CE2-CD1 4.12Å; F269-L295 HydrophobicContact CE2-CD2 3.43Å; F269-L295 VanDerWaalsContact CE2-CD2 3.43Å; F269-L295 HydrophobicContact CE2-CG 4.4Å; F269-L295 HydrophobicContact CZ-CD2 3.3Å; F269-E299 HydrophobicContact CD2-CB 4.26Å; F269-E299 HydrophobicContact CE2-CB 4Å; F269-P302 HydrophobicContact CB-CG 3.78Å; F269-F303 HydrophobicContact CB-CE2 3.98Å; F269-F303 HydrophobicContact CB-CZ 3.92Å; F269-F303 HydrophobicContact CD1-CZ 4.26Å; F269-F303 HydrophobicContact CD2-CE2 4.04Å; F269-F303 HydrophobicContact CD2-CZ 4.43Å; F269-F303 AromaticContact CG-CE2 3.96Å; F269-F303 HydrophobicContact CG-CE2 3.96Å; F269-F303 AromaticContact CG-CZ 3.94Å; F269-F303 HydrophobicContact CG-CZ 3.94Å
270	H	94.8	Very high	88.9	Confident	75 Å²	75	63.6 Å²	63.6	35%	0.347	35%	0.346	S	S	.	.			trans	-69.3	165.2	171.7	66.2	-72.7	0	0	0	110.7	Y233 L236	Y233-H270 AromaticContact CD1-CE1 3.7Å; Y233-H270 AromaticContact CE1-CE1 3.45Å; Y233-H270 VanDerWaalsContact CE1-CE1 3.45Å; Y233-H270 WeakPolarHBondContact CE1-CE1 3.31Å; Y233-H270 AromaticContact CE1-ND1 3.62Å; Y233-H270 AromaticContact CE1-NE2 3.95Å; Y233-H270 WeakPolarHBondContact CE1-O 3.29Å; Y233-H270 PolarHBondContact O-CE1 2.88Å; Y233-H270 VanDerWaalsContact O-CE1 3.29Å; Y233-H270 PolarHBondContact OH-O 2.82Å; L236-H270 PolarHBondContact O-CE1 3.1Å; L236-H270 PolarHBondContact O-NE2 3.14Å
271	T	96.1	Very high	89.1	Confident	78 Å²	78	62.9 Å²	62.9	48%	0.479	34%	0.34	S	S	.	.			trans	-109.4	137.9	179.7	-60.7	0	0	0	0	109.8	P302	T271-P302 WeakPolarHBondContact OG1-CB 3.45Å
272	I	98	Very high	89.5	Confident	2 Å²	2	72.5 Å²	72.5	1%	0.01	38%	0.376	C	S	.	.			trans	-87.1	146.9	168.4	-57.4	-57.3	0	0	0	108.5	L236 D238 L241 W277 Y306	L236-I272 HydrophobicContact CD2-CD1 4.46Å; L236-I272 HydrophobicContact CD2-CG1 4.1Å; L236-I272 HydrophobicContact CG-CD1 4.08Å; L236-I272 HydrophobicContact CG-CG1 4.25Å; D238-I272 WeakPolarHBondContact OD1-CG2 3.21Å; L241-I272 HydrophobicContact CD1-CG2 3.6Å; I272-W277 HydrophobicContact CG2-CG 4.5Å; I272-W277 HydrophobicContact CG2-CZ2 4.43Å; I272-Y306 PolarHBondContact O-OH 3.04Å
273	Q	97.8	Very high	90.6	Very high	117 Å²	117	67.3 Å²	67.3	55%	0.547	35%	0.351	S	S	.	.			trans	-76.8	145.2	175.2	-63.3	-171.5	-15.7	0	0	111.6	D238 S275 S276 W277	D238-Q273 WeakPolarHBondContact OD1-CB 3.42Å; D238-Q273 PolarHBondContact OD1-N 3.44Å; Q273-S275 WeakPolarHBondContact CB-OG 3.4Å; Q273-S275 PolarHBondContact O-N 3.41Å; Q273-S275 PolarHBondContact OE1-OG 3.02Å; Q273-S276 WeakPolarHBondContact O-CB 3.38Å; Q273-S276 PolarHBondContact O-N 3.14Å; Q273-S276 VanDerWaalsContact O-N 3.12Å; Q273-W277 PolarHBondContact O-N 3.25Å
274	K	97.8	Very high	91.7	Very high	75 Å²	75	63.1 Å²	63.1	33%	0.326	33%	0.329	S	S	.	.	H	α-helix	trans	-56.6	-38.6	174.1	175	168.3	173.7	46.5	0	112.2	S276 W277 D278 Y306	K274-S276 PolarHBondContact O-N 3.48Å; K274-W277 PolarHBondContact O-N 2.76Å; K274-D278 VanDerWaalsContact CE-OD2 3.29Å; K274-D278 WeakPolarHBondContact CE-OD2 3.32Å; K274-D278 WeakPolarHBondContact CG-OD2 3.25Å; K274-D278 VanDerWaalsContact NZ-CG 3.28Å; K274-D278 IonicContact NZ-OD1 2.86Å; K274-D278 PolarHBondContact NZ-OD1 3.2Å; K274-D278 IonicContact NZ-OD2 2.89Å; K274-D278 PolarHBondContact NZ-OD2 3.23Å; K274-D278 WeakPolarHBondContact O-CB 3.46Å; K274-D278 VanDerWaalsContact O-CG 3.26Å; K274-D278 PolarHBondContact O-N 2.92Å; K274-Y306 HydrophobicContact CB-CD1 4.21Å; K274-Y306 HydrophobicContact CB-CD2 3.76Å; K274-Y306 HydrophobicContact CB-CE1 4.23Å; K274-Y306 HydrophobicContact CB-CE2 3.82Å; K274-Y306 HydrophobicContact CB-CG 4Å; K274-Y306 HydrophobicContact CD-CD2 4.08Å; K274-Y306 HydrophobicContact CD-CG 4.13Å; K274-Y306 HydrophobicContact CG-CD2 3.92Å; K274-Y306 HydrophobicContact CG-CE2 4.3Å; K274-Y306 HydrophobicContact CG-CG 4.33Å
275	S	98.3	Very high	93.1	Very high	65 Å²	65	63 Å²	63	46%	0.455	33%	0.328	S	S	.	.	H	α-helix	trans	-55.3	-37.9	177.3	38.4	0	0	0	0	112.8	Q273 D278 A279	Q273-S275 WeakPolarHBondContact CB-OG 3.4Å; Q273-S275 PolarHBondContact O-N 3.41Å; Q273-S275 PolarHBondContact OE1-OG 3.02Å; S275-D278 PolarHBondContact O-N 3.41Å; S275-A279 WeakPolarHBondContact O-CB 3.42Å; S275-A279 PolarHBondContact O-N 2.94Å
276	S	98.5	Very high	94.6	Very high	2 Å²	2	69 Å²	69	1%	0.014	34%	0.337	C	S	.	.	H	α-helix	trans	-70.3	-42	179.1	-53.1	0	0	0	0	111.6	D238 Q273 K274 A279 F280	D238-S276 WeakPolarHBondContact OD1-CB 3.28Å; D238-S276 PolarHBondContact OD1-OG 2.9Å; Q273-S276 WeakPolarHBondContact O-CB 3.38Å; Q273-S276 PolarHBondContact O-N 3.14Å; Q273-S276 VanDerWaalsContact O-N 3.12Å; K274-S276 PolarHBondContact O-N 3.48Å; S276-A279 PolarHBondContact O-N 3.17Å; S276-F280 WeakPolarHBondContact O-CB 3.32Å; S276-F280 PolarHBondContact O-N 3.27Å
277	W	98.4	Very high	96	Very high	10 Å²	10	61.6 Å²	61.6	4%	0.038	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-40.4	171.7	-71.9	116.4	0	0	0	112.7	L236 L241 I272 Q273 K274 F280 I281 L289 Y306 P309	L236-W277 HydrophobicContact CD2-CH2 3.96Å; L236-W277 HydrophobicContact CD2-CZ2 3.97Å; L241-W277 HydrophobicContact CD1-CD2 3.84Å; L241-W277 HydrophobicContact CD1-CE3 3.78Å; L241-W277 HydrophobicContact CD1-CG 4.44Å; L241-W277 HydrophobicContact CD1-CH2 4.14Å; L241-W277 HydrophobicContact CD1-CZ2 4.2Å; L241-W277 HydrophobicContact CD1-CZ3 3.92Å; L241-W277 HydrophobicContact CD2-CE3 4.47Å; L241-W277 HydrophobicContact CD2-CZ3 4.06Å; I272-W277 HydrophobicContact CG2-CG 4.5Å; I272-W277 HydrophobicContact CG2-CZ2 4.43Å; Q273-W277 PolarHBondContact O-N 3.25Å; K274-W277 PolarHBondContact O-N 2.76Å; W277-F280 HydrophobicContact CE3-CD1 4.26Å; W277-F280 HydrophobicContact CZ3-CD1 4.35Å; W277-F280 WeakPolarHBondContact O-CB 3.36Å; W277-F280 PolarHBondContact O-N 3.37Å; W277-I281 PolarHBondContact O-N 2.85Å; W277-L289 HydrophobicContact CE3-CD2 4.17Å; W277-L289 HydrophobicContact CH2-CD1 4.33Å; W277-L289 HydrophobicContact CH2-CD2 3.83Å; W277-L289 HydrophobicContact CZ3-CD1 4.28Å; W277-L289 HydrophobicContact CZ3-CD2 3.49Å; W277-L289 VanDerWaalsContact CZ3-CD2 3.49Å; W277-Y306 AromaticContact CD1-CE2 3.65Å; W277-P309 HydrophobicContact CE3-CG 3.77Å; W277-P309 HydrophobicContact CZ3-CG 4.41Å
278	D	98.3	Very high	97	Very high	54 Å²	54	62.9 Å²	62.9	29%	0.289	31%	0.308	S	S	.	.	H	α-helix	trans	-68.1	-36.4	178.6	-69.7	-16.3	0	0	0	111.9	K274 S275 I281 R282	K274-D278 VanDerWaalsContact CE-OD2 3.29Å; K274-D278 WeakPolarHBondContact CE-OD2 3.32Å; K274-D278 WeakPolarHBondContact CG-OD2 3.25Å; K274-D278 VanDerWaalsContact NZ-CG 3.28Å; K274-D278 IonicContact NZ-OD1 2.86Å; K274-D278 PolarHBondContact NZ-OD1 3.2Å; K274-D278 IonicContact NZ-OD2 2.89Å; K274-D278 PolarHBondContact NZ-OD2 3.23Å; K274-D278 WeakPolarHBondContact O-CB 3.46Å; K274-D278 VanDerWaalsContact O-CG 3.26Å; K274-D278 PolarHBondContact O-N 2.92Å; S275-D278 PolarHBondContact O-N 3.41Å; D278-I281 WeakPolarHBondContact O-CG2 3.37Å; D278-R282 VanDerWaalsContact O-CB 3.24Å; D278-R282 WeakPolarHBondContact O-CB 3.36Å; D278-R282 PolarHBondContact O-N 3.21Å; D278-R282 VanDerWaalsContact O-N 3.14Å
279	A	98.5	Very high	97.8	Very high	27 Å²	27	54.6 Å²	54.6	22%	0.223	27%	0.27	C	S	.	.	H	α-helix	trans	-65.1	-44.3	172.1	0	0	0	0	0	111.1	L242 S275 S276 I281 R282 H283	L242-A279 HydrophobicContact CD2-CB 3.95Å; S275-A279 WeakPolarHBondContact O-CB 3.42Å; S275-A279 PolarHBondContact O-N 2.94Å; S276-A279 PolarHBondContact O-N 3.17Å; A279-I281 PolarHBondContact O-N 3.27Å; A279-R282 WeakPolarHBondContact O-CB 3.19Å; A279-R282 PolarHBondContact O-N 3.27Å; A279-H283 PolarHBondContact O-N 3.39Å
280	F	98.5	Very high	98.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.3	-48.8	179.4	-178.9	-112.9	0	0	0	113.1	L241 S245 L252 L255 S276 W277 R282 H283 S284 V287 P309	L241-F280 HydrophobicContact CD2-CB 4.46Å; L241-F280 HydrophobicContact CD2-CD2 4.14Å; L241-F280 HydrophobicContact CD2-CG 4.16Å; S245-F280 WeakPolarHBondContact OG-CA 3.3Å; S245-F280 PolarHBondContact OG-N 3.22Å; L252-F280 HydrophobicContact CB-CE2 4.26Å; L252-F280 HydrophobicContact CD2-CE2 3.69Å; L252-F280 HydrophobicContact CD2-CZ 3.82Å; L255-F280 HydrophobicContact CB-CZ 4.06Å; L255-F280 HydrophobicContact CD2-CE1 4.09Å; L255-F280 HydrophobicContact CD2-CE2 4.28Å; L255-F280 HydrophobicContact CD2-CZ 3.69Å; S276-F280 WeakPolarHBondContact O-CB 3.32Å; S276-F280 PolarHBondContact O-N 3.27Å; W277-F280 HydrophobicContact CE3-CD1 4.26Å; W277-F280 HydrophobicContact CZ3-CD1 4.35Å; W277-F280 WeakPolarHBondContact O-CB 3.36Å; W277-F280 PolarHBondContact O-N 3.37Å; F280-R282 VanDerWaalsContact C-N 3.33Å; F280-R282 PolarHBondContact O-N 3.42Å; F280-H283 PolarHBondContact O-N 2.87Å; F280-S284 PolarHBondContact O-N 3.32Å; F280-V287 HydrophobicContact CD1-CG1 4.23Å; F280-V287 HydrophobicContact CE1-CB 4.38Å; F280-V287 HydrophobicContact CE1-CG1 3.53Å; F280-V287 HydrophobicContact CE1-CG2 4.07Å; F280-V287 HydrophobicContact CZ-CB 4.33Å; F280-V287 HydrophobicContact CZ-CG1 3.96Å; F280-V287 HydrophobicContact CZ-CG2 3.71Å; F280-P309 HydrophobicContact CD1-CG 4.31Å
281	I	97.9	Very high	98.2	Very high	42 Å²	42	50.4 Å²	50.4	22%	0.215	25%	0.251	C	S	.	.	H	α-helix	trans	-70.6	-30.8	178.6	-166.2	60.1	0	0	0	112.6	W277 D278 A279 S284 P285 V287 P309	W277-I281 PolarHBondContact O-N 2.85Å; D278-I281 WeakPolarHBondContact O-CG2 3.37Å; A279-I281 PolarHBondContact O-N 3.27Å; I281-S284 CarbonylContact O-C 3.55Å; I281-P285 WeakPolarHBondContact O-CA 3.11Å; I281-P285 VanDerWaalsContact O-N 3.15Å; I281-V287 HydrophobicContact CD1-CG1 4.26Å; I281-P309 HydrophobicContact CB-CB 4.11Å; I281-P309 HydrophobicContact CD1-CB 3.9Å; I281-P309 HydrophobicContact CG1-CB 4.14Å
282	R	98.4	Very high	98.4	Very high	208 Å²	208	50 Å²	50	79%	0.785	24%	0.242	S	C	*	.	H	α-helix	trans	-64.3	-41.8	175.8	-173.9	-172.9	-51	-132.8	-0.4	111.5	D278 A279 F280	D278-R282 VanDerWaalsContact O-CB 3.24Å; D278-R282 WeakPolarHBondContact O-CB 3.36Å; D278-R282 PolarHBondContact O-N 3.21Å; D278-R282 VanDerWaalsContact O-N 3.14Å; A279-R282 WeakPolarHBondContact O-CB 3.19Å; A279-R282 PolarHBondContact O-N 3.27Å; F280-R282 VanDerWaalsContact C-N 3.33Å; F280-R282 PolarHBondContact O-N 3.42Å
283	H	98.6	Very high	98.3	Very high	36 Å²	36	50 Å²	50	17%	0.167	24%	0.242	C	C	.	.	H	α-helix	trans	-71.6	-47.9	177.1	-175.6	60.8	0	0	0	111.9	L244 S246 H249 V250 R251 A279 F280 P285	L244-H283 PolarHBondContact O-CD2 3Å; S246-H283 PolarHBondContact O-CE1 3.34Å; S246-H283 VanDerWaalsContact O-CE1 3.25Å; H249-H283 PolarHBondContact O-CE1 3.35Å; H249-H283 PolarHBondContact O-NE2 2.99Å; V250-H283 PolarHBondContact O-NE2 3.32Å; R251-H283 PolarHBondContact NE-O 3.33Å; A279-H283 PolarHBondContact O-N 3.39Å; F280-H283 PolarHBondContact O-N 2.87Å; H283-P285 VanDerWaalsContact C-CD 3.47Å; H283-P285 VanDerWaalsContact O-CD 3.23Å; H283-P285 WeakPolarHBondContact O-CD 3.26Å
284	S	98.5	Very high	98.2	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.007	23%	0.229	C	C	.	.			trans	-120	70.5	-173.3	-57.8	0	0	0	0	112.2	R251 L252 F280 I281 K286 V287	R251-S284 WeakPolarHBondContact CA-OG 3.41Å; L252-S284 PolarHBondContact N-OG 3.38Å; F280-S284 PolarHBondContact O-N 3.32Å; I281-S284 CarbonylContact O-C 3.55Å; S284-K286 PolarHBondContact O-N 2.87Å; S284-V287 WeakPolarHBondContact O-CB 3.47Å; S284-V287 WeakPolarHBondContact O-CG1 3.33Å; S284-V287 PolarHBondContact O-N 3.16Å
285	P	98	Very high	98	Very high	72 Å²	72	43.9 Å²	43.9	47%	0.468	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.3	-170.1	25.7	-36.4	0	0	0	115	I281 H283 R333	I281-P285 WeakPolarHBondContact O-CA 3.11Å; I281-P285 VanDerWaalsContact O-N 3.15Å; H283-P285 VanDerWaalsContact C-CD 3.47Å; H283-P285 VanDerWaalsContact O-CD 3.23Å; H283-P285 WeakPolarHBondContact O-CD 3.26Å; P285-R333 PolarHBondContact O-NH2 3.28Å; P285-R333 VanDerWaalsContact O-NH2 3.11Å
286	K	98	Very high	97.5	Very high	185 Å²	185	45.7 Å²	45.7	80%	0.804	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.6	6	178.7	-65	-173	178.7	-176.9	0	113.3	S284	S284-K286 PolarHBondContact O-N 2.87Å
287	V	98.4	Very high	96.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.237	C	C	.	.			trans	-61.1	139.6	-177.6	69.7	0	0	0	0	111.3	L252 F280 I281 S284 R333	L252-V287 HydrophobicContact CB-CG2 4.08Å; L252-V287 WeakPolarHBondContact O-CB 3.39Å; F280-V287 HydrophobicContact CD1-CG1 4.23Å; F280-V287 HydrophobicContact CE1-CB 4.38Å; F280-V287 HydrophobicContact CE1-CG1 3.53Å; F280-V287 HydrophobicContact CE1-CG2 4.07Å; F280-V287 HydrophobicContact CZ-CB 4.33Å; F280-V287 HydrophobicContact CZ-CG1 3.96Å; F280-V287 HydrophobicContact CZ-CG2 3.71Å; I281-V287 HydrophobicContact CD1-CG1 4.26Å; S284-V287 WeakPolarHBondContact O-CB 3.47Å; S284-V287 WeakPolarHBondContact O-CG1 3.33Å; S284-V287 PolarHBondContact O-N 3.16Å; V287-R333 PolarHBondContact O-NH1 2.66Å; V287-R333 PolarHBondContact O-NH2 2.63Å
288	N	98.7	Very high	95.9	Very high	67 Å²	67	58.8 Å²	58.8	36%	0.358	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	113.2	165.8	-65.4	-64.6	0	0	0	108.8	E253 H254 L255 T311	E253-N288 PolarHBondContact O-N 3.08Å; E253-N288 PolarHBondContact O-ND2 3.22Å; H254-N288 WeakPolarHBondContact CA-O 3.35Å; L255-N288 PolarHBondContact N-O 3.17Å; N288-T311 WeakPolarHBondContact CA-OG1 3.35Å
289	L	98.8	Very high	95.6	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	110.2	168	175.7	59.1	0	0	0	108.8	L255 I257 W277 M291 P309 A310 T311 H312	L255-L289 HydrophobicContact CB-CD1 4.19Å; L255-L289 HydrophobicContact CD2-CD1 4.03Å; L255-L289 HydrophobicContact CG-CD1 4.02Å; L255-L289 WeakPolarHBondContact O-CA 3.5Å; I257-L289 HydrophobicContact CG1-CD1 4.12Å; W277-L289 HydrophobicContact CE3-CD2 4.17Å; W277-L289 HydrophobicContact CH2-CD1 4.33Å; W277-L289 HydrophobicContact CH2-CD2 3.83Å; W277-L289 HydrophobicContact CZ3-CD1 4.28Å; W277-L289 HydrophobicContact CZ3-CD2 3.49Å; W277-L289 VanDerWaalsContact CZ3-CD2 3.49Å; L289-M291 HydrophobicContact CD1-CG 4.04Å; L289-M291 HydrophobicContact CD2-SD 4.2Å; L289-M291 HydrophobicContact CG-CG 4.02Å; L289-M291 HydrophobicContact CG-SD 4.3Å; L289-P309 HydrophobicContact CD2-CG 3.99Å; L289-A310 HydrophobicContact CD2-CB 4.4Å; L289-T311 VanDerWaalsContact C-OG1 3.31Å; L289-T311 PolarHBondContact N-OG1 2.67Å; L289-T311 PolarHBondContact O-N 3.36Å; L289-T311 PolarHBondContact O-OG1 2.85Å; L289-H312 PolarHBondContact O-N 3.32Å; L289-H312 VanDerWaalsContact O-N 3.08Å
290	V	98.9	Very high	95.3	Very high	12 Å²	12	55.7 Å²	55.7	7%	0.073	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	125.3	178.2	-178.5	0	0	0	0	108.2	H254 L255 R256 I257 Y292 H312	H254-V290 WeakPolarHBondContact NE2-CG2 3.5Å; L255-V290 PolarHBondContact O-N 2.9Å; R256-V290 CarbonylContact C-O 3.6Å; R256-V290 VanDerWaalsContact CA-O 3.3Å; R256-V290 WeakPolarHBondContact CA-O 3.46Å; R256-V290 HydrophobicContact CB-CB 4.29Å; R256-V290 HydrophobicContact CG-CB 4.43Å; R256-V290 HydrophobicContact CG-CG1 4.41Å; I257-V290 PolarHBondContact N-O 3.44Å; V290-Y292 HydrophobicContact CG1-CD1 3.92Å; V290-Y292 HydrophobicContact CG1-CE1 3.49Å; V290-Y292 VanDerWaalsContact CG1-CE1 3.49Å; V290-H312 WeakPolarHBondContact CA-O 3.3Å; V290-H312 HydrophobicContact CB-CB 4.29Å; V290-H312 HydrophobicContact CG1-CB 4.1Å; V290-H312 HydrophobicContact CG2-CB 3.95Å
291	M	98.8	Very high	95	Very high	5 Å²	5	60.6 Å²	60.6	3%	0.025	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	123.1	179.6	-56.5	-173.9	72.4	0	0	111	I257 V259 L289 F293 H312 L313 Y314	I257-M291 HydrophobicContact CB-CE 4.43Å; I257-M291 HydrophobicContact CB-CG 4.36Å; I257-M291 HydrophobicContact CG2-CE 4.43Å; I257-M291 WeakPolarHBondContact O-CA 3.03Å; V259-M291 HydrophobicContact CG2-CE 4.2Å; L289-M291 HydrophobicContact CD1-CG 4.04Å; L289-M291 HydrophobicContact CD2-SD 4.2Å; L289-M291 HydrophobicContact CG-CG 4.02Å; L289-M291 HydrophobicContact CG-SD 4.3Å; M291-F293 HydrophobicContact CB-CD2 4.26Å; M291-F293 HydrophobicContact CB-CE2 3.56Å; M291-F293 HydrophobicContact CB-CZ 4.24Å; M291-F293 HydrophobicContact CE-CE2 4.2Å; M291-F293 HydrophobicContact CE-CZ 3.69Å; M291-F293 HydrophobicContact SD-CE2 4.42Å; M291-F293 HydrophobicContact SD-CZ 4.33Å; M291-H312 PolarHBondContact N-O 3.27Å; M291-L313 HydrophobicContact CB-CD2 3.93Å; M291-Y314 PolarHBondContact O-N 3.49Å
292	Y	98.5	Very high	94.9	Very high	71 Å²	71	60 Å²	60	28%	0.278	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	126	177	-70.2	4.2	0	0	0	109	R256 I257 V259 V290 Y314	R256-Y292 VanDerWaalsContact NH2-CE2 3.34Å; I257-Y292 PolarHBondContact O-N 2.8Å; V259-Y292 PolarHBondContact N-O 3.48Å; V290-Y292 HydrophobicContact CG1-CD1 3.92Å; V290-Y292 HydrophobicContact CG1-CE1 3.49Å; V290-Y292 VanDerWaalsContact CG1-CE1 3.49Å; Y292-Y314 CarbonylContact C-O 3.51Å; Y292-Y314 WeakPolarHBondContact CA-O 3.34Å; Y292-Y314 HydrophobicContact CD1-CD1 4.35Å; Y292-Y314 HydrophobicContact CD1-CG 4.2Å; Y292-Y314 HydrophobicContact CD2-CD1 4.37Å; Y292-Y314 HydrophobicContact CE1-CG 4.39Å; Y292-Y314 HydrophobicContact CG-CD1 4.11Å; Y292-Y314 HydrophobicContact CG-CG 4.42Å
293	F	97.5	Very high	94.8	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.009	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	121.3	-177.3	-69.8	-93.6	0	0	0	110.4	V259 M291 L295 F300 F303 F304 L313 Y314 F315 G316	V259-F293 HydrophobicContact CB-CD1 3.75Å; V259-F293 HydrophobicContact CB-CE1 4.04Å; V259-F293 HydrophobicContact CB-CG 4.33Å; V259-F293 HydrophobicContact CG1-CD1 4.04Å; V259-F293 HydrophobicContact CG1-CE1 4.16Å; V259-F293 HydrophobicContact CG2-CD1 3.83Å; V259-F293 HydrophobicContact CG2-CE1 3.67Å; V259-F293 HydrophobicContact CG2-CG 4.36Å; V259-F293 HydrophobicContact CG2-CZ 4.04Å; M291-F293 HydrophobicContact CB-CD2 4.26Å; M291-F293 HydrophobicContact CB-CE2 3.56Å; M291-F293 HydrophobicContact CB-CZ 4.24Å; M291-F293 HydrophobicContact CE-CE2 4.2Å; M291-F293 HydrophobicContact CE-CZ 3.69Å; M291-F293 HydrophobicContact SD-CE2 4.42Å; M291-F293 HydrophobicContact SD-CZ 4.33Å; F293-L295 HydrophobicContact CD1-CD1 3.84Å; F293-L295 HydrophobicContact CD1-CG 4.26Å; F293-F300 HydrophobicContact CB-CE1 4.02Å; F293-F300 HydrophobicContact CB-CZ 4.15Å; F293-F300 HydrophobicContact CD1-CD1 4.34Å; F293-F300 AromaticContact CD1-CE1 3.63Å; F293-F300 HydrophobicContact CD1-CE1 3.63Å; F293-F300 HydrophobicContact CD1-CZ 4.48Å; F293-F300 HydrophobicContact CE1-CE1 4.3Å; F293-F300 AromaticContact CG-CE1 3.96Å; F293-F300 HydrophobicContact CG-CE1 3.96Å; F293-F303 HydrophobicContact CE1-CB 4.44Å; F293-F303 AromaticContact CE1-CD1 3.65Å; F293-F303 HydrophobicContact CE1-CD1 3.65Å; F293-F303 HydrophobicContact CE1-CD2 4.19Å; F293-F303 AromaticContact CE1-CE1 3.85Å; F293-F303 HydrophobicContact CE1-CE1 3.85Å; F293-F303 HydrophobicContact CE1-CE2 4.36Å; F293-F303 AromaticContact CE1-CG 3.83Å; F293-F303 HydrophobicContact CE1-CG 3.83Å; F293-F303 HydrophobicContact CE1-CZ 4.21Å; F293-F303 HydrophobicContact CZ-CD1 4.07Å; F293-F303 HydrophobicContact CZ-CE1 4.46Å; F293-F303 HydrophobicContact CZ-CG 4.45Å; F293-F304 HydrophobicContact CE1-CE2 4.4Å; F293-F304 HydrophobicContact CE2-CE2 4.25Å; F293-F304 AromaticContact CE2-CZ 3.77Å; F293-F304 HydrophobicContact CE2-CZ 3.77Å; F293-F304 AromaticContact CZ-CE2 3.96Å; F293-F304 HydrophobicContact CZ-CE2 3.96Å; F293-F304 AromaticContact CZ-CZ 3.78Å; F293-F304 HydrophobicContact CZ-CZ 3.78Å; F293-L313 HydrophobicContact CE2-CD2 4.04Å; F293-Y314 PolarHBondContact N-O 3.15Å; F293-F315 HydrophobicContact CB-CD1 3.89Å; F293-F315 HydrophobicContact CB-CE1 4.3Å; F293-F315 HydrophobicContact CD2-CD1 4.35Å; F293-F315 HydrophobicContact CD2-CE1 4.05Å; F293-F315 HydrophobicContact CG-CD1 4.27Å; F293-F315 HydrophobicContact CG-CE1 4.18Å; F293-G316 PolarHBondContact O-N 2.81Å
294	F	95.1	Very high	94.7	Very high	62 Å²	62	49.2 Å²	49.2	27%	0.272	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	60.7	173.4	-60.2	-88.3	0	0	0	109	V259 V260 S261 Y314	V259-F294 PolarHBondContact O-N 3.35Å; V260-F294 HydrophobicContact CG2-CD2 4.07Å; S261-F294 PolarHBondContact N-O 3.44Å; S261-F294 VanDerWaalsContact N-O 3.15Å; F294-Y314 AromaticContact CE1-CE1 3.84Å; F294-Y314 HydrophobicContact CE1-CE1 3.84Å; F294-Y314 HydrophobicContact CZ-CD1 4.12Å; F294-Y314 AromaticContact CZ-CE1 3.7Å; F294-Y314 HydrophobicContact CZ-CE1 3.7Å
295	L	93.2	Very high	94.6	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	26%	0.26	C	S	.	.			trans	-110.9	167.4	-174	-57.4	-169.8	0	0	0	111.9	V259 F269 F293 E299 F300 F303 R317	V259-L295 HydrophobicContact CG1-CD1 4.06Å; V259-L295 HydrophobicContact CG1-CD2 4.03Å; V259-L295 HydrophobicContact CG1-CG 4.32Å; F269-L295 HydrophobicContact CD2-CD1 4.48Å; F269-L295 HydrophobicContact CD2-CD2 4.48Å; F269-L295 HydrophobicContact CE1-CD2 4.28Å; F269-L295 HydrophobicContact CE2-CD1 4.12Å; F269-L295 HydrophobicContact CE2-CD2 3.43Å; F269-L295 VanDerWaalsContact CE2-CD2 3.43Å; F269-L295 HydrophobicContact CE2-CG 4.4Å; F269-L295 HydrophobicContact CZ-CD2 3.3Å; F293-L295 HydrophobicContact CD1-CD1 3.84Å; F293-L295 HydrophobicContact CD1-CG 4.26Å; L295-E299 HydrophobicContact CB-CB 4.31Å; L295-E299 HydrophobicContact CD1-CB 4.33Å; L295-F300 HydrophobicContact CB-CD2 4.31Å; L295-F300 HydrophobicContact CB-CE1 4.37Å; L295-F300 HydrophobicContact CB-CE2 3.72Å; L295-F300 HydrophobicContact CB-CZ 3.76Å; L295-F300 HydrophobicContact CD1-CD1 4.05Å; L295-F300 HydrophobicContact CD1-CE1 3.91Å; L295-F300 HydrophobicContact CD1-CE2 4.49Å; L295-F300 HydrophobicContact CD1-CG 4.4Å; L295-F300 HydrophobicContact CD1-CZ 4.15Å; L295-F300 HydrophobicContact CG-CE1 4.43Å; L295-F300 HydrophobicContact CG-CZ 4.25Å; L295-F303 HydrophobicContact CD1-CD2 4.18Å; L295-F303 HydrophobicContact CD1-CE2 3.72Å; L295-F303 HydrophobicContact CD1-CZ 4.47Å; L295-R317 VanDerWaalsContact O-CB 3.24Å; L295-R317 WeakPolarHBondContact O-CB 3.44Å; L295-R317 WeakPolarHBondContact O-CD 3.34Å
296	Y	88.7	Confident	94.5	Very high	102 Å²	102	55 Å²	55	40%	0.4	25%	0.248	S	C	.	.			trans	-94.5	160.6	163.1	-61.4	-86.4	0	0	0	110.4	P264 E298 E299 F300 R317	P264-Y296 HydrophobicContact CB-CD2 3.66Å; P264-Y296 HydrophobicContact CB-CE2 3.35Å; P264-Y296 HydrophobicContact CB-CG 4.4Å; P264-Y296 HydrophobicContact CG-CD2 4.41Å; P264-Y296 HydrophobicContact CG-CE2 3.6Å; Y296-E298 VanDerWaalsContact C-N 3.3Å; Y296-E298 PolarHBondContact O-N 3.1Å; Y296-E299 WeakPolarHBondContact CD2-OE2 3.42Å; Y296-E299 PolarHBondContact N-OE2 3.33Å; Y296-E299 WeakPolarHBondContact O-CB 3.16Å; Y296-E299 PolarHBondContact O-N 3.13Å; Y296-F300 WeakPolarHBondContact O-CD2 3.44Å; Y296-R317 PolarHBondContact OH-NH1 2.92Å
297	E	79.2	Confident	94.4	Very high	122 Å²	122	51.7 Å²	51.7	57%	0.57	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-54.5	-41.8	-170.1	-180	163.5	-163.4	0	0	114	E299 S320	E297-E299 PolarHBondContact O-N 3.4Å; E297-S320 WeakPolarHBondContact OE1-CB 3.3Å
298	E	83.1	Confident	94.3	Very high	165 Å²	165	52.3 Å²	52.3	77%	0.771	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-70	-16.7	-177	-61	176	-177.8	0	0	113.4	Y296	Y296-E298 VanDerWaalsContact C-N 3.3Å; Y296-E298 PolarHBondContact O-N 3.1Å
299	E	91.8	Very high	94.2	Very high	13 Å²	13	49.5 Å²	49.5	6%	0.061	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-89.7	-4.6	-172.2	-59	175.1	130.3	0	0	112.9	S261 F269 L295 Y296 E297 D301 P302	S261-E299 WeakPolarHBondContact CB-OE1 3.28Å; S261-E299 WeakPolarHBondContact CB-OE2 3.4Å; S261-E299 PolarHBondContact OG-OE1 2.83Å; S261-E299 PolarHBondContact OG-OE2 3.38Å; F269-E299 HydrophobicContact CD2-CB 4.26Å; F269-E299 HydrophobicContact CE2-CB 4Å; L295-E299 HydrophobicContact CB-CB 4.31Å; L295-E299 HydrophobicContact CD1-CB 4.33Å; Y296-E299 WeakPolarHBondContact CD2-OE2 3.42Å; Y296-E299 PolarHBondContact N-OE2 3.33Å; Y296-E299 WeakPolarHBondContact O-CB 3.16Å; Y296-E299 PolarHBondContact O-N 3.13Å; E297-E299 PolarHBondContact O-N 3.4Å; E299-D301 PolarHBondContact O-N 3.14Å; E299-P302 WeakPolarHBondContact O-CD 3.46Å
300	F	93.5	Very high	94.2	Very high	3 Å²	3	49.5 Å²	49.5	1%	0.013	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-81	2.2	-178	-77.8	-79.5	0	0	0	114.5	F293 L295 Y296 F303 F315 V319 V323 R326	F293-F300 HydrophobicContact CB-CE1 4.02Å; F293-F300 HydrophobicContact CB-CZ 4.15Å; F293-F300 HydrophobicContact CD1-CD1 4.34Å; F293-F300 AromaticContact CD1-CE1 3.63Å; F293-F300 HydrophobicContact CD1-CE1 3.63Å; F293-F300 HydrophobicContact CD1-CZ 4.48Å; F293-F300 HydrophobicContact CE1-CE1 4.3Å; F293-F300 AromaticContact CG-CE1 3.96Å; F293-F300 HydrophobicContact CG-CE1 3.96Å; L295-F300 HydrophobicContact CB-CD2 4.31Å; L295-F300 HydrophobicContact CB-CE1 4.37Å; L295-F300 HydrophobicContact CB-CE2 3.72Å; L295-F300 HydrophobicContact CB-CZ 3.76Å; L295-F300 HydrophobicContact CD1-CD1 4.05Å; L295-F300 HydrophobicContact CD1-CE1 3.91Å; L295-F300 HydrophobicContact CD1-CE2 4.49Å; L295-F300 HydrophobicContact CD1-CG 4.4Å; L295-F300 HydrophobicContact CD1-CZ 4.15Å; L295-F300 HydrophobicContact CG-CE1 4.43Å; L295-F300 HydrophobicContact CG-CZ 4.25Å; Y296-F300 WeakPolarHBondContact O-CD2 3.44Å; F300-F303 HydrophobicContact CD1-CD2 4.45Å; F300-F303 PolarHBondContact O-N 3.25Å; F300-F315 AromaticContact CE1-CD1 3.92Å; F300-F315 HydrophobicContact CE1-CD1 3.92Å; F300-F315 AromaticContact CE1-CE1 3.68Å; F300-F315 HydrophobicContact CE1-CE1 3.68Å; F300-F315 AromaticContact CZ-CD1 3.88Å; F300-F315 HydrophobicContact CZ-CD1 3.88Å; F300-F315 HydrophobicContact CZ-CE1 4.11Å; F300-V319 HydrophobicContact CZ-CG2 4.41Å; F300-V323 HydrophobicContact CB-CG2 3.46Å; F300-V323 VanDerWaalsContact CB-CG2 3.46Å; F300-V323 HydrophobicContact CD1-CG1 3.97Å; F300-V323 HydrophobicContact CD1-CG2 4.33Å; F300-V323 HydrophobicContact CD2-CG2 4.25Å; F300-V323 HydrophobicContact CE1-CG1 4.42Å; F300-V323 HydrophobicContact CG-CG1 4.25Å; F300-V323 HydrophobicContact CG-CG2 3.78Å; F300-R326 PolarHBondContact O-NH1 2.9Å; F300-R326 PolarHBondContact O-NH2 2.93Å
301	D	92.2	Very high	94.2	Very high	104 Å²	104	49.1 Å²	49.1	56%	0.556	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-42.9	-176.5	-97.5	-12	0	0	0	115.1	E299 F303 R305	E299-D301 PolarHBondContact O-N 3.14Å; D301-F303 PolarHBondContact O-N 3.1Å; D301-R305 PolarHBondContact O-NE 3.39Å; D301-R305 PolarHBondContact O-NH2 2.9Å; D301-R305 IonicContact OD1-NH2 3.79Å; D301-R305 PolarHBondContact OD1-NH2 3.16Å
302	P	94.3	Very high	94.2	Very high	28 Å²	28	50.7 Å²	50.7	18%	0.182	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-10.8	-179.6	25.9	-28	0	0	0	113.8	F269 T271 E299	F269-P302 HydrophobicContact CB-CG 3.78Å; T271-P302 WeakPolarHBondContact OG1-CB 3.45Å; E299-P302 WeakPolarHBondContact O-CD 3.46Å
303	F	96.8	Very high	94.2	Very high	11 Å²	11	47.5 Å²	47.5	5%	0.048	22%	0.216	C	C	.	.	S	Bend	trans	-94.2	156.2	-172.2	-59.6	-77.6	0	0	0	113.1	Y233 V259 F269 F293 L295 F300 D301 R305 R326	Y233-F303 HydrophobicContact CD1-CZ 4.29Å; Y233-F303 HydrophobicContact CD2-CE1 4.02Å; Y233-F303 HydrophobicContact CD2-CZ 4.48Å; Y233-F303 HydrophobicContact CE1-CE1 4.11Å; Y233-F303 AromaticContact CE1-CZ 3.98Å; Y233-F303 HydrophobicContact CE1-CZ 3.98Å; Y233-F303 AromaticContact CE2-CE1 3.55Å; Y233-F303 HydrophobicContact CE2-CE1 3.55Å; Y233-F303 HydrophobicContact CE2-CZ 4.22Å; Y233-F303 HydrophobicContact CG-CE1 4.49Å; Y233-F303 AromaticContact CZ-CE1 3.58Å; Y233-F303 AromaticContact CZ-CZ 3.94Å; V259-F303 HydrophobicContact CG1-CE1 4.11Å; V259-F303 HydrophobicContact CG1-CE2 4.21Å; V259-F303 HydrophobicContact CG1-CZ 3.53Å; F269-F303 HydrophobicContact CB-CE2 3.98Å; F269-F303 HydrophobicContact CB-CZ 3.92Å; F269-F303 HydrophobicContact CD1-CZ 4.26Å; F269-F303 HydrophobicContact CD2-CE2 4.04Å; F269-F303 HydrophobicContact CD2-CZ 4.43Å; F269-F303 AromaticContact CG-CE2 3.96Å; F269-F303 HydrophobicContact CG-CE2 3.96Å; F269-F303 AromaticContact CG-CZ 3.94Å; F269-F303 HydrophobicContact CG-CZ 3.94Å; F293-F303 HydrophobicContact CE1-CB 4.44Å; F293-F303 AromaticContact CE1-CD1 3.65Å; F293-F303 HydrophobicContact CE1-CD1 3.65Å; F293-F303 HydrophobicContact CE1-CD2 4.19Å; F293-F303 AromaticContact CE1-CE1 3.85Å; F293-F303 HydrophobicContact CE1-CE1 3.85Å; F293-F303 HydrophobicContact CE1-CE2 4.36Å; F293-F303 AromaticContact CE1-CG 3.83Å; F293-F303 HydrophobicContact CE1-CG 3.83Å; F293-F303 HydrophobicContact CE1-CZ 4.21Å; F293-F303 HydrophobicContact CZ-CD1 4.07Å; F293-F303 HydrophobicContact CZ-CE1 4.46Å; F293-F303 HydrophobicContact CZ-CG 4.45Å; L295-F303 HydrophobicContact CD1-CD2 4.18Å; L295-F303 HydrophobicContact CD1-CE2 3.72Å; L295-F303 HydrophobicContact CD1-CZ 4.47Å; F300-F303 HydrophobicContact CD1-CD2 4.45Å; F300-F303 PolarHBondContact O-N 3.25Å; D301-F303 PolarHBondContact O-N 3.1Å; F303-R305 PolarHBondContact O-N 2.98Å; F303-R326 PolarHBondContact O-NH1 3.27Å
304	F	97.1	Very high	94.3	Very high	7 Å²	7	50.7 Å²	50.7	3%	0.031	23%	0.229	C	C	.	.	S	Bend	trans	51.5	34.2	174.4	-49.6	-75.3	0	0	0	114.5	F293 I308 L313 F315 V323 R326 V327 T330	F293-F304 HydrophobicContact CE1-CE2 4.4Å; F293-F304 HydrophobicContact CE2-CE2 4.25Å; F293-F304 AromaticContact CE2-CZ 3.77Å; F293-F304 HydrophobicContact CE2-CZ 3.77Å; F293-F304 AromaticContact CZ-CE2 3.96Å; F293-F304 HydrophobicContact CZ-CE2 3.96Å; F293-F304 AromaticContact CZ-CZ 3.78Å; F293-F304 HydrophobicContact CZ-CZ 3.78Å; F304-I308 HydrophobicContact CD1-CD1 3.52Å; F304-I308 HydrophobicContact CD1-CG1 4.4Å; F304-I308 HydrophobicContact CE1-CD1 3.53Å; F304-L313 HydrophobicContact CE1-CD1 3.8Å; F304-L313 HydrophobicContact CE1-CD2 4.14Å; F304-L313 HydrophobicContact CZ-CD1 4.08Å; F304-L313 HydrophobicContact CZ-CD2 4.09Å; F304-F315 HydrophobicContact CE2-CE1 4.09Å; F304-F315 AromaticContact CE2-CZ 3.98Å; F304-F315 HydrophobicContact CE2-CZ 3.98Å; F304-F315 HydrophobicContact CZ-CE1 4.31Å; F304-F315 AromaticContact CZ-CZ 3.87Å; F304-F315 HydrophobicContact CZ-CZ 3.87Å; F304-V323 HydrophobicContact CD2-CG1 3.97Å; F304-V323 HydrophobicContact CE2-CG1 4.12Å; F304-R326 HydrophobicContact CB-CB 3.83Å; F304-V327 HydrophobicContact CD1-CG2 3.78Å; F304-V327 HydrophobicContact CD2-CG2 4.14Å; F304-V327 HydrophobicContact CE1-CG2 3.7Å; F304-V327 HydrophobicContact CE2-CG2 4.07Å; F304-V327 HydrophobicContact CG-CG2 4Å; F304-V327 HydrophobicContact CZ-CG2 3.86Å; F304-T330 WeakPolarHBondContact O-CG2 3.44Å
305	R	96.1	Very high	94.4	Very high	141 Å²	141	47.7 Å²	47.7	53%	0.532	22%	0.216	S	C	.	.	S	Bend	trans	-82.8	-20.1	178.5	-68.8	-66.6	-175.4	-171.3	-5.5	113.6	D301 F303 R326	D301-R305 PolarHBondContact O-NE 3.39Å; D301-R305 PolarHBondContact O-NH2 2.9Å; D301-R305 IonicContact OD1-NH2 3.79Å; D301-R305 PolarHBondContact OD1-NH2 3.16Å; F303-R305 PolarHBondContact O-N 2.98Å; R305-R326 VanDerWaalsContact CZ-NH1 3.34Å
306	Y	96.3	Very high	94.5	Very high	55 Å²	55	48.6 Å²	48.6	22%	0.216	23%	0.225	C	C	.	.	S	Bend	trans	-152.9	172.4	-179.2	52	-105.7	0	0	0	109	I272 K274 W277 I308 T330	I272-Y306 PolarHBondContact O-OH 3.04Å; K274-Y306 HydrophobicContact CB-CD1 4.21Å; K274-Y306 HydrophobicContact CB-CD2 3.76Å; K274-Y306 HydrophobicContact CB-CE1 4.23Å; K274-Y306 HydrophobicContact CB-CE2 3.82Å; K274-Y306 HydrophobicContact CB-CG 4Å; K274-Y306 HydrophobicContact CD-CD2 4.08Å; K274-Y306 HydrophobicContact CD-CG 4.13Å; K274-Y306 HydrophobicContact CG-CD2 3.92Å; K274-Y306 HydrophobicContact CG-CE2 4.3Å; K274-Y306 HydrophobicContact CG-CG 4.33Å; W277-Y306 AromaticContact CD1-CE2 3.65Å; Y306-I308 HydrophobicContact CD2-CG2 4.18Å; Y306-I308 HydrophobicContact CE2-CG2 3.85Å; Y306-I308 PolarHBondContact O-N 2.71Å; Y306-T330 VanDerWaalsContact O-CB 3.29Å; Y306-T330 WeakPolarHBondContact O-CB 3.1Å; Y306-T330 WeakPolarHBondContact O-CG2 3.39Å
307	E	96.1	Very high	94.6	Very high	114 Å²	114	48 Å²	48	53%	0.533	22%	0.222	S	C	.	.			trans	-58.6	123.2	-179.2	-171.6	178.7	136.6	0	0	112.3	T330 P332	E307-T330 VanDerWaalsContact CA-O 3.31Å; E307-T330 WeakPolarHBondContact CA-O 3.32Å; E307-P332 HydrophobicContact CG-CG 3.88Å
308	I	95.5	Very high	95.1	Very high	14 Å²	14	44.7 Å²	44.7	7%	0.072	21%	0.212	C	C	.	.			trans	-119.1	147.5	176.9	56.9	171.4	0	0	0	110.5	F304 Y306 A310 T330	F304-I308 HydrophobicContact CD1-CD1 3.52Å; F304-I308 HydrophobicContact CD1-CG1 4.4Å; F304-I308 HydrophobicContact CE1-CD1 3.53Å; Y306-I308 HydrophobicContact CD2-CG2 4.18Å; Y306-I308 HydrophobicContact CE2-CG2 3.85Å; Y306-I308 PolarHBondContact O-N 2.71Å; I308-A310 HydrophobicContact CD1-CB 3.77Å; I308-A310 HydrophobicContact CG1-CB 3.96Å; I308-A310 PolarHBondContact O-N 3.33Å; I308-T330 PolarHBondContact N-O 3.29Å
309	P	97.2	Very high	95.6	Very high	8 Å²	8	36.8 Å²	36.8	5%	0.052	18%	0.176	C	C	.	.			trans	-78.9	27	-178.1	32.8	-35.1	0	0	0	113.2	W277 F280 I281 L289 R333	W277-P309 HydrophobicContact CE3-CG 3.77Å; W277-P309 HydrophobicContact CZ3-CG 4.41Å; F280-P309 HydrophobicContact CD1-CG 4.31Å; I281-P309 HydrophobicContact CB-CB 4.11Å; I281-P309 HydrophobicContact CD1-CB 3.9Å; I281-P309 HydrophobicContact CG1-CB 4.14Å; L289-P309 HydrophobicContact CD2-CG 3.99Å; P309-R333 PolarHBondContact O-NH1 3.14Å
310	A	98.4	Very high	95.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	134.5	-177.7	0	0	0	0	0	111.2	L289 I308 L313 R333 L334	L289-A310 HydrophobicContact CD2-CB 4.4Å; I308-A310 HydrophobicContact CD1-CB 3.77Å; I308-A310 HydrophobicContact CG1-CB 3.96Å; I308-A310 PolarHBondContact O-N 3.33Å; A310-L313 HydrophobicContact CB-CD2 4.03Å; A310-L313 HydrophobicContact CB-CG 4.43Å; A310-R333 CarbonylContact O-C 3.59Å; A310-L334 PolarHBondContact O-N 3.44Å
311	T	98.8	Very high	95.8	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.018	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	-35.9	-178.4	57.5	0	0	0	0	112.1	N288 L289 R333 V335 E336	N288-T311 WeakPolarHBondContact CA-OG1 3.35Å; L289-T311 VanDerWaalsContact C-OG1 3.31Å; L289-T311 PolarHBondContact N-OG1 2.67Å; L289-T311 PolarHBondContact O-N 3.36Å; L289-T311 PolarHBondContact O-OG1 2.85Å; T311-R333 HydrophobicContact CG2-CB 4.28Å; T311-V335 WeakPolarHBondContact O-CA 3.44Å; T311-V335 WeakPolarHBondContact O-CB 3.42Å; T311-V335 PolarHBondContact O-N 3.23Å; T311-E336 PolarHBondContact O-N 2.87Å; T311-E336 VanDerWaalsContact O-N 3.15Å
312	H	98.9	Very high	96	Very high	39 Å²	39	39 Å²	39	18%	0.181	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	124.9	179.4	-54.6	70.5	0	0	0	108.2	L289 V290 M291 E336	L289-H312 PolarHBondContact O-N 3.32Å; L289-H312 VanDerWaalsContact O-N 3.08Å; V290-H312 WeakPolarHBondContact CA-O 3.3Å; V290-H312 HydrophobicContact CB-CB 4.29Å; V290-H312 HydrophobicContact CG1-CB 4.1Å; V290-H312 HydrophobicContact CG2-CB 3.95Å; M291-H312 PolarHBondContact N-O 3.27Å; H312-E336 WeakPolarHBondContact CA-O 3.18Å; H312-E336 HydrophobicContact CB-CB 4.37Å; H312-E336 IonicContact CD2-OE2 3.48Å; H312-E336 PolarHBondContact CD2-OE2 3.45Å
313	L	98.8	Very high	96.1	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.016	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	130	179.4	-66.3	178.9	0	0	0	109.7	M291 F293 F304 A310 F315 V327 L334 E336 L337 V338	M291-L313 HydrophobicContact CB-CD2 3.93Å; F293-L313 HydrophobicContact CE2-CD2 4.04Å; F304-L313 HydrophobicContact CE1-CD1 3.8Å; F304-L313 HydrophobicContact CE1-CD2 4.14Å; F304-L313 HydrophobicContact CZ-CD1 4.08Å; F304-L313 HydrophobicContact CZ-CD2 4.09Å; A310-L313 HydrophobicContact CB-CD2 4.03Å; A310-L313 HydrophobicContact CB-CG 4.43Å; L313-F315 HydrophobicContact CB-CE2 4.09Å; L313-F315 HydrophobicContact CD1-CE2 4.42Å; L313-V327 HydrophobicContact CD1-CG1 3.7Å; L313-V327 HydrophobicContact CD1-CG2 4.14Å; L313-L334 HydrophobicContact CB-CD1 4.1Å; L313-L334 HydrophobicContact CD1-CD1 3.65Å; L313-L334 HydrophobicContact CG-CD1 3.62Å; L313-E336 PolarHBondContact N-O 3Å; L313-L337 HydrophobicContact CB-CD1 3.9Å; L313-L337 WeakPolarHBondContact O-CA 3.49Å; L313-V338 PolarHBondContact O-N 3.06Å
314	Y	98.6	Very high	96.1	Very high	69 Å²	69	37.5 Å²	37.5	27%	0.271	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	121.1	172.9	177.1	-99.2	0	0	0	109.1	M291 Y292 F293 F294 V338 C340	M291-Y314 PolarHBondContact O-N 3.49Å; Y292-Y314 CarbonylContact C-O 3.51Å; Y292-Y314 WeakPolarHBondContact CA-O 3.34Å; Y292-Y314 HydrophobicContact CD1-CD1 4.35Å; Y292-Y314 HydrophobicContact CD1-CG 4.2Å; Y292-Y314 HydrophobicContact CD2-CD1 4.37Å; Y292-Y314 HydrophobicContact CE1-CG 4.39Å; Y292-Y314 HydrophobicContact CG-CD1 4.11Å; Y292-Y314 HydrophobicContact CG-CG 4.42Å; F293-Y314 PolarHBondContact N-O 3.15Å; F294-Y314 AromaticContact CE1-CE1 3.84Å; F294-Y314 HydrophobicContact CE1-CE1 3.84Å; F294-Y314 HydrophobicContact CZ-CD1 4.12Å; F294-Y314 AromaticContact CZ-CE1 3.7Å; F294-Y314 HydrophobicContact CZ-CE1 3.7Å; Y314-V338 WeakPolarHBondContact CA-O 3.4Å; Y314-V338 HydrophobicContact CD2-CB 3.71Å; Y314-V338 HydrophobicContact CD2-CG1 3.59Å; Y314-V338 HydrophobicContact CE2-CB 4.35Å; Y314-V338 HydrophobicContact CE2-CG1 3.7Å; Y314-C340 PolarHBondContact OH-SG 2.74Å
315	F	97.8	Very high	96.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	94	172.4	-61.7	-86	0	0	0	108.2	F293 F300 F304 L313 R317 V319 V323 L324 V327 L337 V338 V339 C340	F293-F315 HydrophobicContact CB-CD1 3.89Å; F293-F315 HydrophobicContact CB-CE1 4.3Å; F293-F315 HydrophobicContact CD2-CD1 4.35Å; F293-F315 HydrophobicContact CD2-CE1 4.05Å; F293-F315 HydrophobicContact CG-CD1 4.27Å; F293-F315 HydrophobicContact CG-CE1 4.18Å; F300-F315 AromaticContact CE1-CD1 3.92Å; F300-F315 HydrophobicContact CE1-CD1 3.92Å; F300-F315 AromaticContact CE1-CE1 3.68Å; F300-F315 HydrophobicContact CE1-CE1 3.68Å; F300-F315 AromaticContact CZ-CD1 3.88Å; F300-F315 HydrophobicContact CZ-CD1 3.88Å; F300-F315 HydrophobicContact CZ-CE1 4.11Å; F304-F315 HydrophobicContact CE2-CE1 4.09Å; F304-F315 AromaticContact CE2-CZ 3.98Å; F304-F315 HydrophobicContact CE2-CZ 3.98Å; F304-F315 HydrophobicContact CZ-CE1 4.31Å; F304-F315 AromaticContact CZ-CZ 3.87Å; F304-F315 HydrophobicContact CZ-CZ 3.87Å; L313-F315 HydrophobicContact CB-CE2 4.09Å; L313-F315 HydrophobicContact CD1-CE2 4.42Å; F315-R317 PolarHBondContact O-N 3.06Å; F315-V319 HydrophobicContact CB-CB 4.07Å; F315-V319 HydrophobicContact CB-CG1 4.18Å; F315-V319 HydrophobicContact CD1-CB 3.76Å; F315-V319 HydrophobicContact CD1-CG1 4.45Å; F315-V319 HydrophobicContact CD1-CG2 3.58Å; F315-V319 HydrophobicContact CD2-CG1 4.48Å; F315-V319 HydrophobicContact CE1-CB 4.36Å; F315-V319 HydrophobicContact CE1-CG2 3.65Å; F315-V319 HydrophobicContact CG-CB 3.91Å; F315-V319 HydrophobicContact CG-CG1 4.13Å; F315-V319 HydrophobicContact CG-CG2 4.06Å; F315-V319 HydrophobicContact CZ-CG2 4.19Å; F315-V323 HydrophobicContact CE1-CG1 4.25Å; F315-V323 HydrophobicContact CZ-CG1 4.5Å; F315-L324 HydrophobicContact CE2-CD2 4.23Å; F315-V327 HydrophobicContact CE2-CG2 4.5Å; F315-V327 HydrophobicContact CZ-CG2 4.01Å; F315-L337 HydrophobicContact CD2-CD1 3.94Å; F315-L337 HydrophobicContact CE2-CD1 3.65Å; F315-V338 PolarHBondContact N-O 3.01Å; F315-V339 HydrophobicContact CD2-CG2 3.95Å; F315-C340 WeakPolarHBondContact O-CB 3.29Å; F315-C340 PolarHBondContact O-N 2.85Å; F315-C340 PolarHBondContact O-SG 2.78Å
316	G	95.1	Very high	96.1	Very high	20 Å²	20	33.1 Å²	33.1	21%	0.206	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	0.3	-177.4	0	0	0	0	0	114.6	F293	F293-G316 PolarHBondContact O-N 2.81Å
317	R	91.8	Very high	96.2	Very high	89 Å²	89	30.5 Å²	30.5	34%	0.336	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	178.8	170.2	-71.9	-168.2	176.7	166.2	0.3	108.3	L295 Y296 F315 V319	L295-R317 VanDerWaalsContact O-CB 3.24Å; L295-R317 WeakPolarHBondContact O-CB 3.44Å; L295-R317 WeakPolarHBondContact O-CD 3.34Å; Y296-R317 PolarHBondContact OH-NH1 2.92Å; F315-R317 PolarHBondContact O-N 3.06Å; R317-V319 PolarHBondContact O-N 3.05Å
318	S	89.7	Confident	96.3	Very high	52 Å²	52	25 Å²	25	36%	0.364	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	131.2	176.9	-173.1	0	0	0	0	111.8	A341	S318-A341 WeakPolarHBondContact CA-O 3.41Å
319	V	94.2	Very high	96.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	142.4	172.6	66	0	0	0	0	109.2	F300 F315 R317 V323 L324 V339 A341 N342	F300-V319 HydrophobicContact CZ-CG2 4.41Å; F315-V319 HydrophobicContact CB-CB 4.07Å; F315-V319 HydrophobicContact CB-CG1 4.18Å; F315-V319 HydrophobicContact CD1-CB 3.76Å; F315-V319 HydrophobicContact CD1-CG1 4.45Å; F315-V319 HydrophobicContact CD1-CG2 3.58Å; F315-V319 HydrophobicContact CD2-CG1 4.48Å; F315-V319 HydrophobicContact CE1-CB 4.36Å; F315-V319 HydrophobicContact CE1-CG2 3.65Å; F315-V319 HydrophobicContact CG-CB 3.91Å; F315-V319 HydrophobicContact CG-CG1 4.13Å; F315-V319 HydrophobicContact CG-CG2 4.06Å; F315-V319 HydrophobicContact CZ-CG2 4.19Å; R317-V319 PolarHBondContact O-N 3.05Å; V319-V323 HydrophobicContact CG2-CB 3.7Å; V319-V323 HydrophobicContact CG2-CG1 3.49Å; V319-V323 VanDerWaalsContact CG2-CG1 3.49Å; V319-L324 HydrophobicContact CG1-CD1 3.88Å; V319-L324 HydrophobicContact CG1-CD2 4.07Å; V319-L324 HydrophobicContact CG1-CG 3.9Å; V319-L324 HydrophobicContact CG2-CD2 4.4Å; V319-L324 HydrophobicContact CG2-CG 4.21Å; V319-V339 HydrophobicContact CG1-CB 4.49Å; V319-V339 HydrophobicContact CG1-CG1 3.47Å; V319-V339 VanDerWaalsContact CG1-CG1 3.47Å; V319-V339 HydrophobicContact CG1-CG2 4.25Å; V319-A341 PolarHBondContact N-O 3.38Å; V319-A341 VanDerWaalsContact N-O 3.08Å; V319-N342 PolarHBondContact O-ND2 2.78Å
320	S	93.6	Very high	96.4	Very high	11 Å²	11	29 Å²	29	8%	0.077	15%	0.147	C	C	.	.			trans	-80.6	157.2	179.6	78.1	0	0	0	0	113.1	E297 D322 V323 L324	E297-S320 WeakPolarHBondContact OE1-CB 3.3Å; S320-D322 PolarHBondContact O-N 2.78Å; S320-V323 PolarHBondContact O-N 3.16Å; S320-V323 VanDerWaalsContact OG-CG2 3.27Å; S320-V323 WeakPolarHBondContact OG-CG2 3.4Å; S320-V323 PolarHBondContact OG-N 2.86Å; S320-L324 PolarHBondContact O-N 2.79Å; S320-L324 VanDerWaalsContact O-N 3.1Å
321	K	95.5	Very high	96.4	Very high	45 Å²	45	29 Å²	29	20%	0.196	15%	0.147	C	C	.	.	H	α-helix	trans	-55.6	-40.7	173.1	-179.4	-179.4	171.5	81.8	0	111.3	V323 L324 G325 N342 R345 P346 L347 E350	K321-V323 PolarHBondContact O-N 3.3Å; K321-L324 PolarHBondContact O-N 3.38Å; K321-G325 PolarHBondContact O-N 2.67Å; K321-N342 PolarHBondContact N-ND2 3.39Å; K321-R345 HydrophobicContact CD-CB 3.99Å; K321-P346 PolarHBondContact NZ-O 2.58Å; K321-L347 HydrophobicContact CB-CD2 4.01Å; K321-L347 HydrophobicContact CG-CD2 3.97Å; K321-E350 VanDerWaalsContact CE-OE2 3.29Å; K321-E350 WeakPolarHBondContact CE-OE2 3.39Å; K321-E350 HydrophobicContact CG-CG 4.21Å; K321-E350 WeakPolarHBondContact CG-OE2 3.41Å; K321-E350 IonicContact NZ-OE2 2.67Å; K321-E350 PolarHBondContact NZ-OE2 2.95Å
322	D	94.8	Very high	96.3	Very high	111 Å²	111	31.1 Å²	31.1	59%	0.594	16%	0.161	S	C	*	.	H	α-helix	trans	-66.4	-37.6	-179.7	-62.8	-41.8	0	0	0	112.3	S320 G325 R326	S320-D322 PolarHBondContact O-N 2.78Å; D322-G325 PolarHBondContact O-N 2.74Å; D322-R326 WeakPolarHBondContact O-CG 3.2Å; D322-R326 PolarHBondContact O-N 3.32Å
323	V	96.3	Very high	96.3	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-64.6	-46.5	174.2	174.3	0	0	0	0	110.5	F300 F304 F315 V319 S320 K321 G325 R326 V327	F300-V323 HydrophobicContact CB-CG2 3.46Å; F300-V323 VanDerWaalsContact CB-CG2 3.46Å; F300-V323 HydrophobicContact CD1-CG1 3.97Å; F300-V323 HydrophobicContact CD1-CG2 4.33Å; F300-V323 HydrophobicContact CD2-CG2 4.25Å; F300-V323 HydrophobicContact CE1-CG1 4.42Å; F300-V323 HydrophobicContact CG-CG1 4.25Å; F300-V323 HydrophobicContact CG-CG2 3.78Å; F304-V323 HydrophobicContact CD2-CG1 3.97Å; F304-V323 HydrophobicContact CE2-CG1 4.12Å; F315-V323 HydrophobicContact CE1-CG1 4.25Å; F315-V323 HydrophobicContact CZ-CG1 4.5Å; V319-V323 HydrophobicContact CG2-CB 3.7Å; V319-V323 HydrophobicContact CG2-CG1 3.49Å; V319-V323 VanDerWaalsContact CG2-CG1 3.49Å; S320-V323 PolarHBondContact O-N 3.16Å; S320-V323 VanDerWaalsContact OG-CG2 3.27Å; S320-V323 WeakPolarHBondContact OG-CG2 3.4Å; S320-V323 PolarHBondContact OG-N 2.86Å; K321-V323 PolarHBondContact O-N 3.3Å; V323-G325 VanDerWaalsContact C-N 3.27Å; V323-G325 PolarHBondContact O-N 3.09Å; V323-R326 CarbonylContact O-C 3.58Å; V323-R326 WeakPolarHBondContact O-CB 3.33Å; V323-R326 PolarHBondContact O-N 3.29Å; V323-R326 VanDerWaalsContact O-N 3.12Å; V323-V327 WeakPolarHBondContact O-CG2 3.24Å; V323-V327 PolarHBondContact O-N 3.18Å
324	L	97.1	Very high	96.3	Very high	5 Å²	5	31.7 Å²	31.7	3%	0.026	16%	0.161	C	C	.	.	H	α-helix	trans	-62.7	-35.4	175.8	-70.4	174.3	0	0	0	112.3	F315 V319 S320 K321 R326 V327 G328 V339 L347 E350	F315-L324 HydrophobicContact CE2-CD2 4.23Å; V319-L324 HydrophobicContact CG1-CD1 3.88Å; V319-L324 HydrophobicContact CG1-CD2 4.07Å; V319-L324 HydrophobicContact CG1-CG 3.9Å; V319-L324 HydrophobicContact CG2-CD2 4.4Å; V319-L324 HydrophobicContact CG2-CG 4.21Å; S320-L324 PolarHBondContact O-N 2.79Å; S320-L324 VanDerWaalsContact O-N 3.1Å; K321-L324 PolarHBondContact O-N 3.38Å; L324-R326 VanDerWaalsContact C-N 3.35Å; L324-R326 PolarHBondContact O-N 2.83Å; L324-V327 WeakPolarHBondContact O-CB 3.22Å; L324-V327 PolarHBondContact O-N 3.15Å; L324-G328 PolarHBondContact O-N 2.88Å; L324-V339 HydrophobicContact CD1-CG2 4.47Å; L324-V339 HydrophobicContact CD2-CG2 3.85Å; L324-L347 HydrophobicContact CD1-CD1 3.6Å; L324-L347 HydrophobicContact CD1-CD2 3.79Å; L324-L347 HydrophobicContact CD1-CG 4.33Å; L324-E350 HydrophobicContact CB-CB 4.22Å; L324-E350 HydrophobicContact CB-CG 3.96Å
325	G	96.8	Very high	96.3	Very high	9 Å²	9	30.3 Å²	30.3	9%	0.093	16%	0.16	C	C	.	.	H	α-helix	trans	-60.6	-44.3	172.3	0	0	0	0	0	112.2	K321 D322 V323 G328 M329 R353	K321-G325 PolarHBondContact O-N 2.67Å; D322-G325 PolarHBondContact O-N 2.74Å; V323-G325 VanDerWaalsContact C-N 3.27Å; V323-G325 PolarHBondContact O-N 3.09Å; G325-G328 PolarHBondContact O-N 3.31Å; G325-M329 WeakPolarHBondContact O-CG 2.99Å; G325-M329 PolarHBondContact O-N 3.44Å; G325-R353 VanDerWaalsContact CA-NH1 3.34Å
326	R	97.6	Very high	96.4	Very high	47 Å²	47	34 Å²	34	18%	0.177	18%	0.177	C	C	.	.	H	α-helix	trans	-63.5	-40.8	172.7	-71.9	-172.4	-70	166.1	-6.3	112.3	F300 F303 F304 R305 D322 V323 L324 G328 M329 T330	F300-R326 PolarHBondContact O-NH1 2.9Å; F300-R326 PolarHBondContact O-NH2 2.93Å; F303-R326 PolarHBondContact O-NH1 3.27Å; F304-R326 HydrophobicContact CB-CB 3.83Å; R305-R326 VanDerWaalsContact CZ-NH1 3.34Å; D322-R326 WeakPolarHBondContact O-CG 3.2Å; D322-R326 PolarHBondContact O-N 3.32Å; V323-R326 CarbonylContact O-C 3.58Å; V323-R326 WeakPolarHBondContact O-CB 3.33Å; V323-R326 PolarHBondContact O-N 3.29Å; V323-R326 VanDerWaalsContact O-N 3.12Å; L324-R326 VanDerWaalsContact C-N 3.35Å; L324-R326 PolarHBondContact O-N 2.83Å; R326-G328 VanDerWaalsContact C-N 3.34Å; R326-G328 PolarHBondContact O-N 2.81Å; R326-M329 PolarHBondContact O-N 2.98Å; R326-T330 WeakPolarHBondContact O-CB 3.11Å; R326-T330 WeakPolarHBondContact O-CG2 3.33Å; R326-T330 PolarHBondContact O-N 3.18Å; R326-T330 PolarHBondContact O-OG1 3.05Å
327	V	98	Very high	96.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-55.3	-50.2	175.2	169.2	0	0	0	0	110.5	F304 L313 F315 V323 L324 M329 T330 C331 L334	F304-V327 HydrophobicContact CD1-CG2 3.78Å; F304-V327 HydrophobicContact CD2-CG2 4.14Å; F304-V327 HydrophobicContact CE1-CG2 3.7Å; F304-V327 HydrophobicContact CE2-CG2 4.07Å; F304-V327 HydrophobicContact CG-CG2 4Å; F304-V327 HydrophobicContact CZ-CG2 3.86Å; L313-V327 HydrophobicContact CD1-CG1 3.7Å; L313-V327 HydrophobicContact CD1-CG2 4.14Å; F315-V327 HydrophobicContact CE2-CG2 4.5Å; F315-V327 HydrophobicContact CZ-CG2 4.01Å; V323-V327 WeakPolarHBondContact O-CG2 3.24Å; V323-V327 PolarHBondContact O-N 3.18Å; L324-V327 WeakPolarHBondContact O-CB 3.22Å; L324-V327 PolarHBondContact O-N 3.15Å; V327-M329 PolarHBondContact O-N 3.39Å; V327-M329 VanDerWaalsContact O-N 3.14Å; V327-T330 PolarHBondContact O-N 2.66Å; V327-T330 VanDerWaalsContact O-N 3.08Å; V327-C331 HydrophobicContact CG1-CB 4.24Å; V327-C331 WeakPolarHBondContact O-CB 3.06Å; V327-C331 PolarHBondContact O-N 2.71Å; V327-L334 HydrophobicContact CG1-CD2 4.06Å
328	G	97.3	Very high	96.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57.8	-29.7	177.6	0	0	0	0	0	113.6	L324 G325 R326 R357	L324-G328 PolarHBondContact O-N 2.88Å; G325-G328 PolarHBondContact O-N 3.31Å; R326-G328 VanDerWaalsContact C-N 3.34Å; R326-G328 PolarHBondContact O-N 2.81Å; G328-R357 WeakPolarHBondContact O-CB 3.25Å; G328-R357 WeakPolarHBondContact O-CD 3.39Å
329	M	97.7	Very high	97.2	Very high	94 Å²	94	28.1 Å²	28.1	46%	0.463	15%	0.145	S	C	.	.	H	α-helix	trans	-85.3	-24.8	177.8	-66.8	-58.2	-64.7	0	0	114.4	G325 R326 V327 R353 R357	G325-M329 WeakPolarHBondContact O-CG 2.99Å; G325-M329 PolarHBondContact O-N 3.44Å; R326-M329 PolarHBondContact O-N 2.98Å; V327-M329 PolarHBondContact O-N 3.39Å; V327-M329 VanDerWaalsContact O-N 3.14Å; M329-R353 HydrophobicContact SD-CG 4.2Å; M329-R357 PolarHBondContact SD-NE 3.42Å; M329-R357 VanDerWaalsContact SD-NE 3.42Å
330	T	97.9	Very high	97.1	Very high	11 Å²	11	30.1 Å²	30.1	7%	0.067	16%	0.159	C	C	.	.	H	α-helix	trans	-118.2	-8.5	-164.8	57.2	0	0	0	0	115	F304 Y306 E307 I308 R326 V327 P332	F304-T330 WeakPolarHBondContact O-CG2 3.44Å; Y306-T330 VanDerWaalsContact O-CB 3.29Å; Y306-T330 WeakPolarHBondContact O-CB 3.1Å; Y306-T330 WeakPolarHBondContact O-CG2 3.39Å; E307-T330 VanDerWaalsContact CA-O 3.31Å; E307-T330 WeakPolarHBondContact CA-O 3.32Å; I308-T330 PolarHBondContact N-O 3.29Å; R326-T330 WeakPolarHBondContact O-CB 3.11Å; R326-T330 WeakPolarHBondContact O-CG2 3.33Å; R326-T330 PolarHBondContact O-N 3.18Å; R326-T330 PolarHBondContact O-OG1 3.05Å; V327-T330 PolarHBondContact O-N 2.66Å; V327-T330 VanDerWaalsContact O-N 3.08Å; T330-P332 WeakPolarHBondContact O-CD 3.29Å
331	C	98.2	Very high	97	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.007	16%	0.16	C	C	.	.			trans	-117.9	64.2	-174.6	-61.1	0	0	0	0	112.7	V327 R333 L334 C358	V327-C331 HydrophobicContact CG1-CB 4.24Å; V327-C331 WeakPolarHBondContact O-CB 3.06Å; V327-C331 PolarHBondContact O-N 2.71Å; C331-R333 PolarHBondContact O-N 3.1Å; C331-R333 VanDerWaalsContact O-N 3.11Å; C331-L334 HydrophobicContact CB-CB 4.25Å; C331-L334 WeakPolarHBondContact O-CB 3.32Å; C331-L334 PolarHBondContact O-N 3.13Å; C331-L334 VanDerWaalsContact O-N 3.15Å; C331-C358 PolarHBondContact O-SG 3.48Å
332	P	97.5	Very high	96.7	Very high	47 Å²	47	28.7 Å²	28.7	31%	0.305	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.3	-176	28.1	-35.7	0	0	0	113.8	E307 T330	E307-P332 HydrophobicContact CG-CG 3.88Å; T330-P332 WeakPolarHBondContact O-CD 3.29Å
333	R	98.2	Very high	96	Very high	54 Å²	54	25.3 Å²	25.3	20%	0.204	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	6.1	179.5	-63	-175.3	70.3	-133.8	1.9	113.8	P285 V287 P309 A310 T311 C331 V335	P285-R333 PolarHBondContact O-NH2 3.28Å; P285-R333 VanDerWaalsContact O-NH2 3.11Å; V287-R333 PolarHBondContact O-NH1 2.66Å; V287-R333 PolarHBondContact O-NH2 2.63Å; P309-R333 PolarHBondContact O-NH1 3.14Å; A310-R333 CarbonylContact O-C 3.59Å; T311-R333 HydrophobicContact CG2-CB 4.28Å; C331-R333 PolarHBondContact O-N 3.1Å; C331-R333 VanDerWaalsContact O-N 3.11Å; R333-V335 PolarHBondContact O-N 3.28Å
334	L	98.7	Very high	95.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.183	C	C	.	.			trans	-59.6	127.2	-176.1	-163.9	65.3	0	0	0	111.3	A310 L313 V327 C331 E336 L337 I354 C358 N360 L361	A310-L334 PolarHBondContact O-N 3.44Å; L313-L334 HydrophobicContact CB-CD1 4.1Å; L313-L334 HydrophobicContact CD1-CD1 3.65Å; L313-L334 HydrophobicContact CG-CD1 3.62Å; V327-L334 HydrophobicContact CG1-CD2 4.06Å; C331-L334 HydrophobicContact CB-CB 4.25Å; C331-L334 WeakPolarHBondContact O-CB 3.32Å; C331-L334 PolarHBondContact O-N 3.13Å; C331-L334 VanDerWaalsContact O-N 3.15Å; L334-E336 WeakPolarHBondContact CD1-O 3.5Å; L334-L337 HydrophobicContact CD2-CB 4.04Å; L334-L337 HydrophobicContact CD2-CD2 4.35Å; L334-I354 HydrophobicContact CD2-CG2 4.38Å; L334-C358 HydrophobicContact CB-CB 3.97Å; L334-N360 CarbonylContact O-C 3.29Å; L334-N360 VanDerWaalsContact O-C 3.22Å; L334-L361 HydrophobicContact CD2-CD1 4.19Å; L334-L361 HydrophobicContact CG-CD1 4.05Å; L334-L361 VanDerWaalsContact O-CA 3.29Å; L334-L361 WeakPolarHBondContact O-CA 3.44Å; L334-L361 PolarHBondContact O-N 2.76Å
335	V	98.6	Very high	94.8	Very high	39 Å²	39	40.4 Å²	40.4	24%	0.236	21%	0.212	C	C	.	.			trans	-111.1	-41.6	179.9	177.3	0	0	0	0	110	T311 R333 N360 S362 A363	T311-V335 WeakPolarHBondContact O-CA 3.44Å; T311-V335 WeakPolarHBondContact O-CB 3.42Å; T311-V335 PolarHBondContact O-N 3.23Å; R333-V335 PolarHBondContact O-N 3.28Å; V335-N360 HydrophobicContact CG2-CB 4.33Å; V335-S362 WeakPolarHBondContact CG1-OG 3.41Å; V335-S362 PolarHBondContact O-N 3.32Å; V335-S362 PolarHBondContact O-OG 2.99Å; V335-A363 PolarHBondContact O-N 3.49Å; V335-A363 VanDerWaalsContact O-N 3.08Å
336	E	98.8	Very high	94.7	Very high	77 Å²	77	42.7 Å²	42.7	36%	0.36	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	134.8	178.7	-177.8	168	-153.6	0	0	110.9	T311 H312 L313 L334 V338 A363	T311-E336 PolarHBondContact O-N 2.87Å; T311-E336 VanDerWaalsContact O-N 3.15Å; H312-E336 WeakPolarHBondContact CA-O 3.18Å; H312-E336 HydrophobicContact CB-CB 4.37Å; H312-E336 IonicContact CD2-OE2 3.48Å; H312-E336 PolarHBondContact CD2-OE2 3.45Å; L313-E336 PolarHBondContact N-O 3Å; L334-E336 WeakPolarHBondContact CD1-O 3.5Å; E336-V338 HydrophobicContact CG-CG2 4.17Å; E336-A363 WeakPolarHBondContact CA-O 3.36Å; E336-A363 HydrophobicContact CB-CB 3.97Å; E336-A363 HydrophobicContact CG-CB 3.71Å
337	L	98.6	Very high	94.7	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	122.3	172.7	174.4	61.1	0	0	0	109.7	L313 F315 L334 V339 I354 L361 A363 I364 G365	L313-L337 HydrophobicContact CB-CD1 3.9Å; L313-L337 WeakPolarHBondContact O-CA 3.49Å; F315-L337 HydrophobicContact CD2-CD1 3.94Å; F315-L337 HydrophobicContact CE2-CD1 3.65Å; L334-L337 HydrophobicContact CD2-CB 4.04Å; L334-L337 HydrophobicContact CD2-CD2 4.35Å; L337-V339 HydrophobicContact CD1-CG2 4.03Å; L337-V339 HydrophobicContact CG-CG2 4.21Å; L337-I354 HydrophobicContact CD2-CD1 3.78Å; L337-L361 HydrophobicContact CB-CD1 4.24Å; L337-A363 PolarHBondContact N-O 3.25Å; L337-A363 VanDerWaalsContact N-O 3.13Å; L337-I364 HydrophobicContact CB-CG1 4.44Å; L337-I364 CarbonylContact O-C 3.09Å; L337-I364 VanDerWaalsContact O-CA 3.26Å; L337-I364 WeakPolarHBondContact O-CA 3.25Å; L337-G365 PolarHBondContact O-N 3.31Å
338	V	98.4	Very high	94.7	Very high	35 Å²	35	42.5 Å²	42.5	21%	0.212	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125.9	173.6	178.8	0	0	0	0	109.1	L313 Y314 F315 E336 G365	L313-V338 PolarHBondContact O-N 3.06Å; Y314-V338 WeakPolarHBondContact CA-O 3.4Å; Y314-V338 HydrophobicContact CD2-CB 3.71Å; Y314-V338 HydrophobicContact CD2-CG1 3.59Å; Y314-V338 HydrophobicContact CE2-CB 4.35Å; Y314-V338 HydrophobicContact CE2-CG1 3.7Å; F315-V338 PolarHBondContact N-O 3.01Å; E336-V338 HydrophobicContact CG-CG2 4.17Å; V338-G365 CarbonylContact C-O 3.42Å; V338-G365 WeakPolarHBondContact CA-O 3.43Å
339	V	97.2	Very high	94.7	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	113.6	177.6	177.6	0	0	0	0	107.9	F315 V319 L324 L337 A341 G365 L366 G367	F315-V339 HydrophobicContact CD2-CG2 3.95Å; V319-V339 HydrophobicContact CG1-CB 4.49Å; V319-V339 HydrophobicContact CG1-CG1 3.47Å; V319-V339 VanDerWaalsContact CG1-CG1 3.47Å; V319-V339 HydrophobicContact CG1-CG2 4.25Å; L324-V339 HydrophobicContact CD1-CG2 4.47Å; L324-V339 HydrophobicContact CD2-CG2 3.85Å; L337-V339 HydrophobicContact CD1-CG2 4.03Å; L337-V339 HydrophobicContact CG-CG2 4.21Å; V339-A341 WeakPolarHBondContact CG1-O 3.45Å; V339-G365 PolarHBondContact N-O 3.45Å; V339-L366 HydrophobicContact CB-CD2 3.92Å; V339-L366 HydrophobicContact CG2-CD2 4.11Å; V339-G367 PolarHBondContact O-N 2.89Å
340	C	93	Very high	94.7	Very high	43 Å²	43	44.4 Å²	44.4	29%	0.291	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	-33.3	179.5	-68.5	0	0	0	0	113.1	Y314 F315 G367	Y314-C340 PolarHBondContact OH-SG 2.74Å; F315-C340 WeakPolarHBondContact O-CB 3.29Å; F315-C340 PolarHBondContact O-N 2.85Å; F315-C340 PolarHBondContact O-SG 2.78Å; C340-G367 CarbonylContact C-O 3.55Å; C340-G367 VanDerWaalsContact C-O 3.29Å; C340-G367 CarbonylContact O-C 3.56Å
341	A	91.4	Very high	94.7	Very high	13 Å²	13	44.1 Å²	44.1	11%	0.107	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	150.6	179	0	0	0	0	0	112.1	S318 V319 V339 G367 E368	S318-A341 WeakPolarHBondContact CA-O 3.41Å; V319-A341 PolarHBondContact N-O 3.38Å; V319-A341 VanDerWaalsContact N-O 3.08Å; V339-A341 WeakPolarHBondContact CG1-O 3.45Å; A341-G367 WeakPolarHBondContact CA-O 3.38Å; A341-E368 CarbonylContact C-O 3.57Å; A341-E368 WeakPolarHBondContact CA-O 3.41Å; A341-E368 HydrophobicContact CB-CB 3.76Å
342	N	88.3	Confident	94.7	Very high	13 Å²	13	45.7 Å²	45.7	7%	0.07	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	160.4	170	177.1	-106.3	0	0	0	109.2	V319 K321 R345 L347 E368 C369	V319-N342 PolarHBondContact O-ND2 2.78Å; K321-N342 PolarHBondContact N-ND2 3.39Å; N342-R345 PolarHBondContact OD1-O 3.44Å; N342-L347 HydrophobicContact CB-CD1 3.96Å; N342-L347 WeakPolarHBondContact OD1-CD2 3.44Å; N342-L347 WeakPolarHBondContact OD1-CG 3.23Å; N342-E368 PolarHBondContact N-O 3.44Å; N342-C369 HydrophobicContact CB-CB 3.49Å; N342-C369 VanDerWaalsContact CB-CB 3.49Å
343	G	81	Confident	94.8	Very high	39 Å²	39	46.3 Å²	46.3	40%	0.402	24%	0.238	S	C	.	.			trans	-64.1	-172	175	0	0	0	0	0	114.2	R345	G343-R345 PolarHBondContact O-N 3.12Å
344	L	78.1	Confident	94.8	Very high	155 Å²	155	43.9 Å²	43.9	81%	0.812	23%	0.229	S	C	*	.	S	Bend	trans	-77.1	18.1	-173.2	-56.6	171.7	0	0	0	115
345	R	90.3	Very high	94.7	Very high	168 Å²	168	44 Å²	44	63%	0.634	23%	0.23	S	C	*	.	S	Bend	trans	-108.4	127.6	-176.8	-72.2	-170.2	-178.9	-179.3	3	109.6	K321 N342 G343 L347	K321-R345 HydrophobicContact CD-CB 3.99Å; N342-R345 PolarHBondContact OD1-O 3.44Å; G343-R345 PolarHBondContact O-N 3.12Å; R345-L347 PolarHBondContact O-N 3.07Å
346	P	94.2	Very high	94.7	Very high	58 Å²	58	47.3 Å²	47.3	38%	0.377	24%	0.243	S	C	.	.			trans	-54.9	134.2	176.1	-27.6	34.2	0	0	0	112.5	K321 D348 E370	K321-P346 PolarHBondContact NZ-O 2.58Å; P346-D348 VanDerWaalsContact C-N 3.33Å; P346-E370 CarbonylContact C-O 3.52Å; P346-E370 VanDerWaalsContact CA-O 3.27Å; P346-E370 WeakPolarHBondContact CA-O 3.23Å; P346-E370 HydrophobicContact CG-CB 4.44Å
347	L	97.3	Very high	94.6	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	25%	0.248	C	C	.	.			trans	-92.8	17.1	-175.9	-66	179	0	0	0	114	K321 L324 N342 R345 E349 E350 L351 C369 E370 V371	K321-L347 HydrophobicContact CB-CD2 4.01Å; K321-L347 HydrophobicContact CG-CD2 3.97Å; L324-L347 HydrophobicContact CD1-CD1 3.6Å; L324-L347 HydrophobicContact CD1-CD2 3.79Å; L324-L347 HydrophobicContact CD1-CG 4.33Å; N342-L347 HydrophobicContact CB-CD1 3.96Å; N342-L347 WeakPolarHBondContact OD1-CD2 3.44Å; N342-L347 WeakPolarHBondContact OD1-CG 3.23Å; R345-L347 PolarHBondContact O-N 3.07Å; L347-E349 PolarHBondContact O-N 3.17Å; L347-E350 WeakPolarHBondContact O-CB 3.42Å; L347-E350 PolarHBondContact O-N 3.08Å; L347-E350 VanDerWaalsContact O-N 3.12Å; L347-L351 PolarHBondContact O-N 2.66Å; L347-C369 HydrophobicContact CD1-CB 3.88Å; L347-E370 PolarHBondContact N-O 2.96Å; L347-V371 HydrophobicContact CB-CG2 4.25Å
348	D	97.9	Very high	94.6	Very high	41 Å²	41	49.3 Å²	49.3	22%	0.219	25%	0.247	C	C	.	.	H	α-helix	trans	-47	-59.6	-175.2	-65.1	13.5	0	0	0	112.7	P346 E350 L351 I352 S372 A375	P346-D348 VanDerWaalsContact C-N 3.33Å; D348-E350 VanDerWaalsContact C-N 3.31Å; D348-E350 PolarHBondContact O-N 3.03Å; D348-L351 PolarHBondContact O-N 3Å; D348-I352 WeakPolarHBondContact O-CG1 3.32Å; D348-I352 PolarHBondContact O-N 3.45Å; D348-I352 VanDerWaalsContact O-N 3.07Å; D348-S372 VanDerWaalsContact CG-OG 3.31Å; D348-S372 PolarHBondContact OD1-N 2.68Å; D348-S372 VanDerWaalsContact OD2-CB 3.24Å; D348-S372 WeakPolarHBondContact OD2-CB 3.39Å; D348-S372 PolarHBondContact OD2-OG 3Å; D348-A375 HydrophobicContact CB-CB 3.48Å; D348-A375 VanDerWaalsContact CB-CB 3.48Å
349	E	97.9	Very high	94.5	Very high	123 Å²	123	54 Å²	54	58%	0.575	26%	0.264	S	S	*	.	H	α-helix	trans	-63.6	-35.2	-178	-65	-177.1	-169.3	0	0	113.1	L347 R353	L347-E349 PolarHBondContact O-N 3.17Å; E349-R353 WeakPolarHBondContact O-CB 3.25Å; E349-R353 PolarHBondContact O-N 2.96Å; E349-R353 IonicContact OE2-NH2 3.56Å
350	E	98.1	Very high	94.5	Very high	11 Å²	11	58.5 Å²	58.5	5%	0.051	29%	0.289	C	S	.	.	H	α-helix	trans	-66.3	-45.2	179.6	-77.6	57.9	-121	0	0	110.6	K321 L324 L347 D348 R353 I354	K321-E350 VanDerWaalsContact CE-OE2 3.29Å; K321-E350 WeakPolarHBondContact CE-OE2 3.39Å; K321-E350 HydrophobicContact CG-CG 4.21Å; K321-E350 WeakPolarHBondContact CG-OE2 3.41Å; K321-E350 IonicContact NZ-OE2 2.67Å; K321-E350 PolarHBondContact NZ-OE2 2.95Å; L324-E350 HydrophobicContact CB-CB 4.22Å; L324-E350 HydrophobicContact CB-CG 3.96Å; L347-E350 WeakPolarHBondContact O-CB 3.42Å; L347-E350 PolarHBondContact O-N 3.08Å; L347-E350 VanDerWaalsContact O-N 3.12Å; D348-E350 VanDerWaalsContact C-N 3.31Å; D348-E350 PolarHBondContact O-N 3.03Å; E350-R353 PolarHBondContact O-N 3.5Å; E350-R353 IonicContact OE1-CZ 3.96Å; E350-R353 IonicContact OE1-NH1 3.88Å; E350-R353 PolarHBondContact OE1-NH1 3.5Å; E350-R353 IonicContact OE1-NH2 3.34Å; E350-I354 WeakPolarHBondContact O-CB 3.46Å; E350-I354 WeakPolarHBondContact O-CD1 3.36Å; E350-I354 WeakPolarHBondContact O-CG1 3.27Å; E350-I354 PolarHBondContact O-N 2.87Å
351	L	97.8	Very high	94.8	Very high	5 Å²	5	56.4 Å²	56.4	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-64.3	-45.8	176.4	-77.2	-177.6	0	0	0	112	L347 D348 R353 I354 A355 I364 L366 V371 F379	L347-L351 PolarHBondContact O-N 2.66Å; D348-L351 PolarHBondContact O-N 3Å; L351-R353 VanDerWaalsContact C-N 3.31Å; L351-R353 PolarHBondContact O-N 3.22Å; L351-I354 PolarHBondContact O-N 2.86Å; L351-A355 PolarHBondContact O-N 2.83Å; L351-I364 HydrophobicContact CD2-CD1 3.52Å; L351-L366 HydrophobicContact CD1-CD1 3.82Å; L351-L366 HydrophobicContact CD2-CD1 4.1Å; L351-L366 HydrophobicContact CG-CD1 4.48Å; L351-V371 HydrophobicContact CD1-CB 4.39Å; L351-V371 HydrophobicContact CD1-CG1 3.76Å; L351-V371 HydrophobicContact CD1-CG2 3.65Å; L351-F379 HydrophobicContact CB-CB 4.43Å; L351-F379 HydrophobicContact CB-CD2 3.88Å; L351-F379 HydrophobicContact CB-CG 4.27Å; L351-F379 HydrophobicContact CD2-CD2 4.37Å; L351-F379 HydrophobicContact CD2-CE2 4.23Å; L351-F379 VanDerWaalsContact O-CD2 3.31Å; L351-F379 WeakPolarHBondContact O-CD2 3.21Å
352	I	98.4	Very high	95.1	Very high	34 Å²	34	57.3 Å²	57.3	17%	0.174	28%	0.28	C	S	.	.	H	α-helix	trans	-59.6	-45.2	177.2	-63.9	-54.5	0	0	0	110.7	D348 I354 A355 E356 E378 F379 M382	D348-I352 WeakPolarHBondContact O-CG1 3.32Å; D348-I352 PolarHBondContact O-N 3.45Å; D348-I352 VanDerWaalsContact O-N 3.07Å; I352-I354 VanDerWaalsContact C-N 3.35Å; I352-I354 PolarHBondContact O-N 3.12Å; I352-A355 PolarHBondContact O-N 3.5Å; I352-E356 WeakPolarHBondContact O-CB 3.49Å; I352-E356 PolarHBondContact O-N 2.82Å; I352-E378 HydrophobicContact CD1-CB 3.85Å; I352-E378 HydrophobicContact CD1-CG 3.7Å; I352-F379 HydrophobicContact CD1-CB 4.13Å; I352-M382 HydrophobicContact CD1-SD 4Å; I352-M382 HydrophobicContact CG2-CE 4.31Å; I352-M382 HydrophobicContact CG2-SD 3.92Å
353	R	98.3	Very high	95.6	Very high	60 Å²	60	57 Å²	57	23%	0.226	28%	0.279	C	S	.	.	H	α-helix	trans	-61.6	-41.6	176.5	-173.2	-176.9	-60.9	127.6	5.8	112.1	G325 M329 E349 E350 L351 E356 R357	G325-R353 VanDerWaalsContact CA-NH1 3.34Å; M329-R353 HydrophobicContact SD-CG 4.2Å; E349-R353 WeakPolarHBondContact O-CB 3.25Å; E349-R353 PolarHBondContact O-N 2.96Å; E349-R353 IonicContact OE2-NH2 3.56Å; E350-R353 PolarHBondContact O-N 3.5Å; E350-R353 IonicContact OE1-CZ 3.96Å; E350-R353 IonicContact OE1-NH1 3.88Å; E350-R353 PolarHBondContact OE1-NH1 3.5Å; E350-R353 IonicContact OE1-NH2 3.34Å; L351-R353 VanDerWaalsContact C-N 3.31Å; L351-R353 PolarHBondContact O-N 3.22Å; R353-E356 PolarHBondContact O-N 3.32Å; R353-R357 WeakPolarHBondContact O-CB 3.48Å; R353-R357 PolarHBondContact O-N 2.87Å
354	I	98.2	Very high	96.4	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-64.1	-47.1	175.8	-73	164	0	0	0	110.4	L334 L337 E350 L351 I352 E356 R357 C358 L361	L334-I354 HydrophobicContact CD2-CG2 4.38Å; L337-I354 HydrophobicContact CD2-CD1 3.78Å; E350-I354 WeakPolarHBondContact O-CB 3.46Å; E350-I354 WeakPolarHBondContact O-CD1 3.36Å; E350-I354 WeakPolarHBondContact O-CG1 3.27Å; E350-I354 PolarHBondContact O-N 2.87Å; L351-I354 PolarHBondContact O-N 2.86Å; I352-I354 VanDerWaalsContact C-N 3.35Å; I352-I354 PolarHBondContact O-N 3.12Å; I354-E356 VanDerWaalsContact C-N 3.27Å; I354-E356 PolarHBondContact O-N 3.05Å; I354-R357 PolarHBondContact O-N 3.19Å; I354-C358 HydrophobicContact CG2-CB 4.26Å; I354-C358 WeakPolarHBondContact O-CA 3.41Å; I354-C358 WeakPolarHBondContact O-CB 3.29Å; I354-C358 PolarHBondContact O-N 2.83Å; I354-C358 PolarHBondContact O-SG 3.33Å; I354-L361 HydrophobicContact CG2-CD2 3.89Å
355	A	97.6	Very high	97.3	Very high	2 Å²	2	48.4 Å²	48.4	2%	0.017	23%	0.227	C	C	.	.	H	α-helix	trans	-60.4	-37.7	175.5	0	0	0	0	0	112.5	L351 I352 F379 M382 C383	L351-A355 PolarHBondContact O-N 2.83Å; I352-A355 PolarHBondContact O-N 3.5Å; A355-F379 HydrophobicContact CB-CD2 3.59Å; A355-F379 HydrophobicContact CB-CE2 3.82Å; A355-M382 HydrophobicContact CB-CB 3.93Å; A355-M382 HydrophobicContact CB-CE 4.21Å; A355-M382 HydrophobicContact CB-SD 4.2Å; A355-C383 VanDerWaalsContact CB-SG 3.53Å
356	E	97.5	Very high	97.6	Very high	110 Å²	110	40.9 Å²	40.9	51%	0.514	20%	0.199	S	C	.	.	H	α-helix	trans	-66.6	-46.5	178.6	-166.4	-177	-169	0	0	111.7	I352 R353 I354 K359 M382	I352-E356 WeakPolarHBondContact O-CB 3.49Å; I352-E356 PolarHBondContact O-N 2.82Å; R353-E356 PolarHBondContact O-N 3.32Å; I354-E356 VanDerWaalsContact C-N 3.27Å; I354-E356 PolarHBondContact O-N 3.05Å; E356-K359 WeakPolarHBondContact O-CD 3.45Å; E356-K359 WeakPolarHBondContact O-CE 3.17Å; E356-K359 PolarHBondContact O-NZ 3.06Å; E356-M382 HydrophobicContact CB-CE 3.82Å; E356-M382 HydrophobicContact CG-CE 4.35Å
357	R	97.6	Very high	97.6	Very high	120 Å²	120	38.6 Å²	38.6	45%	0.453	19%	0.187	S	C	.	.	H	α-helix	trans	-95.2	-31.4	-170.1	-68.4	-179.7	169.4	-104.5	-2.9	114	G328 M329 R353 I354 K359	G328-R357 WeakPolarHBondContact O-CB 3.25Å; G328-R357 WeakPolarHBondContact O-CD 3.39Å; M329-R357 PolarHBondContact SD-NE 3.42Å; M329-R357 VanDerWaalsContact SD-NE 3.42Å; R353-R357 WeakPolarHBondContact O-CB 3.48Å; R353-R357 PolarHBondContact O-N 2.87Å; I354-R357 PolarHBondContact O-N 3.19Å; R357-K359 PolarHBondContact O-N 2.83Å
358	C	97.6	Very high	97.4	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.217	C	C	.	.			trans	-92.4	71.1	-175.6	-53.8	0	0	0	0	110.9	C331 L334 I354 N360 L361 R386	C331-C358 PolarHBondContact O-SG 3.48Å; L334-C358 HydrophobicContact CB-CB 3.97Å; I354-C358 HydrophobicContact CG2-CB 4.26Å; I354-C358 WeakPolarHBondContact O-CA 3.41Å; I354-C358 WeakPolarHBondContact O-CB 3.29Å; I354-C358 PolarHBondContact O-N 2.83Å; I354-C358 PolarHBondContact O-SG 3.33Å; C358-N360 PolarHBondContact O-N 3.23Å; C358-L361 HydrophobicContact CB-CB 4.17Å; C358-L361 WeakPolarHBondContact O-CB 3.41Å; C358-L361 PolarHBondContact O-N 2.88Å; C358-R386 PolarHBondContact O-NH2 2.95Å
359	K	96.8	Very high	97.2	Very high	132 Å²	132	43.3 Å²	43.3	57%	0.574	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-5.8	-174	-60.9	-52.4	-165.2	-164.3	0	115.6	E356 R357 R386	E356-K359 WeakPolarHBondContact O-CD 3.45Å; E356-K359 WeakPolarHBondContact O-CE 3.17Å; E356-K359 PolarHBondContact O-NZ 3.06Å; R357-K359 PolarHBondContact O-N 2.83Å; K359-R386 VanDerWaalsContact C-NH1 3.29Å; K359-R386 PolarHBondContact O-NH1 3.1Å
360	N	97.2	Very high	97.1	Very high	97 Å²	97	40.4 Å²	40.4	52%	0.519	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-3.1	174.9	-65.4	-40.7	0	0	0	113.9	L334 V335 C358 S362	L334-N360 CarbonylContact O-C 3.29Å; L334-N360 VanDerWaalsContact O-C 3.22Å; V335-N360 HydrophobicContact CG2-CB 4.33Å; C358-N360 PolarHBondContact O-N 3.23Å; N360-S362 PolarHBondContact O-N 3.13Å; N360-S362 VanDerWaalsContact O-N 3.17Å
361	L	98.4	Very high	97	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.192	C	C	.	.			trans	-56.5	120.6	-179.5	-172.4	76.1	0	0	0	111.6	L334 L337 I354 C358 A363 I364 F379 R386 L387	L334-L361 HydrophobicContact CD2-CD1 4.19Å; L334-L361 HydrophobicContact CG-CD1 4.05Å; L334-L361 VanDerWaalsContact O-CA 3.29Å; L334-L361 WeakPolarHBondContact O-CA 3.44Å; L334-L361 PolarHBondContact O-N 2.76Å; L337-L361 HydrophobicContact CB-CD1 4.24Å; I354-L361 HydrophobicContact CG2-CD2 3.89Å; C358-L361 HydrophobicContact CB-CB 4.17Å; C358-L361 WeakPolarHBondContact O-CB 3.41Å; C358-L361 PolarHBondContact O-N 2.88Å; L361-A363 WeakPolarHBondContact CD1-O 3.45Å; L361-I364 HydrophobicContact CD2-CD1 4.49Å; L361-F379 HydrophobicContact CD2-CE2 4.15Å; L361-F379 HydrophobicContact CD2-CZ 3.94Å; L361-R386 VanDerWaalsContact N-NH1 3.16Å; L361-R386 VanDerWaalsContact N-NH2 3.16Å; L361-R386 PolarHBondContact O-NH1 3Å; L361-R386 PolarHBondContact O-NH2 3.27Å; L361-L387 HydrophobicContact CD2-CD2 4.44Å; L361-L387 HydrophobicContact CG-CD2 4.42Å
362	S	98.3	Very high	97	Very high	31 Å²	31	40.8 Å²	40.8	22%	0.217	20%	0.198	C	C	.	.			trans	-129.7	-11.5	-174.4	69.1	0	0	0	0	113.5	V335 N360 R386 L387 S388 Q389	V335-S362 WeakPolarHBondContact CG1-OG 3.41Å; V335-S362 PolarHBondContact O-N 3.32Å; V335-S362 PolarHBondContact O-OG 2.99Å; N360-S362 PolarHBondContact O-N 3.13Å; N360-S362 VanDerWaalsContact O-N 3.17Å; S362-R386 VanDerWaalsContact CA-O 3.27Å; S362-R386 WeakPolarHBondContact CA-O 3.37Å; S362-R386 WeakPolarHBondContact CB-O 3.42Å; S362-L387 CarbonylContact O-C 3.26Å; S362-S388 WeakPolarHBondContact O-CA 3.49Å; S362-S388 PolarHBondContact O-N 3.38Å; S362-S388 PolarHBondContact O-OG 3.25Å; S362-Q389 PolarHBondContact O-N 3.44Å
363	A	98.6	Very high	97	Very high	7 Å²	7	39.1 Å²	39.1	6%	0.058	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	132.1	175.7	0	0	0	0	0	109.4	V335 E336 L337 L361 Q389	V335-A363 PolarHBondContact O-N 3.49Å; V335-A363 VanDerWaalsContact O-N 3.08Å; E336-A363 WeakPolarHBondContact CA-O 3.36Å; E336-A363 HydrophobicContact CB-CB 3.97Å; E336-A363 HydrophobicContact CG-CB 3.71Å; L337-A363 PolarHBondContact N-O 3.25Å; L337-A363 VanDerWaalsContact N-O 3.13Å; L361-A363 WeakPolarHBondContact CD1-O 3.45Å; A363-Q389 WeakPolarHBondContact CA-O 3.44Å; A363-Q389 HydrophobicContact CB-CB 3.81Å; A363-Q389 HydrophobicContact CB-CG 4.38Å
364	I	98.1	Very high	97	Very high	5 Å²	5	38 Å²	38	3%	0.026	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	135.3	170.7	-164.4	173	0	0	0	110.5	L337 L351 L361 L366 F379 Q389 L390 S391	L337-I364 HydrophobicContact CB-CG1 4.44Å; L337-I364 CarbonylContact O-C 3.09Å; L337-I364 VanDerWaalsContact O-CA 3.26Å; L337-I364 WeakPolarHBondContact O-CA 3.25Å; L351-I364 HydrophobicContact CD2-CD1 3.52Å; L361-I364 HydrophobicContact CD2-CD1 4.49Å; I364-L366 HydrophobicContact CD1-CD2 4.42Å; I364-L366 HydrophobicContact CD1-CG 4.46Å; I364-L366 HydrophobicContact CG1-CD2 4.36Å; I364-L366 HydrophobicContact CG1-CG 4.34Å; I364-F379 HydrophobicContact CD1-CE1 4.17Å; I364-F379 HydrophobicContact CD1-CE2 4.2Å; I364-F379 HydrophobicContact CD1-CZ 3.59Å; I364-F379 HydrophobicContact CG2-CE1 4.02Å; I364-F379 HydrophobicContact CG2-CZ 4.11Å; I364-Q389 PolarHBondContact N-O 3.1Å; I364-Q389 VanDerWaalsContact N-O 3.13Å; I364-L390 HydrophobicContact CG2-CD1 3.2Å; I364-L390 WeakPolarHBondContact O-CA 3.43Å; I364-S391 PolarHBondContact O-N 3.48Å
365	G	97.9	Very high	97	Very high	9 Å²	9	38.3 Å²	38.3	9%	0.093	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.2	176.9	0	0	0	0	0	110	L337 V338 V339 S391	L337-G365 PolarHBondContact O-N 3.31Å; V338-G365 CarbonylContact C-O 3.42Å; V338-G365 WeakPolarHBondContact CA-O 3.43Å; V339-G365 PolarHBondContact N-O 3.45Å; G365-S391 CarbonylContact C-O 3.37Å; G365-S391 WeakPolarHBondContact CA-O 3.37Å
366	L	96.8	Very high	97	Very high	9 Å²	9	38.2 Å²	38.2	5%	0.047	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	127.1	175.9	-56.9	177.5	0	0	0	110.4	V339 L351 I364 V371 S391 I392 M393 V396	V339-L366 HydrophobicContact CB-CD2 3.92Å; V339-L366 HydrophobicContact CG2-CD2 4.11Å; L351-L366 HydrophobicContact CD1-CD1 3.82Å; L351-L366 HydrophobicContact CD2-CD1 4.1Å; L351-L366 HydrophobicContact CG-CD1 4.48Å; I364-L366 HydrophobicContact CD1-CD2 4.42Å; I364-L366 HydrophobicContact CD1-CG 4.46Å; I364-L366 HydrophobicContact CG1-CD2 4.36Å; I364-L366 HydrophobicContact CG1-CG 4.34Å; L366-V371 HydrophobicContact CD1-CG2 4.23Å; L366-S391 PolarHBondContact N-O 3.3Å; L366-I392 HydrophobicContact CB-CD1 3.68Å; L366-I392 HydrophobicContact CD1-CD1 3.79Å; L366-I392 HydrophobicContact CG-CD1 3.71Å; L366-M393 PolarHBondContact O-N 3.24Å; L366-V396 HydrophobicContact CB-CG1 4.37Å
367	G	93.4	Very high	97	Very high	11 Å²	11	33.3 Å²	33.3	11%	0.113	17%	0.171	C	C	.	.			trans	-131.2	159.3	170.1	0	0	0	0	0	110.7	V339 C340 A341 C369	V339-G367 PolarHBondContact O-N 2.89Å; C340-G367 CarbonylContact C-O 3.55Å; C340-G367 VanDerWaalsContact C-O 3.29Å; C340-G367 CarbonylContact O-C 3.56Å; A341-G367 WeakPolarHBondContact CA-O 3.38Å; G367-C369 VanDerWaalsContact C-N 3.27Å; G367-C369 PolarHBondContact O-N 3.46Å; G367-C369 VanDerWaalsContact O-N 3.09Å
368	E	92.4	Very high	97.1	Very high	136 Å²	136	32.6 Å²	32.6	64%	0.636	17%	0.173	S	C	*	.	S	Bend	trans	40.1	51.2	176.4	-60.3	-177.3	-169.4	0	0	113.6	A341 N342	A341-E368 CarbonylContact C-O 3.57Å; A341-E368 WeakPolarHBondContact CA-O 3.41Å; A341-E368 HydrophobicContact CB-CB 3.76Å; N342-E368 PolarHBondContact N-O 3.44Å
369	C	94	Very high	97.1	Very high	6 Å²	6	32.6 Å²	32.6	4%	0.041	17%	0.173	C	C	.	.			trans	-144.4	175.9	177	66.2	0	0	0	0	109.8	N342 L347 G367 V396	N342-C369 HydrophobicContact CB-CB 3.49Å; N342-C369 VanDerWaalsContact CB-CB 3.49Å; L347-C369 HydrophobicContact CD1-CB 3.88Å; G367-C369 VanDerWaalsContact C-N 3.27Å; G367-C369 PolarHBondContact O-N 3.46Å; G367-C369 VanDerWaalsContact O-N 3.09Å; C369-V396 WeakPolarHBondContact O-CA 3.3Å; C369-V396 WeakPolarHBondContact SG-CG1 3.38Å
370	E	95.9	Very high	97.2	Very high	62 Å²	62	26.3 Å²	26.3	29%	0.29	15%	0.145	S	C	.	.			trans	-120.8	137.6	177.6	-63.3	-175.5	165.8	0	0	111.4	P346 L347 V396 I398	P346-E370 CarbonylContact C-O 3.52Å; P346-E370 VanDerWaalsContact CA-O 3.27Å; P346-E370 WeakPolarHBondContact CA-O 3.23Å; P346-E370 HydrophobicContact CG-CB 4.44Å; L347-E370 PolarHBondContact N-O 2.96Å; E370-V396 CarbonylContact C-O 3.22Å; E370-I398 HydrophobicContact CB-CD1 4.33Å; E370-I398 HydrophobicContact CB-CG1 3.98Å; E370-I398 HydrophobicContact CG-CD1 4.12Å; E370-I398 HydrophobicContact CG-CG1 4.3Å
371	V	97.4	Very high	97.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	130.6	172.6	-174.8	0	0	0	0	108.8	L347 L351 L366 A375 F376 V396 I398	L347-V371 HydrophobicContact CB-CG2 4.25Å; L351-V371 HydrophobicContact CD1-CB 4.39Å; L351-V371 HydrophobicContact CD1-CG1 3.76Å; L351-V371 HydrophobicContact CD1-CG2 3.65Å; L366-V371 HydrophobicContact CD1-CG2 4.23Å; V371-A375 HydrophobicContact CG1-CB 4.38Å; V371-F376 HydrophobicContact CG1-CB 3.92Å; V371-F376 HydrophobicContact CG1-CD2 4.48Å; V371-V396 HydrophobicContact CB-CG1 4.33Å; V371-V396 HydrophobicContact CG2-CG1 3.9Å; V371-V396 PolarHBondContact N-O 3.34Å; V371-I398 PolarHBondContact O-N 2.71Å
372	S	97.6	Very high	97.1	Very high	23 Å²	23	32 Å²	32	16%	0.161	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	143.4	173.7	73.9	0	0	0	0	111.5	D348 S374 A375 F376 I398	D348-S372 VanDerWaalsContact CG-OG 3.31Å; D348-S372 PolarHBondContact OD1-N 2.68Å; D348-S372 VanDerWaalsContact OD2-CB 3.24Å; D348-S372 WeakPolarHBondContact OD2-CB 3.39Å; D348-S372 PolarHBondContact OD2-OG 3Å; S372-S374 PolarHBondContact O-N 2.88Å; S372-A375 PolarHBondContact O-N 2.95Å; S372-A375 VanDerWaalsContact O-N 3.14Å; S372-A375 VanDerWaalsContact OG-CB 3.24Å; S372-A375 WeakPolarHBondContact OG-CB 3.42Å; S372-A375 PolarHBondContact OG-N 3.33Å; S372-F376 PolarHBondContact O-N 3.02Å; S372-I398 WeakPolarHBondContact CA-O 3.4Å
373	C	97.8	Very high	97.1	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-56.7	-39.6	179.5	-74.5	0	0	0	0	112	F376 V377 I398 I408	C373-F376 PolarHBondContact O-N 2.79Å; C373-V377 WeakPolarHBondContact O-CG2 3.46Å; C373-V377 PolarHBondContact O-N 3.27Å; C373-I398 PolarHBondContact N-O 3.07Å; C373-I398 PolarHBondContact SG-O 3.44Å; C373-I408 HydrophobicContact CB-CD1 3.66Å; C373-I408 VanDerWaalsContact SG-CD1 3.55Å
374	S	97.7	Very high	96.8	Very high	36 Å²	36	31.1 Å²	31.1	25%	0.252	16%	0.163	S	C	.	.	H	α-helix	trans	-62.5	-46.6	175.9	-69.3	0	0	0	0	112.8	S372 F376 V377 E378 D400	S372-S374 PolarHBondContact O-N 2.88Å; S374-F376 VanDerWaalsContact C-N 3.34Å; S374-V377 PolarHBondContact O-N 2.93Å; S374-E378 WeakPolarHBondContact O-CB 3.35Å; S374-E378 PolarHBondContact O-N 3.19Å; S374-D400 WeakPolarHBondContact CA-OD2 3.5Å; S374-D400 WeakPolarHBondContact CB-OD2 3.33Å; S374-D400 PolarHBondContact N-OD2 3.27Å; S374-D400 PolarHBondContact OG-OD1 3.2Å; S374-D400 VanDerWaalsContact OG-OD1 3.14Å; S374-D400 PolarHBondContact OG-OD2 3.16Å
375	A	98	Very high	96.5	Very high	8 Å²	8	34 Å²	34	7%	0.066	19%	0.193	C	C	.	.	H	α-helix	trans	-66.2	-38.2	178.5	0	0	0	0	0	111.6	D348 V371 S372 E378 F379	D348-A375 HydrophobicContact CB-CB 3.48Å; D348-A375 VanDerWaalsContact CB-CB 3.48Å; V371-A375 HydrophobicContact CG1-CB 4.38Å; S372-A375 PolarHBondContact O-N 2.95Å; S372-A375 VanDerWaalsContact O-N 3.14Å; S372-A375 VanDerWaalsContact OG-CB 3.24Å; S372-A375 WeakPolarHBondContact OG-CB 3.42Å; S372-A375 PolarHBondContact OG-N 3.33Å; A375-E378 PolarHBondContact O-N 3.4Å; A375-F379 WeakPolarHBondContact O-CB 3.48Å; A375-F379 PolarHBondContact O-N 2.81Å
376	F	98.3	Very high	96.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.4	-44.6	176.5	-172.1	-105.1	0	0	0	112.2	V371 S372 C373 S374 E378 F379 V380 L390 I392 L397 I408 V412 W420	V371-F376 HydrophobicContact CG1-CB 3.92Å; V371-F376 HydrophobicContact CG1-CD2 4.48Å; S372-F376 PolarHBondContact O-N 3.02Å; C373-F376 PolarHBondContact O-N 2.79Å; S374-F376 VanDerWaalsContact C-N 3.34Å; F376-E378 VanDerWaalsContact C-N 3.29Å; F376-E378 PolarHBondContact O-N 3.48Å; F376-F379 HydrophobicContact CD2-CD1 4.46Å; F376-F379 HydrophobicContact CE2-CD1 4.38Å; F376-F379 WeakPolarHBondContact O-CB 3.44Å; F376-F379 PolarHBondContact O-N 3.07Å; F376-V380 HydrophobicContact CD1-CG2 4.21Å; F376-V380 HydrophobicContact CE1-CG2 3.86Å; F376-V380 HydrophobicContact CE2-CG2 4.38Å; F376-V380 HydrophobicContact CZ-CG2 3.94Å; F376-V380 WeakPolarHBondContact O-CG2 3.3Å; F376-V380 PolarHBondContact O-N 3.2Å; F376-L390 HydrophobicContact CE1-CD2 4.4Å; F376-L390 HydrophobicContact CE2-CD1 4.18Å; F376-L390 HydrophobicContact CZ-CD1 3.88Å; F376-L390 HydrophobicContact CZ-CD2 3.84Å; F376-L390 HydrophobicContact CZ-CG 4.18Å; F376-I392 HydrophobicContact CE2-CD1 3.81Å; F376-I392 HydrophobicContact CE2-CG1 3.83Å; F376-I392 HydrophobicContact CZ-CD1 4.17Å; F376-I392 HydrophobicContact CZ-CG1 3.66Å; F376-L397 HydrophobicContact CB-CD2 4.05Å; F376-L397 HydrophobicContact CD1-CD2 3.84Å; F376-L397 HydrophobicContact CD2-CD2 4.23Å; F376-L397 HydrophobicContact CE1-CD2 4.31Å; F376-L397 HydrophobicContact CG-CD2 3.76Å; F376-I408 HydrophobicContact CB-CD1 4.38Å; F376-I408 HydrophobicContact CD1-CD1 3.88Å; F376-I408 HydrophobicContact CD1-CG1 4.25Å; F376-V412 HydrophobicContact CD1-CG2 3.82Å; F376-V412 HydrophobicContact CE1-CG1 4.3Å; F376-V412 HydrophobicContact CE1-CG2 3.6Å; F376-W420 AromaticContact CE1-CH2 3.84Å; F376-W420 HydrophobicContact CE1-CH2 3.84Å; F376-W420 HydrophobicContact CE1-CZ2 4.23Å; F376-W420 HydrophobicContact CE1-CZ3 4.36Å; F376-W420 HydrophobicContact CZ-CH2 4.23Å; F376-W420 HydrophobicContact CZ-CZ2 4.2Å
377	V	98	Very high	96.5	Very high	7 Å²	7	36.8 Å²	36.8	4%	0.042	20%	0.201	C	C	.	.	H	α-helix	trans	-61.2	-40.6	174.6	170.4	0	0	0	0	110.9	C373 S374 V380 K381 Y403 I408 E411	C373-V377 WeakPolarHBondContact O-CG2 3.46Å; C373-V377 PolarHBondContact O-N 3.27Å; S374-V377 PolarHBondContact O-N 2.93Å; V377-V380 PolarHBondContact O-N 3.4Å; V377-K381 VanDerWaalsContact O-CB 3.27Å; V377-K381 WeakPolarHBondContact O-CB 3.48Å; V377-K381 PolarHBondContact O-N 3.11Å; V377-Y403 HydrophobicContact CB-CE2 4.12Å; V377-Y403 HydrophobicContact CG1-CE2 4.16Å; V377-Y403 HydrophobicContact CG2-CD2 4.2Å; V377-Y403 HydrophobicContact CG2-CE2 4.07Å; V377-I408 HydrophobicContact CG2-CD1 4.35Å; V377-I408 HydrophobicContact CG2-CG1 4.07Å; V377-E411 HydrophobicContact CG1-CB 4.28Å; V377-E411 HydrophobicContact CG2-CB 4.23Å
378	E	98.2	Very high	96.7	Very high	106 Å²	106	39 Å²	39	50%	0.495	21%	0.214	S	C	.	.	H	α-helix	trans	-64.4	-44.2	175.7	-174.3	174.4	-175.4	0	0	112.1	I352 S374 A375 F376 V380 K381 M382	I352-E378 HydrophobicContact CD1-CB 3.85Å; I352-E378 HydrophobicContact CD1-CG 3.7Å; S374-E378 WeakPolarHBondContact O-CB 3.35Å; S374-E378 PolarHBondContact O-N 3.19Å; A375-E378 PolarHBondContact O-N 3.4Å; F376-E378 VanDerWaalsContact C-N 3.29Å; F376-E378 PolarHBondContact O-N 3.48Å; E378-V380 PolarHBondContact O-N 2.93Å; E378-K381 WeakPolarHBondContact O-CB 3.46Å; E378-K381 PolarHBondContact O-N 3.12Å; E378-K381 VanDerWaalsContact O-N 3.15Å; E378-M382 HydrophobicContact CG-SD 4.39Å; E378-M382 VanDerWaalsContact O-CG 3.31Å; E378-M382 WeakPolarHBondContact O-CG 3.34Å; E378-M382 PolarHBondContact O-N 3.49Å
379	F	98.4	Very high	96.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-55.3	-50.3	173.2	167	-96.4	0	0	0	111.7	L351 I352 A355 L361 I364 A375 F376 K381 M382 C383 L387	L351-F379 HydrophobicContact CB-CB 4.43Å; L351-F379 HydrophobicContact CB-CD2 3.88Å; L351-F379 HydrophobicContact CB-CG 4.27Å; L351-F379 HydrophobicContact CD2-CD2 4.37Å; L351-F379 HydrophobicContact CD2-CE2 4.23Å; L351-F379 VanDerWaalsContact O-CD2 3.31Å; L351-F379 WeakPolarHBondContact O-CD2 3.21Å; I352-F379 HydrophobicContact CD1-CB 4.13Å; A355-F379 HydrophobicContact CB-CD2 3.59Å; A355-F379 HydrophobicContact CB-CE2 3.82Å; L361-F379 HydrophobicContact CD2-CE2 4.15Å; L361-F379 HydrophobicContact CD2-CZ 3.94Å; I364-F379 HydrophobicContact CD1-CE1 4.17Å; I364-F379 HydrophobicContact CD1-CE2 4.2Å; I364-F379 HydrophobicContact CD1-CZ 3.59Å; I364-F379 HydrophobicContact CG2-CE1 4.02Å; I364-F379 HydrophobicContact CG2-CZ 4.11Å; A375-F379 WeakPolarHBondContact O-CB 3.48Å; A375-F379 PolarHBondContact O-N 2.81Å; F376-F379 HydrophobicContact CD2-CD1 4.46Å; F376-F379 HydrophobicContact CE2-CD1 4.38Å; F376-F379 WeakPolarHBondContact O-CB 3.44Å; F376-F379 PolarHBondContact O-N 3.07Å; F379-K381 VanDerWaalsContact C-N 3.29Å; F379-K381 PolarHBondContact O-N 3.03Å; F379-M382 PolarHBondContact O-N 3.3Å; F379-C383 PolarHBondContact O-N 2.64Å; F379-L387 HydrophobicContact CE1-CD1 3.81Å; F379-L387 HydrophobicContact CZ-CD1 4.32Å
380	V	98.1	Very high	97.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-66.4	-33.8	178.7	179	0	0	0	0	110.7	F376 V377 E378 G384 L390 V412 H415 L416	F376-V380 HydrophobicContact CD1-CG2 4.21Å; F376-V380 HydrophobicContact CE1-CG2 3.86Å; F376-V380 HydrophobicContact CE2-CG2 4.38Å; F376-V380 HydrophobicContact CZ-CG2 3.94Å; F376-V380 WeakPolarHBondContact O-CG2 3.3Å; F376-V380 PolarHBondContact O-N 3.2Å; V377-V380 PolarHBondContact O-N 3.4Å; E378-V380 PolarHBondContact O-N 2.93Å; V380-G384 WeakPolarHBondContact O-CA 3.29Å; V380-G384 PolarHBondContact O-N 3.16Å; V380-L390 HydrophobicContact CG2-CD2 4.03Å; V380-V412 HydrophobicContact CG1-CG1 4.17Å; V380-V412 HydrophobicContact CG2-CG1 4.22Å; V380-V412 HydrophobicContact CG2-CG2 4.35Å; V380-H415 HydrophobicContact CG1-CB 3.75Å; V380-L416 HydrophobicContact CG1-CD2 3.94Å; V380-L416 HydrophobicContact CG1-CG 3.95Å
381	K	97.6	Very high	97.1	Very high	141 Å²	141	38.8 Å²	38.8	61%	0.613	22%	0.22	S	C	*	.	H	α-helix	trans	-66.2	-38.5	174.7	-179	-178.7	175.9	-173.4	0	112.2	V377 E378 F379	V377-K381 VanDerWaalsContact O-CB 3.27Å; V377-K381 WeakPolarHBondContact O-CB 3.48Å; V377-K381 PolarHBondContact O-N 3.11Å; E378-K381 WeakPolarHBondContact O-CB 3.46Å; E378-K381 PolarHBondContact O-N 3.12Å; E378-K381 VanDerWaalsContact O-N 3.15Å; F379-K381 VanDerWaalsContact C-N 3.29Å; F379-K381 PolarHBondContact O-N 3.03Å
382	M	97.8	Very high	97.1	Very high	76 Å²	76	38.8 Å²	38.8	37%	0.374	22%	0.22	S	C	.	.	H	α-helix	trans	-70.3	-41.5	177.9	-70.3	175.3	75.3	0	0	112.3	I352 A355 E356 E378 F379	I352-M382 HydrophobicContact CD1-SD 4Å; I352-M382 HydrophobicContact CG2-CE 4.31Å; I352-M382 HydrophobicContact CG2-SD 3.92Å; A355-M382 HydrophobicContact CB-CB 3.93Å; A355-M382 HydrophobicContact CB-CE 4.21Å; A355-M382 HydrophobicContact CB-SD 4.2Å; E356-M382 HydrophobicContact CB-CE 3.82Å; E356-M382 HydrophobicContact CG-CE 4.35Å; E378-M382 HydrophobicContact CG-SD 4.39Å; E378-M382 VanDerWaalsContact O-CG 3.31Å; E378-M382 WeakPolarHBondContact O-CG 3.34Å; E378-M382 PolarHBondContact O-N 3.49Å; F379-M382 PolarHBondContact O-N 3.3Å
383	C	96.6	Very high	97	Very high	8 Å²	8	39.4 Å²	39.4	5%	0.054	22%	0.22	C	C	.	.	H	α-helix	trans	-76.8	-53.5	176.5	-62.6	0	0	0	0	110.6	A355 F379 R386 L387	A355-C383 VanDerWaalsContact CB-SG 3.53Å; F379-C383 PolarHBondContact O-N 2.64Å; C383-R386 VanDerWaalsContact O-CD 3.26Å; C383-R386 WeakPolarHBondContact O-CD 3.3Å; C383-R386 WeakPolarHBondContact O-CG 3.48Å; C383-L387 HydrophobicContact CB-CD1 3.61Å; C383-L387 HydrophobicContact CB-CD2 4.05Å; C383-L387 HydrophobicContact CB-CG 3.57Å
384	G	93.8	Very high	96.8	Very high	11 Å²	11	43 Å²	43	11%	0.113	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	66.3	-143.6	-179.9	0	0	0	0	0	112.5	V380 R386 L387	V380-G384 WeakPolarHBondContact O-CA 3.29Å; V380-G384 PolarHBondContact O-N 3.16Å; G384-R386 PolarHBondContact O-N 2.57Å; G384-L387 PolarHBondContact O-N 2.89Å; G384-L387 VanDerWaalsContact O-N 3.12Å
385	G	91.8	Very high	96.6	Very high	65 Å²	65	46.1 Å²	46.1	67%	0.67	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-65.1	-3	-174.4	0	0	0	0	0	116.5	L387	G385-L387 VanDerWaalsContact C-N 3.31Å
386	R	96.1	Very high	96.5	Very high	74 Å²	74	45.8 Å²	45.8	28%	0.279	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-76.4	-17.5	171.2	36	-179	-105.1	87.3	1.4	112.8	C358 K359 L361 S362 C383 G384 S388	C358-R386 PolarHBondContact O-NH2 2.95Å; K359-R386 VanDerWaalsContact C-NH1 3.29Å; K359-R386 PolarHBondContact O-NH1 3.1Å; L361-R386 VanDerWaalsContact N-NH1 3.16Å; L361-R386 VanDerWaalsContact N-NH2 3.16Å; L361-R386 PolarHBondContact O-NH1 3Å; L361-R386 PolarHBondContact O-NH2 3.27Å; S362-R386 VanDerWaalsContact CA-O 3.27Å; S362-R386 WeakPolarHBondContact CA-O 3.37Å; S362-R386 WeakPolarHBondContact CB-O 3.42Å; C383-R386 VanDerWaalsContact O-CD 3.26Å; C383-R386 WeakPolarHBondContact O-CD 3.3Å; C383-R386 WeakPolarHBondContact O-CG 3.48Å; G384-R386 PolarHBondContact O-N 2.57Å; R386-S388 PolarHBondContact O-N 2.82Å
387	L	97.7	Very high	96.4	Very high	3 Å²	3	46 Å²	46	2%	0.016	25%	0.246	C	C	.	.			trans	-74.4	94.2	171	-65.5	178.1	0	0	0	110.1	L361 S362 F379 C383 G384 G385 L416 R418	L361-L387 HydrophobicContact CD2-CD2 4.44Å; L361-L387 HydrophobicContact CG-CD2 4.42Å; S362-L387 CarbonylContact O-C 3.26Å; F379-L387 HydrophobicContact CE1-CD1 3.81Å; F379-L387 HydrophobicContact CZ-CD1 4.32Å; C383-L387 HydrophobicContact CB-CD1 3.61Å; C383-L387 HydrophobicContact CB-CD2 4.05Å; C383-L387 HydrophobicContact CB-CG 3.57Å; G384-L387 PolarHBondContact O-N 2.89Å; G384-L387 VanDerWaalsContact O-N 3.12Å; G385-L387 VanDerWaalsContact C-N 3.31Å; L387-L416 HydrophobicContact CB-CD2 3.76Å; L387-L416 HydrophobicContact CD1-CD2 4.26Å; L387-R418 PolarHBondContact O-NH2 3.09Å
388	S	97	Very high	96.4	Very high	57 Å²	57	48.7 Å²	48.7	40%	0.399	26%	0.26	S	S	.	.	S	Bend	trans	-76.7	-23.7	174.1	73.1	0	0	0	0	113	S362 R386 R418	S362-S388 WeakPolarHBondContact O-CA 3.49Å; S362-S388 PolarHBondContact O-N 3.38Å; S362-S388 PolarHBondContact O-OG 3.25Å; R386-S388 PolarHBondContact O-N 2.82Å; S388-R418 PolarHBondContact O-NH1 2.89Å; S388-R418 PolarHBondContact O-NH2 2.87Å
389	Q	97.3	Very high	96.3	Very high	125 Å²	125	47 Å²	47	58%	0.584	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.4	133.2	172.7	-60.3	-63.7	-14.3	0	0	109.7	S362 A363 I364	S362-Q389 PolarHBondContact O-N 3.44Å; A363-Q389 WeakPolarHBondContact CA-O 3.44Å; A363-Q389 HydrophobicContact CB-CB 3.81Å; A363-Q389 HydrophobicContact CB-CG 4.38Å; I364-Q389 PolarHBondContact N-O 3.1Å; I364-Q389 VanDerWaalsContact N-O 3.13Å
390	L	97.8	Very high	96.2	Very high	13 Å²	13	49.5 Å²	49.5	7%	0.068	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	97.8	177	179.7	62.7	0	0	0	107.7	I364 F376 V380 I392 V412 L416 W420	I364-L390 HydrophobicContact CG2-CD1 3.2Å; I364-L390 WeakPolarHBondContact O-CA 3.43Å; F376-L390 HydrophobicContact CE1-CD2 4.4Å; F376-L390 HydrophobicContact CE2-CD1 4.18Å; F376-L390 HydrophobicContact CZ-CD1 3.88Å; F376-L390 HydrophobicContact CZ-CD2 3.84Å; F376-L390 HydrophobicContact CZ-CG 4.18Å; V380-L390 HydrophobicContact CG2-CD2 4.03Å; L390-I392 HydrophobicContact CD1-CD1 3.92Å; L390-I392 HydrophobicContact CD1-CG1 3.8Å; L390-I392 HydrophobicContact CG-CG1 4.11Å; L390-V412 HydrophobicContact CD2-CG1 3.8Å; L390-L416 HydrophobicContact CD2-CD1 3.78Å; L390-L416 HydrophobicContact CD2-CD2 4.41Å; L390-W420 HydrophobicContact CD2-CD2 4.34Å; L390-W420 HydrophobicContact CD2-CG 4.48Å; L390-W420 HydrophobicContact CD2-CZ2 4.21Å; L390-W420 HydrophobicContact CG-CZ2 4.27Å; L390-W420 PolarHBondContact O-NE1 2.89Å
391	S	97.3	Very high	96.1	Very high	61 Å²	61	59.6 Å²	59.6	43%	0.427	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	117.9	179.3	171.7	0	0	0	0	108.5	I364 G365 L366 D423	I364-S391 PolarHBondContact O-N 3.48Å; G365-S391 CarbonylContact C-O 3.37Å; G365-S391 WeakPolarHBondContact CA-O 3.37Å; L366-S391 PolarHBondContact N-O 3.3Å; S391-D423 WeakPolarHBondContact CA-OD2 3.2Å; S391-D423 WeakPolarHBondContact CB-OD2 3.33Å; S391-D423 PolarHBondContact OG-OD2 2.67Å
392	I	97.3	Very high	96	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	122.6	-173	-53.3	-69.8	0	0	0	106.4	L366 F376 L390 V396 L397 W420 P422 D423	L366-I392 HydrophobicContact CB-CD1 3.68Å; L366-I392 HydrophobicContact CD1-CD1 3.79Å; L366-I392 HydrophobicContact CG-CD1 3.71Å; F376-I392 HydrophobicContact CE2-CD1 3.81Å; F376-I392 HydrophobicContact CE2-CG1 3.83Å; F376-I392 HydrophobicContact CZ-CD1 4.17Å; F376-I392 HydrophobicContact CZ-CG1 3.66Å; L390-I392 HydrophobicContact CD1-CD1 3.92Å; L390-I392 HydrophobicContact CD1-CG1 3.8Å; L390-I392 HydrophobicContact CG-CG1 4.11Å; I392-V396 HydrophobicContact CG2-CB 3.82Å; I392-V396 HydrophobicContact CG2-CG1 3.94Å; I392-V396 HydrophobicContact CG2-CG2 4.39Å; I392-L397 HydrophobicContact CG2-CD2 4.3Å; I392-L397 HydrophobicContact CG2-CG 4.25Å; I392-W420 HydrophobicContact CB-CZ2 4.04Å; I392-W420 HydrophobicContact CG1-CZ2 4.04Å; I392-P422 CarbonylContact O-C 3.39Å; I392-P422 VanDerWaalsContact O-CA 3.3Å; I392-P422 WeakPolarHBondContact O-CA 3.44Å; I392-P422 WeakPolarHBondContact O-CB 3.45Å; I392-D423 PolarHBondContact N-OD2 2.85Å; I392-D423 PolarHBondContact O-N 3.44Å
393	M	95.1	Very high	95.9	Very high	36 Å²	36	57.1 Å²	57.1	18%	0.177	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-69.6	144.8	174.5	-144.5	71.6	68.1	0	0	110.8	L366 E395 V396 D423 M425	L366-M393 PolarHBondContact O-N 3.24Å; M393-E395 VanDerWaalsContact C-N 3.26Å; M393-E395 VanDerWaalsContact CB-CD 3.5Å; M393-E395 WeakPolarHBondContact CB-OE1 3.16Å; M393-E395 WeakPolarHBondContact CB-OE2 3.46Å; M393-E395 WeakPolarHBondContact CG-OE1 3.46Å; M393-E395 WeakPolarHBondContact CG-OE2 3.24Å; M393-E395 PolarHBondContact O-N 3.07Å; M393-V396 HydrophobicContact CB-CG2 4.24Å; M393-V396 VanDerWaalsContact O-CB 3.26Å; M393-V396 WeakPolarHBondContact O-CB 3.48Å; M393-V396 PolarHBondContact O-N 3.47Å; M393-D423 WeakPolarHBondContact CA-O 3.45Å; M393-D423 HydrophobicContact SD-CB 3.64Å; M393-M425 HydrophobicContact CE-CE 3.37Å; M393-M425 HydrophobicContact SD-CE 3.58Å; M393-M425 VanDerWaalsContact SD-CE 3.58Å; M393-M425 HydrophobicContact SD-CG 4.14Å
394	E	94.3	Very high	95.8	Very high	75 Å²	75	58.7 Å²	58.7	35%	0.35	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-55.1	-39.9	-176.2	-173.3	-179.9	-174.2	0	0	112.8	V396 L397 L405 P422 D423 M424	E394-V396 PolarHBondContact O-N 3.1Å; E394-V396 VanDerWaalsContact O-N 3.08Å; E394-L397 PolarHBondContact O-N 3.46Å; E394-L405 HydrophobicContact CG-CD1 4.37Å; E394-P422 HydrophobicContact CB-CB 4.2Å; E394-P422 HydrophobicContact CB-CG 4.32Å; E394-P422 HydrophobicContact CG-CG 4.34Å; E394-D423 PolarHBondContact N-O 3.27Å; E394-M424 HydrophobicContact CB-CG 4.41Å; E394-M424 WeakPolarHBondContact OE2-CG 3.33Å
395	E	92.8	Very high	95.7	Very high	103 Å²	103	61 Å²	61	48%	0.481	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-65	-12.7	179.7	69.6	-85.8	-168.6	0	0	114.2	M393 L397	M393-E395 VanDerWaalsContact C-N 3.26Å; M393-E395 VanDerWaalsContact CB-CD 3.5Å; M393-E395 WeakPolarHBondContact CB-OE1 3.16Å; M393-E395 WeakPolarHBondContact CB-OE2 3.46Å; M393-E395 WeakPolarHBondContact CG-OE1 3.46Å; M393-E395 WeakPolarHBondContact CG-OE2 3.24Å; M393-E395 PolarHBondContact O-N 3.07Å; E395-L397 VanDerWaalsContact C-N 3.3Å
396	V	95.8	Very high	95.6	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-71.3	-29.2	177.1	173.4	0	0	0	0	112.1	L366 C369 E370 V371 I392 M393 E394	L366-V396 HydrophobicContact CB-CG1 4.37Å; C369-V396 WeakPolarHBondContact O-CA 3.3Å; C369-V396 WeakPolarHBondContact SG-CG1 3.38Å; E370-V396 CarbonylContact C-O 3.22Å; V371-V396 HydrophobicContact CB-CG1 4.33Å; V371-V396 HydrophobicContact CG2-CG1 3.9Å; V371-V396 PolarHBondContact N-O 3.34Å; I392-V396 HydrophobicContact CG2-CB 3.82Å; I392-V396 HydrophobicContact CG2-CG1 3.94Å; I392-V396 HydrophobicContact CG2-CG2 4.39Å; M393-V396 HydrophobicContact CB-CG2 4.24Å; M393-V396 VanDerWaalsContact O-CB 3.26Å; M393-V396 WeakPolarHBondContact O-CB 3.48Å; M393-V396 PolarHBondContact O-N 3.47Å; E394-V396 PolarHBondContact O-N 3.1Å; E394-V396 VanDerWaalsContact O-N 3.08Å
397	L	96.8	Very high	95.4	Very high	4 Å²	4	66.7 Å²	66.7	2%	0.021	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	117.3	-170.6	-62.3	171.6	0	0	0	110.5	F376 I392 E394 E395 P399 L405 I408 W420 P422	F376-L397 HydrophobicContact CB-CD2 4.05Å; F376-L397 HydrophobicContact CD1-CD2 3.84Å; F376-L397 HydrophobicContact CD2-CD2 4.23Å; F376-L397 HydrophobicContact CE1-CD2 4.31Å; F376-L397 HydrophobicContact CG-CD2 3.76Å; I392-L397 HydrophobicContact CG2-CD2 4.3Å; I392-L397 HydrophobicContact CG2-CG 4.25Å; E394-L397 PolarHBondContact O-N 3.46Å; E395-L397 VanDerWaalsContact C-N 3.3Å; L397-P399 WeakPolarHBondContact O-CD 3.46Å; L397-L405 HydrophobicContact CB-CD2 3.58Å; L397-L405 HydrophobicContact CD1-CD2 4.47Å; L397-I408 HydrophobicContact CD1-CD1 4.1Å; L397-I408 HydrophobicContact CD1-CG2 4.06Å; L397-I408 HydrophobicContact CD2-CD1 3.88Å; L397-I408 HydrophobicContact CG-CD1 4.44Å; L397-W420 HydrophobicContact CD1-CH2 4.22Å; L397-P422 HydrophobicContact CD1-CB 4.25Å
398	I	96.8	Very high	95.3	Very high	64 Å²	64	66.6 Å²	66.6	33%	0.328	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	115.2	178.6	-50.9	-55.7	0	0	0	109.3	E370 V371 S372 C373	E370-I398 HydrophobicContact CB-CD1 4.33Å; E370-I398 HydrophobicContact CB-CG1 3.98Å; E370-I398 HydrophobicContact CG-CD1 4.12Å; E370-I398 HydrophobicContact CG-CG1 4.3Å; V371-I398 PolarHBondContact O-N 2.71Å; S372-I398 WeakPolarHBondContact CA-O 3.4Å; C373-I398 PolarHBondContact N-O 3.07Å; C373-I398 PolarHBondContact SG-O 3.44Å
399	P	96.6	Very high	95.2	Very high	70 Å²	70	65.4 Å²	65.4	46%	0.455	33%	0.325	S	S	.	.			trans	-60.8	149.2	176.8	-26.6	37.9	0	0	0	112.5	L397 L405	L397-P399 WeakPolarHBondContact O-CD 3.46Å; P399-L405 HydrophobicContact CG-CD2 4.25Å; P399-L405 HydrophobicContact CG-CG 3.88Å
400	D	96.3	Very high	95.2	Very high	53 Å²	53	68.3 Å²	68.3	28%	0.283	33%	0.331	S	S	.	.			trans	-136.4	-172.4	177.3	60.3	41.8	0	0	0	111	S374 K402 Y403	S374-D400 WeakPolarHBondContact CA-OD2 3.5Å; S374-D400 WeakPolarHBondContact CB-OD2 3.33Å; S374-D400 PolarHBondContact N-OD2 3.27Å; S374-D400 PolarHBondContact OG-OD1 3.2Å; S374-D400 VanDerWaalsContact OG-OD1 3.14Å; S374-D400 PolarHBondContact OG-OD2 3.16Å; D400-K402 PolarHBondContact O-N 3.43Å; D400-K402 VanDerWaalsContact O-N 3.09Å; D400-K402 WeakPolarHBondContact OD1-CA 3.37Å; D400-K402 WeakPolarHBondContact OD1-CB 3.49Å; D400-K402 PolarHBondContact OD1-N 3.16Å; D400-Y403 PolarHBondContact N-O 2.93Å; D400-Y403 VanDerWaalsContact N-O 3.14Å; D400-Y403 PolarHBondContact OD1-N 2.78Å
401	Q	95.1	Very high	95.1	Very high	212 Å²	212	70.2 Å²	70.2	99%	0.991	34%	0.339	S	S	*	.	S	Bend	trans	-62.9	-16.9	-177.4	-60.8	179.2	16.7	0	0	113.5
402	K	95.5	Very high	95.1	Very high	134 Å²	134	67.3 Å²	67.3	58%	0.583	32%	0.319	S	S	*	.	S	Bend	trans	-105.3	-36.5	-172.6	-169.8	178.2	177.6	-170.6	0	112.6	D400	D400-K402 PolarHBondContact O-N 3.43Å; D400-K402 VanDerWaalsContact O-N 3.09Å; D400-K402 WeakPolarHBondContact OD1-CA 3.37Å; D400-K402 WeakPolarHBondContact OD1-CB 3.49Å; D400-K402 PolarHBondContact OD1-N 3.16Å
403	Y	96.1	Very high	95.1	Very high	32 Å²	32	68 Å²	68	13%	0.125	32%	0.324	C	S	.	.			trans	-134.4	132	-174.9	-64.9	-66.5	0	0	0	112.2	V377 D400 Q407 E411	V377-Y403 HydrophobicContact CB-CE2 4.12Å; V377-Y403 HydrophobicContact CG1-CE2 4.16Å; V377-Y403 HydrophobicContact CG2-CD2 4.2Å; V377-Y403 HydrophobicContact CG2-CE2 4.07Å; D400-Y403 PolarHBondContact N-O 2.93Å; D400-Y403 VanDerWaalsContact N-O 3.14Å; D400-Y403 PolarHBondContact OD1-N 2.78Å; Y403-Q407 HydrophobicContact CD1-CB 4.49Å; Y403-E411 HydrophobicContact CE1-CG 3.76Å
404	S	94.9	Very high	95.2	Very high	41 Å²	41	73.1 Å²	73.1	29%	0.287	35%	0.346	S	S	.	.			trans	-93.6	167	164.2	70.8	0	0	0	0	112	E406 Q407 I408	S404-E406 PolarHBondContact O-N 3.09Å; S404-Q407 VanDerWaalsContact N-OE1 3.17Å; S404-Q407 PolarHBondContact O-N 3.14Å; S404-Q407 WeakPolarHBondContact OG-CG 3.35Å; S404-I408 PolarHBondContact O-N 3.01Å; S404-I408 VanDerWaalsContact O-N 3.13Å
405	L	91.9	Very high	95.4	Very high	59 Å²	59	72 Å²	72	31%	0.309	34%	0.34	S	S	.	.	H	α-helix	trans	-59.6	-30.8	174.2	-67.5	-178.5	0	0	0	113	E394 L397 P399 Q407 I408	E394-L405 HydrophobicContact CG-CD1 4.37Å; L397-L405 HydrophobicContact CB-CD2 3.58Å; L397-L405 HydrophobicContact CD1-CD2 4.47Å; P399-L405 HydrophobicContact CG-CD2 4.25Å; P399-L405 HydrophobicContact CG-CG 3.88Å; L405-Q407 VanDerWaalsContact C-N 3.26Å; L405-Q407 PolarHBondContact O-N 3.06Å; L405-I408 WeakPolarHBondContact O-CG2 3.41Å
406	E	90	Very high	95.6	Very high	161 Å²	161	67.8 Å²	67.8	75%	0.752	32%	0.321	S	S	*	.	H	α-helix	trans	-73.3	-19.7	176.5	-63.9	177.3	175.6	0	0	112.7	S404 H409	S404-E406 PolarHBondContact O-N 3.09Å; E406-H409 PolarHBondContact O-CD2 3.27Å; E406-H409 PolarHBondContact O-NE2 3.2Å
407	Q	92	Very high	95.6	Very high	98 Å²	98	71.1 Å²	71.1	46%	0.458	36%	0.355	S	S	.	.	H	α-helix	trans	-97.2	-31.5	-176.5	-69.7	172.7	-24.3	0	0	112.8	Y403 S404 L405 H409 W410	Y403-Q407 HydrophobicContact CD1-CB 4.49Å; S404-Q407 VanDerWaalsContact N-OE1 3.17Å; S404-Q407 PolarHBondContact O-N 3.14Å; S404-Q407 WeakPolarHBondContact OG-CG 3.35Å; L405-Q407 VanDerWaalsContact C-N 3.26Å; L405-Q407 PolarHBondContact O-N 3.06Å; Q407-H409 VanDerWaalsContact C-N 3.29Å; Q407-H409 PolarHBondContact O-N 3.3Å; Q407-W410 PolarHBondContact O-N 2.93Å
408	I	95.1	Very high	95.6	Very high	0 Å²	0	75.8 Å²	75.8	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-60.2	-38.6	-171.7	-167.6	151.5	0	0	0	112.7	C373 F376 V377 L397 S404 L405 W410 E411 V412	C373-I408 HydrophobicContact CB-CD1 3.66Å; C373-I408 VanDerWaalsContact SG-CD1 3.55Å; F376-I408 HydrophobicContact CB-CD1 4.38Å; F376-I408 HydrophobicContact CD1-CD1 3.88Å; F376-I408 HydrophobicContact CD1-CG1 4.25Å; V377-I408 HydrophobicContact CG2-CD1 4.35Å; V377-I408 HydrophobicContact CG2-CG1 4.07Å; L397-I408 HydrophobicContact CD1-CD1 4.1Å; L397-I408 HydrophobicContact CD1-CG2 4.06Å; L397-I408 HydrophobicContact CD2-CD1 3.88Å; L397-I408 HydrophobicContact CG-CD1 4.44Å; S404-I408 PolarHBondContact O-N 3.01Å; S404-I408 VanDerWaalsContact O-N 3.13Å; L405-I408 WeakPolarHBondContact O-CG2 3.41Å; I408-W410 VanDerWaalsContact C-N 3.25Å; I408-W410 PolarHBondContact O-N 2.98Å; I408-E411 PolarHBondContact O-N 2.94Å; I408-V412 HydrophobicContact CG1-CG2 3.81Å; I408-V412 WeakPolarHBondContact O-CB 3.48Å; I408-V412 WeakPolarHBondContact O-CG2 3.37Å; I408-V412 PolarHBondContact O-N 3.3Å
409	H	95	Very high	95.7	Very high	32 Å²	32	78.4 Å²	78.4	15%	0.148	39%	0.391	C	S	.	.	H	α-helix	trans	-62.1	-33.7	-177.5	81	86.7	0	0	0	112.2	E406 Q407 S413 W420 F421	E406-H409 PolarHBondContact O-CD2 3.27Å; E406-H409 PolarHBondContact O-NE2 3.2Å; Q407-H409 VanDerWaalsContact C-N 3.29Å; Q407-H409 PolarHBondContact O-N 3.3Å; H409-S413 WeakPolarHBondContact O-CB 3.44Å; H409-S413 PolarHBondContact O-N 3.33Å; H409-S413 PolarHBondContact O-OG 3.37Å; H409-W420 HydrophobicContact CB-CE3 4.46Å; H409-F421 HydrophobicContact CB-CD1 3.89Å; H409-F421 HydrophobicContact CB-CE1 4.11Å; H409-F421 AromaticContact CE1-CE1 3.71Å; H409-F421 AromaticContact CG-CD1 3.94Å; H409-F421 AromaticContact CG-CE1 3.65Å; H409-F421 AromaticContact ND1-CE1 3.33Å; H409-F421 VanDerWaalsContact ND1-CE1 3.33Å; H409-F421 WeakPolarHBondContact ND1-CE1 3.44Å; H409-F421 AromaticContact ND1-CZ 3.84Å
410	W	96.1	Very high	95.7	Very high	187 Å²	187	75.9 Å²	75.9	71%	0.708	37%	0.373	S	S	*	.	H	α-helix	trans	-68.1	-48.3	176.6	-75.5	109.2	0	0	0	112.3	Q407 I408 S413 K414	Q407-W410 PolarHBondContact O-N 2.93Å; I408-W410 VanDerWaalsContact C-N 3.25Å; I408-W410 PolarHBondContact O-N 2.98Å; W410-S413 PolarHBondContact O-N 3.42Å; W410-K414 WeakPolarHBondContact O-CB 3.5Å; W410-K414 PolarHBondContact O-N 3.48Å
411	E	96.8	Very high	95.7	Very high	52 Å²	52	78.8 Å²	78.8	24%	0.243	38%	0.383	C	S	.	.	H	α-helix	trans	-68.3	-41.1	179.8	-76.2	-62.8	165.2	0	0	111.9	V377 Y403 I408 K414 H415	V377-E411 HydrophobicContact CG1-CB 4.28Å; V377-E411 HydrophobicContact CG2-CB 4.23Å; Y403-E411 HydrophobicContact CE1-CG 3.76Å; I408-E411 PolarHBondContact O-N 2.94Å; E411-K414 WeakPolarHBondContact O-CB 3.27Å; E411-K414 PolarHBondContact O-N 3.46Å; E411-K414 IonicContact OE1-NZ 3.97Å; E411-K414 IonicContact OE2-NZ 3.51Å; E411-H415 PolarHBondContact O-CD2 3.03Å; E411-H415 PolarHBondContact O-N 3.27Å; E411-H415 VanDerWaalsContact O-N 3.1Å; E411-H415 IonicContact OE2-NE2 3.25Å
412	V	97.5	Very high	95.8	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-62.1	-47.7	175.6	173.3	0	0	0	0	110.2	F376 V380 L390 I408 K414 H415 L416 W420	F376-V412 HydrophobicContact CD1-CG2 3.82Å; F376-V412 HydrophobicContact CE1-CG1 4.3Å; F376-V412 HydrophobicContact CE1-CG2 3.6Å; V380-V412 HydrophobicContact CG1-CG1 4.17Å; V380-V412 HydrophobicContact CG2-CG1 4.22Å; V380-V412 HydrophobicContact CG2-CG2 4.35Å; L390-V412 HydrophobicContact CD2-CG1 3.8Å; I408-V412 HydrophobicContact CG1-CG2 3.81Å; I408-V412 WeakPolarHBondContact O-CB 3.48Å; I408-V412 WeakPolarHBondContact O-CG2 3.37Å; I408-V412 PolarHBondContact O-N 3.3Å; V412-K414 VanDerWaalsContact C-N 3.28Å; V412-K414 PolarHBondContact O-N 3.25Å; V412-H415 PolarHBondContact O-N 2.74Å; V412-L416 HydrophobicContact CG1-CD1 3.72Å; V412-L416 HydrophobicContact CG1-CG 4.21Å; V412-L416 WeakPolarHBondContact O-CB 3.37Å; V412-L416 WeakPolarHBondContact O-CG 3.39Å; V412-L416 PolarHBondContact O-N 3.5Å; V412-W420 HydrophobicContact CB-CD2 4.3Å; V412-W420 HydrophobicContact CB-CE3 3.63Å; V412-W420 HydrophobicContact CB-CZ3 3.95Å; V412-W420 HydrophobicContact CG1-CB 4.26Å; V412-W420 HydrophobicContact CG1-CD2 3.46Å; V412-W420 VanDerWaalsContact CG1-CD2 3.46Å; V412-W420 HydrophobicContact CG1-CE3 3.3Å; V412-W420 HydrophobicContact CG1-CG 3.89Å; V412-W420 HydrophobicContact CG1-CH2 4.44Å; V412-W420 HydrophobicContact CG1-CZ3 3.83Å; V412-W420 HydrophobicContact CG2-CE3 4.23Å; V412-W420 HydrophobicContact CG2-CZ3 4.03Å
413	S	97.6	Very high	95.7	Very high	16 Å²	16	66.3 Å²	66.3	11%	0.112	33%	0.33	C	S	.	.	H	α-helix	trans	-57.7	-41.5	177.8	-65.4	0	0	0	0	112.5	H409 W410 L416 G417 R418 W420	H409-S413 WeakPolarHBondContact O-CB 3.44Å; H409-S413 PolarHBondContact O-N 3.33Å; H409-S413 PolarHBondContact O-OG 3.37Å; W410-S413 PolarHBondContact O-N 3.42Å; S413-L416 PolarHBondContact O-N 3.21Å; S413-G417 PolarHBondContact O-N 3.2Å; S413-R418 WeakPolarHBondContact CA-O 3.34Å; S413-R418 VanDerWaalsContact CB-O 3.28Å; S413-R418 WeakPolarHBondContact CB-O 3.47Å; S413-R418 PolarHBondContact O-N 2.97Å; S413-W420 PolarHBondContact OG-N 3.4Å; S413-W420 PolarHBondContact OG-O 3.11Å
414	K	97.2	Very high	95.6	Very high	143 Å²	143	71 Å²	71	62%	0.622	36%	0.355	S	S	*	.	H	α-helix	trans	-62.2	-43.7	177.9	176	-173.6	172.6	-168.4	0	112.2	W410 E411 V412	W410-K414 WeakPolarHBondContact O-CB 3.5Å; W410-K414 PolarHBondContact O-N 3.48Å; E411-K414 WeakPolarHBondContact O-CB 3.27Å; E411-K414 PolarHBondContact O-N 3.46Å; E411-K414 IonicContact OE1-NZ 3.97Å; E411-K414 IonicContact OE2-NZ 3.51Å; V412-K414 VanDerWaalsContact C-N 3.28Å; V412-K414 PolarHBondContact O-N 3.25Å
415	H	97.2	Very high	95.2	Very high	51 Å²	51	75.1 Å²	75.1	24%	0.236	37%	0.371	C	S	.	.	H	α-helix	trans	-74.7	-29.3	179.3	-72	-51.8	0	0	0	113.4	V380 E411 V412	V380-H415 HydrophobicContact CG1-CB 3.75Å; E411-H415 PolarHBondContact O-CD2 3.03Å; E411-H415 PolarHBondContact O-N 3.27Å; E411-H415 VanDerWaalsContact O-N 3.1Å; E411-H415 IonicContact OE2-NE2 3.25Å; V412-H415 PolarHBondContact O-N 2.74Å
416	L	96.9	Very high	95.1	Very high	14 Å²	14	76.2 Å²	76.2	7%	0.073	38%	0.382	C	S	.	.	H	α-helix	trans	-78.6	-28	174.2	-67.9	177.6	0	0	0	113.5	V380 L387 L390 V412 S413 R418 W420	V380-L416 HydrophobicContact CG1-CD2 3.94Å; V380-L416 HydrophobicContact CG1-CG 3.95Å; L387-L416 HydrophobicContact CB-CD2 3.76Å; L387-L416 HydrophobicContact CD1-CD2 4.26Å; L390-L416 HydrophobicContact CD2-CD1 3.78Å; L390-L416 HydrophobicContact CD2-CD2 4.41Å; V412-L416 HydrophobicContact CG1-CD1 3.72Å; V412-L416 HydrophobicContact CG1-CG 4.21Å; V412-L416 WeakPolarHBondContact O-CB 3.37Å; V412-L416 WeakPolarHBondContact O-CG 3.39Å; V412-L416 PolarHBondContact O-N 3.5Å; S413-L416 PolarHBondContact O-N 3.21Å; L416-R418 HydrophobicContact CB-CG 4.05Å; L416-W420 HydrophobicContact CD1-CB 3.79Å; L416-W420 HydrophobicContact CD1-CG 3.86Å
417	G	96.8	Very high	95	Very high	70 Å²	70	75.2 Å²	75.2	72%	0.722	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	19.2	-173.3	0	0	0	0	0	114	S413	S413-G417 PolarHBondContact O-N 3.2Å
418	R	97	Very high	94.6	Very high	102 Å²	102	83.8 Å²	83.8	39%	0.385	42%	0.415	S	S	.	.	S	Bend	trans	-152.3	157	177.1	61.8	-174.4	178.4	178.1	5.1	110	L387 S388 S413 L416 W420	L387-R418 PolarHBondContact O-NH2 3.09Å; S388-R418 PolarHBondContact O-NH1 2.89Å; S388-R418 PolarHBondContact O-NH2 2.87Å; S413-R418 WeakPolarHBondContact CA-O 3.34Å; S413-R418 VanDerWaalsContact CB-O 3.28Å; S413-R418 WeakPolarHBondContact CB-O 3.47Å; S413-R418 PolarHBondContact O-N 2.97Å; L416-R418 HydrophobicContact CB-CG 4.05Å; R418-W420 PolarHBondContact O-N 2.95Å
419	V	97.1	Very high	94.5	Very high	119 Å²	119	88 Å²	88	72%	0.721	44%	0.436	S	S	*	.			trans	-62.5	132.4	175.4	-179.5	0	0	0	0	109.3	F421	V419-F421 HydrophobicContact CG1-CD2 3.97Å; V419-F421 HydrophobicContact CG1-CE2 3.41Å; V419-F421 VanDerWaalsContact CG1-CE2 3.41Å; V419-F421 HydrophobicContact CG1-CZ 4.31Å
420	W	97.6	Very high	94.5	Very high	17 Å²	17	90.9 Å²	90.9	6%	0.064	45%	0.451	C	S	.	.			trans	-141.5	144.1	179	177.6	86.9	0	0	0	110.3	F376 L390 I392 L397 H409 V412 S413 L416 R418 P422	F376-W420 AromaticContact CE1-CH2 3.84Å; F376-W420 HydrophobicContact CE1-CH2 3.84Å; F376-W420 HydrophobicContact CE1-CZ2 4.23Å; F376-W420 HydrophobicContact CE1-CZ3 4.36Å; F376-W420 HydrophobicContact CZ-CH2 4.23Å; F376-W420 HydrophobicContact CZ-CZ2 4.2Å; L390-W420 HydrophobicContact CD2-CD2 4.34Å; L390-W420 HydrophobicContact CD2-CG 4.48Å; L390-W420 HydrophobicContact CD2-CZ2 4.21Å; L390-W420 HydrophobicContact CG-CZ2 4.27Å; L390-W420 PolarHBondContact O-NE1 2.89Å; I392-W420 HydrophobicContact CB-CZ2 4.04Å; I392-W420 HydrophobicContact CG1-CZ2 4.04Å; L397-W420 HydrophobicContact CD1-CH2 4.22Å; H409-W420 HydrophobicContact CB-CE3 4.46Å; V412-W420 HydrophobicContact CB-CD2 4.3Å; V412-W420 HydrophobicContact CB-CE3 3.63Å; V412-W420 HydrophobicContact CB-CZ3 3.95Å; V412-W420 HydrophobicContact CG1-CB 4.26Å; V412-W420 HydrophobicContact CG1-CD2 3.46Å; V412-W420 VanDerWaalsContact CG1-CD2 3.46Å; V412-W420 HydrophobicContact CG1-CE3 3.3Å; V412-W420 HydrophobicContact CG1-CG 3.89Å; V412-W420 HydrophobicContact CG1-CH2 4.44Å; V412-W420 HydrophobicContact CG1-CZ3 3.83Å; V412-W420 HydrophobicContact CG2-CE3 4.23Å; V412-W420 HydrophobicContact CG2-CZ3 4.03Å; S413-W420 PolarHBondContact OG-N 3.4Å; S413-W420 PolarHBondContact OG-O 3.11Å; L416-W420 HydrophobicContact CD1-CB 3.79Å; L416-W420 HydrophobicContact CD1-CG 3.86Å; R418-W420 PolarHBondContact O-N 2.95Å; W420-P422 HydrophobicContact CH2-CB 4.13Å
421	F	96.9	Very high	94.4	Very high	114 Å²	114	85.6 Å²	85.6	50%	0.5	44%	0.437	S	S	.	.			trans	-140.2	152.1	172.6	-68.3	-82.7	0	0	0	108.7	H409 V419	H409-F421 HydrophobicContact CB-CD1 3.89Å; H409-F421 HydrophobicContact CB-CE1 4.11Å; H409-F421 AromaticContact CE1-CE1 3.71Å; H409-F421 AromaticContact CG-CD1 3.94Å; H409-F421 AromaticContact CG-CE1 3.65Å; H409-F421 AromaticContact ND1-CE1 3.33Å; H409-F421 VanDerWaalsContact ND1-CE1 3.33Å; H409-F421 WeakPolarHBondContact ND1-CE1 3.44Å; H409-F421 AromaticContact ND1-CZ 3.84Å; V419-F421 HydrophobicContact CG1-CD2 3.97Å; V419-F421 HydrophobicContact CG1-CE2 3.41Å; V419-F421 VanDerWaalsContact CG1-CE2 3.41Å; V419-F421 HydrophobicContact CG1-CZ 4.31Å
422	P	96.2	Very high	94.3	Very high	18 Å²	18	87.5 Å²	87.5	12%	0.117	45%	0.448	C	S	.	.			trans	-63.8	153	167.5	29.6	-34.2	0	0	0	110.7	I392 E394 L397 W420	I392-P422 CarbonylContact O-C 3.39Å; I392-P422 VanDerWaalsContact O-CA 3.3Å; I392-P422 WeakPolarHBondContact O-CA 3.44Å; I392-P422 WeakPolarHBondContact O-CB 3.45Å; E394-P422 HydrophobicContact CB-CB 4.2Å; E394-P422 HydrophobicContact CB-CG 4.32Å; E394-P422 HydrophobicContact CG-CG 4.34Å; L397-P422 HydrophobicContact CD1-CB 4.25Å; W420-P422 HydrophobicContact CH2-CB 4.13Å
423	D	94.8	Very high	94.1	Very high	66 Å²	66	93 Å²	93	35%	0.353	48%	0.476	S	S	.	.	B	Isolated β-bridge	trans	-72.8	136.7	173.1	-63.7	-50.4	0	0	0	109.3	S391 I392 M393 E394	S391-D423 WeakPolarHBondContact CA-OD2 3.2Å; S391-D423 WeakPolarHBondContact CB-OD2 3.33Å; S391-D423 PolarHBondContact OG-OD2 2.67Å; I392-D423 PolarHBondContact N-OD2 2.85Å; I392-D423 PolarHBondContact O-N 3.44Å; M393-D423 WeakPolarHBondContact CA-O 3.45Å; M393-D423 HydrophobicContact SD-CB 3.64Å; E394-D423 PolarHBondContact N-O 3.27Å
424	M	92.8	Very high	93.9	Very high	131 Å²	131	98.1 Å²	98.1	65%	0.645	50%	0.501	S	S	*	.			trans	-118.8	136.8	-178.8	-69.4	179.9	-79.9	0	0	110.1	E394	E394-M424 HydrophobicContact CB-CG 4.41Å; E394-M424 WeakPolarHBondContact OE2-CG 3.33Å
425	M	87.6	Confident	93.6	Very high	127 Å²	127	94.9 Å²	94.9	63%	0.626	49%	0.492	S	S	*	.			trans	-85	136.1	169.9	-73.8	-66.6	145.6	0	0	110.6	M393 T427	M393-M425 HydrophobicContact CE-CE 3.37Å; M393-M425 HydrophobicContact SD-CE 3.58Å; M393-M425 VanDerWaalsContact SD-CE 3.58Å; M393-M425 HydrophobicContact SD-CG 4.14Å; M425-T427 PolarHBondContact O-N 2.89Å
426	P	89.5	Confident	93.4	Very high	82 Å²	82	98.3 Å²	98.3	53%	0.532	51%	0.512	S	S	.	.			trans	-56.6	138.1	172.3	-22.6	32.7	0	0	0	111.4	W428	P426-W428 VanDerWaalsContact C-N 3.32Å; P426-W428 HydrophobicContact CB-CD2 4.07Å; P426-W428 HydrophobicContact CB-CG 4.47Å; P426-W428 HydrophobicContact CB-CH2 4.44Å; P426-W428 HydrophobicContact CB-CZ2 3.89Å; P426-W428 PolarHBondContact O-N 3.13Å
427	T	86.9	Confident	93.1	Very high	140 Å²	140	105.3 Å²	105.3	86%	0.859	55%	0.548	S	S	*	.			trans	-93.3	16.3	-178.3	52.7	0	0	0	0	113.5	M425	M425-T427 PolarHBondContact O-N 2.89Å
428	W	83.7	Confident	92.7	Very high	278 Å²	278	108.5 Å²	108.5	100%	1.053	53%	0.532	S	S	*	.			trans	-124.7	0	-173.1	56.5	68.2	0	0	0	114.4	P426	P426-W428 VanDerWaalsContact C-N 3.32Å; P426-W428 HydrophobicContact CB-CD2 4.07Å; P426-W428 HydrophobicContact CB-CG 4.47Å; P426-W428 HydrophobicContact CB-CH2 4.44Å; P426-W428 HydrophobicContact CB-CZ2 3.89Å; P426-W428 PolarHBondContact O-N 3.13Å

Retrieved 428 of 428 residues in 79.7 ms (Link to these results)

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