A0A3B3TSN6_9TELE Loading...

Delta(3,5)-Delta(2,4)-dienoyl-CoA isomerase, mitochondrial

Isomerization of 3-trans,5-cis-dienoyl-CoA to 2-trans,4-trans-dienoyl-CoA.

AlphaFold DB , UniProt , Accession A0A3B3TSN6, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 308 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	38.7	Very low	32	Very low	245 Å²	245	153.4 Å²	153.4	100%	1.207	83%	0.833	S	S	*	*				0	123.2	0	-90.2	173.2	171.6	0	0	107.9
2	L	30.4	Very low	32.2	Very low	164 Å²	164	158.3 Å²	158.3	86%	0.859	84%	0.841	S	S	*	*			trans	-60.9	140.1	-171.4	-80.8	73.9	0	0	0	113.1	V4	L2-V4 HydrophobicContact CD2-CG2 4.24Å
3	S	29.6	Very low	32.3	Very low	117 Å²	117	163.6 Å²	163.6	82%	0.818	85%	0.845	S	S	*	*			trans	-129.3	106.4	152	62.8	0	0	0	0	108.8
4	V	33.3	Very low	32.1	Very low	103 Å²	103	157.4 Å²	157.4	62%	0.624	84%	0.841	S	S	*	*			trans	-79.7	122.3	-179.4	176.2	0	0	0	0	109.2	L2 F6	L2-V4 HydrophobicContact CD2-CG2 4.24Å; V4-F6 HydrophobicContact CG1-CD2 3.71Å; V4-F6 HydrophobicContact CG1-CE2 3.86Å
5	L	34	Very low	32.2	Very low	159 Å²	159	163.6 Å²	163.6	83%	0.832	85%	0.848	S	S	*	*			trans	-81.8	107.1	168.5	-86.8	149.2	0	0	0	109.2
6	F	31.1	Very low	32	Very low	195 Å²	195	163.1 Å²	163.1	86%	0.855	84%	0.843	S	S	*	*			trans	-93.2	107	162.1	-98.5	-87.6	0	0	0	109.2	V4	V4-F6 HydrophobicContact CG1-CD2 3.71Å; V4-F6 HydrophobicContact CG1-CE2 3.86Å
7	R	30.3	Very low	31.7	Very low	235 Å²	235	164.6 Å²	164.6	89%	0.887	84%	0.835	S	S	*	*			trans	-88.3	110.5	162.6	-78.6	-176	174.2	-154.9	-1	108.1
8	S	30.1	Very low	31.4	Very low	108 Å²	108	167.1 Å²	167.1	76%	0.755	83%	0.833	S	S	*	*			trans	-83.2	114	167.5	58.1	0	0	0	0	109.8
9	A	31.9	Very low	31.3	Very low	101 Å²	101	163.8 Å²	163.8	84%	0.835	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-84.5	116.1	168.8	0	0	0	0	0	109.5
10	L	31.8	Very low	31.3	Very low	157 Å²	157	161 Å²	161	82%	0.822	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-99.1	127	166.1	-80.9	158.4	0	0	0	108.5
11	P	31.2	Very low	31.1	Very low	103 Å²	103	159.1 Å²	159.1	67%	0.669	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-78.4	125.7	175.8	28	-27.9	0	0	0	110.9	Y13	P11-Y13 HydrophobicContact CB-CD2 4.38Å; P11-Y13 HydrophobicContact CB-CE2 4.3Å; P11-Y13 PolarHBondContact O-N 3.2Å
12	K	34.4	Very low	31.1	Very low	213 Å²	213	151.8 Å²	151.8	93%	0.926	78%	0.783	S	S	*	*			trans	-70.1	101.4	170	-69.6	-179.7	177.3	-179.6	0	109.8
13	Y	32.9	Very low	31.4	Very low	227 Å²	227	155 Å²	155	89%	0.89	78%	0.784	S	S	*	*			trans	-101.9	85.8	159.9	-81.1	-81.4	0	0	0	109.5	P11	P11-Y13 HydrophobicContact CB-CD2 4.38Å; P11-Y13 HydrophobicContact CB-CE2 4.3Å; P11-Y13 PolarHBondContact O-N 3.2Å
14	G	29.1	Very low	31.6	Very low	77 Å²	77	155.8 Å²	155.8	79%	0.794	78%	0.784	S	S	*	*			trans	-112.8	83.7	168.1	0	0	0	0	0	109.4	M16	G14-M16 PolarHBondContact O-N 3.35Å
15	R	33.7	Very low	32.2	Very low	250 Å²	250	154.4 Å²	154.4	94%	0.943	77%	0.772	S	S	*	*			trans	-84.1	102.5	167.1	-128.6	-179.5	-164	-124.9	4.3	107.1	W17	R15-W17 PolarHBondContact O-N 3.1Å; R15-W17 VanDerWaalsContact O-N 3.1Å
16	M	28.8	Very low	32.5	Very low	155 Å²	155	151.7 Å²	151.7	76%	0.764	77%	0.766	S	S	*	*			trans	-55.7	108.8	174	-176.7	176.7	2.4	0	0	109.5	G14 R18	G14-M16 PolarHBondContact O-N 3.35Å; M16-R18 PolarHBondContact O-N 3.34Å
17	W	27.7	Very low	33.2	Very low	190 Å²	190	145.9 Å²	145.9	72%	0.72	75%	0.75	S	S	*	*			trans	-61	119.8	169.3	-131.6	71.2	0	0	0	107.5	R15	R15-W17 PolarHBondContact O-N 3.1Å; R15-W17 VanDerWaalsContact O-N 3.1Å
18	R	27	Very low	34.3	Very low	209 Å²	209	136.3 Å²	136.3	79%	0.789	72%	0.719	S	S	*	*			trans	-103.5	114.2	169.3	-76.7	-170.2	170.9	-148.7	-2	107	M16 V20	M16-R18 PolarHBondContact O-N 3.34Å; R18-V20 PolarHBondContact O-N 3.44Å
19	P	28.3	Very low	35.9	Very low	104 Å²	104	139 Å²	139	68%	0.675	73%	0.725	S	S	*	*			trans	-66.2	126.9	176.9	23.5	-26.4	0	0	0	109
20	V	32.2	Very low	37.9	Very low	108 Å²	108	135.2 Å²	135.2	66%	0.655	70%	0.696	S	S	*	*			trans	-64.9	136.5	163.9	179.6	0	0	0	0	106.5	R18 V22	R18-V20 PolarHBondContact O-N 3.44Å; V20-V22 PolarHBondContact O-N 3.14Å
21	P	27.5	Very low	39.9	Very low	121 Å²	121	130.5 Å²	130.5	79%	0.786	67%	0.674	S	S	*	*			trans	-63.7	102.8	176.4	25.4	-31.9	0	0	0	108.8	R23	P21-R23 PolarHBondContact O-N 3.01Å; P21-R23 VanDerWaalsContact O-N 3.15Å
22	V	38.2	Very low	42.3	Very low	91 Å²	91	127.8 Å²	127.8	55%	0.552	66%	0.656	S	S	*	*			trans	-66.3	109.2	169.6	179.4	0	0	0	0	105.5	V20 T24	V20-V22 PolarHBondContact O-N 3.14Å; V22-T24 PolarHBondContact O-N 3.46Å; V22-T24 VanDerWaalsContact O-N 3.09Å
23	R	35.7	Very low	44.5	Very low	232 Å²	232	122 Å²	122	88%	0.875	65%	0.647	S	S	*	*			trans	-53.7	120	159.9	-99.7	-179.6	171.9	175.8	-2.1	105.2	P21 M25	P21-R23 PolarHBondContact O-N 3.01Å; P21-R23 VanDerWaalsContact O-N 3.15Å; R23-M25 PolarHBondContact O-N 2.96Å
24	T	34.4	Very low	47.2	Very low	134 Å²	134	115.9 Å²	115.9	82%	0.822	64%	0.635	S	S	*	*			trans	-38.9	114.3	172.7	29.2	0	0	0	0	108.1	V22 S26	V22-T24 PolarHBondContact O-N 3.46Å; V22-T24 VanDerWaalsContact O-N 3.09Å; T24-S26 PolarHBondContact O-N 3.38Å
25	M	46.6	Very low	50.4	Low	73 Å²	73	112.9 Å²	112.9	36%	0.36	60%	0.601	S	S	.	*			trans	-58.6	109.3	174.9	-73.7	-168.5	-177.5	0	0	105.8	R23 S27 P43 M234 L238	R23-M25 PolarHBondContact O-N 2.96Å; M25-S27 PolarHBondContact O-N 3.18Å; M25-P43 HydrophobicContact CE-CB 4.33Å; M25-M234 HydrophobicContact CE-CB 4.38Å; M25-M234 HydrophobicContact CE-CE 4.18Å; M25-M234 HydrophobicContact SD-CE 4.39Å; M25-L238 HydrophobicContact CE-CD1 3.14Å; M25-L238 HydrophobicContact CE-CD2 4.1Å; M25-L238 HydrophobicContact CE-CG 3.64Å
26	S	38.8	Very low	53.4	Low	102 Å²	102	104.9 Å²	104.9	71%	0.713	58%	0.58	S	S	*	*			trans	-61.7	98.3	160.4	177.1	0	0	0	0	104.8	T24 S28	T24-S26 PolarHBondContact O-N 3.38Å; S26-S28 PolarHBondContact O-N 3.02Å; S26-S28 VanDerWaalsContact O-N 3.08Å
27	S	47.2	Very low	56.7	Low	73 Å²	73	97.6 Å²	97.6	51%	0.51	54%	0.544	S	S	.	.			trans	-52.6	116.8	159.1	50.4	0	0	0	0	104.8	M25 D29	M25-S27 PolarHBondContact O-N 3.18Å; S27-D29 PolarHBondContact O-N 2.75Å
28	S	51.8	Low	60.1	Low	34 Å²	34	88.6 Å²	88.6	24%	0.238	51%	0.51	C	S	.	.			trans	-51.5	124	169.6	49.4	0	0	0	0	107.1	S26 G30 A39	S26-S28 PolarHBondContact O-N 3.02Å; S26-S28 VanDerWaalsContact O-N 3.08Å; S28-G30 PolarHBondContact O-N 2.88Å; S28-G30 PolarHBondContact OG-O 3.27Å; S28-A39 WeakPolarHBondContact OG-CB 3.2Å
29	D	65.3	Low	63.5	Low	166 Å²	166	78.7 Å²	78.7	89%	0.888	47%	0.473	S	S	*	.	S	Bend	trans	-63.4	9.6	-172.6	-73.5	-42.2	0	0	0	114	S27	S27-D29 PolarHBondContact O-N 2.75Å
30	G	73.1	Confident	66.8	Low	21 Å²	21	75.4 Å²	75.4	22%	0.216	45%	0.451	C	S	.	.	S	Bend	trans	-176.2	-178.5	176.9	0	0	0	0	0	112.8	S28 H53	S28-G30 PolarHBondContact O-N 2.88Å; S28-G30 PolarHBondContact OG-O 3.27Å; G30-H53 WeakPolarHBondContact CA-NE2 3.42Å
31	P	73.6	Confident	69.9	Low	57 Å²	57	72.2 Å²	72.2	37%	0.37	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-54.1	146.6	167.5	-22.4	33.9	0	0	0	111.7	F35 T36 L38	P31-F35 WeakPolarHBondContact CB-O 3.38Å; P31-T36 WeakPolarHBondContact CG-O 3.44Å; P31-L38 VanDerWaalsContact CA-O 3.29Å; P31-L38 WeakPolarHBondContact CA-O 3.38Å; P31-L38 WeakPolarHBondContact CB-O 3.49Å
32	T	82.8	Confident	73.2	Confident	47 Å²	47	71.9 Å²	71.9	29%	0.288	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-88.1	118.2	177.3	-56.3	0	0	0	0	108.8	F35 L38 V40	T32-F35 WeakPolarHBondContact O-CA 3.34Å; T32-F35 VanDerWaalsContact O-CB 3.3Å; T32-F35 WeakPolarHBondContact O-CB 3.33Å; T32-F35 WeakPolarHBondContact O-CD2 3.02Å; T32-F35 PolarHBondContact O-N 2.64Å; T32-L38 PolarHBondContact N-O 3.45Å; T32-V40 PolarHBondContact OG1-N 2.95Å; T32-V40 PolarHBondContact OG1-O 3.33Å
33	A	79.1	Confident	75.9	Confident	90 Å²	90	69.8 Å²	69.8	74%	0.744	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	135.2	176.8	0	0	0	0	0	110.9
34	P	89.3	Confident	78.8	Confident	99 Å²	99	60.5 Å²	60.5	64%	0.643	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	cis	-88.6	4.1	11.2	36.8	-37.3	0	0	0	115.3
35	F	96.7	Very high	81.6	Confident	14 Å²	14	62.2 Å²	62.2	6%	0.061	38%	0.381	C	S	.	.			trans	-76.1	146.9	-175.2	-50.7	-57.6	0	0	0	112.2	P31 T32 L38 V40 E68 E71 C72	P31-F35 WeakPolarHBondContact CB-O 3.38Å; T32-F35 WeakPolarHBondContact O-CA 3.34Å; T32-F35 VanDerWaalsContact O-CB 3.3Å; T32-F35 WeakPolarHBondContact O-CB 3.33Å; T32-F35 WeakPolarHBondContact O-CD2 3.02Å; T32-F35 PolarHBondContact O-N 2.64Å; F35-L38 HydrophobicContact CB-CB 4.04Å; F35-L38 HydrophobicContact CD2-CB 4.49Å; F35-L38 HydrophobicContact CG-CB 4.31Å; F35-V40 HydrophobicContact CD2-CG2 4Å; F35-V40 HydrophobicContact CE2-CG2 3.97Å; F35-E68 HydrophobicContact CD1-CB 3.75Å; F35-E68 HydrophobicContact CD1-CG 3.82Å; F35-E68 HydrophobicContact CE1-CB 4.36Å; F35-E71 HydrophobicContact CE1-CB 4.15Å; F35-C72 HydrophobicContact CE1-CB 4.13Å; F35-C72 HydrophobicContact CE2-CB 4.19Å; F35-C72 HydrophobicContact CZ-CB 3.71Å
36	T	97.2	Very high	84	Confident	83 Å²	83	59.5 Å²	59.5	51%	0.509	37%	0.369	S	S	.	.	S	Bend	trans	-111.3	-14.8	177.7	62	0	0	0	0	112.6	P31 E68	P31-T36 WeakPolarHBondContact CG-O 3.44Å; T36-E68 WeakPolarHBondContact CB-OE1 3.46Å; T36-E68 PolarHBondContact N-OE1 3.29Å; T36-E68 PolarHBondContact N-OE2 3.13Å; T36-E68 PolarHBondContact OG1-OE1 3.34Å
37	T	98.3	Very high	86.8	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.012	34%	0.335	C	S	.	.	S	Bend	trans	-121.6	-8	-175.6	70	0	0	0	0	113.6	H53 R54 N62 A64 F65 E68	T37-H53 PolarHBondContact O-N 3.5Å; T37-R54 HydrophobicContact CG2-CG 4.33Å; T37-N62 VanDerWaalsContact CG2-OD1 3.29Å; T37-N62 WeakPolarHBondContact CG2-OD1 3.25Å; T37-A64 HydrophobicContact CG2-CB 3.75Å; T37-F65 HydrophobicContact CG2-CB 4.22Å; T37-F65 VanDerWaalsContact OG1-CA 3.31Å; T37-F65 WeakPolarHBondContact OG1-CA 3.29Å; T37-E68 WeakPolarHBondContact CB-OE2 3.38Å; T37-E68 PolarHBondContact N-OE2 3.33Å; T37-E68 PolarHBondContact OG1-OE2 2.99Å
38	L	98.6	Very high	89.3	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	140.8	-178.3	-55.7	176.3	0	0	0	110.2	P31 T32 F35 V50 Q51 L52 F65 E68 M69 C72	P31-L38 VanDerWaalsContact CA-O 3.29Å; P31-L38 WeakPolarHBondContact CA-O 3.38Å; P31-L38 WeakPolarHBondContact CB-O 3.49Å; T32-L38 PolarHBondContact N-O 3.45Å; F35-L38 HydrophobicContact CB-CB 4.04Å; F35-L38 HydrophobicContact CD2-CB 4.49Å; F35-L38 HydrophobicContact CG-CB 4.31Å; L38-V50 HydrophobicContact CD1-CG1 4.39Å; L38-V50 HydrophobicContact CD2-CG1 4.27Å; L38-Q51 WeakPolarHBondContact CA-O 3.41Å; L38-L52 HydrophobicContact CD2-CD2 4.02Å; L38-F65 HydrophobicContact CD2-CD2 4.12Å; L38-F65 HydrophobicContact CD2-CE2 3.99Å; L38-E68 HydrophobicContact CD1-CB 4.02Å; L38-E68 HydrophobicContact CG-CB 4.46Å; L38-M69 HydrophobicContact CD1-CG 4.18Å; L38-M69 HydrophobicContact CD1-SD 3.74Å; L38-M69 HydrophobicContact CD2-CG 4.39Å; L38-M69 HydrophobicContact CD2-SD 3.67Å; L38-M69 HydrophobicContact CG-SD 4.36Å; L38-C72 HydrophobicContact CD1-CB 3.98Å
39	A	98.3	Very high	91.5	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.008	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	123.8	165.1	0	0	0	0	0	108.6	S28 Q51 H53	S28-A39 WeakPolarHBondContact OG-CB 3.2Å; A39-Q51 HydrophobicContact CB-CB 4.3Å; A39-Q51 PolarHBondContact N-O 2.86Å; A39-Q51 PolarHBondContact O-N 3.15Å; A39-H53 HydrophobicContact CB-CB 3.85Å
40	V	98.1	Very high	93.1	Very high	35 Å²	35	42.7 Å²	42.7	21%	0.212	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	126.8	-177.8	-173.6	0	0	0	0	109	T32 F35 T48 H49 V50	T32-V40 PolarHBondContact OG1-N 2.95Å; T32-V40 PolarHBondContact OG1-O 3.33Å; F35-V40 HydrophobicContact CD2-CG2 4Å; F35-V40 HydrophobicContact CE2-CG2 3.97Å; V40-T48 HydrophobicContact CG1-CG2 3.76Å; V40-H49 WeakPolarHBondContact CA-O 3.37Å; V40-V50 HydrophobicContact CG2-CG2 4.42Å
41	S	97.3	Very high	94.3	Very high	41 Å²	41	43 Å²	43	29%	0.287	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	170.8	-179.7	71	0	0	0	0	111.8	H49	S41-H49 PolarHBondContact N-O 3.09Å; S41-H49 PolarHBondContact O-N 2.86Å
42	Q	96.9	Very high	95.5	Very high	114 Å²	114	40.3 Å²	40.3	53%	0.533	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	84.3	177.3	-169.4	172.4	29.2	0	0	109.6	A44 V47	Q42-A44 VanDerWaalsContact C-N 3.26Å; Q42-A44 WeakPolarHBondContact CG-O 3.28Å; Q42-A44 PolarHBondContact O-N 2.99Å; Q42-V47 WeakPolarHBondContact CA-O 2.9Å; Q42-V47 WeakPolarHBondContact CG-O 3.39Å
43	P	95.7	Very high	96.3	Very high	47 Å²	47	39.4 Å²	39.4	31%	0.305	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	-17.6	-174.3	28.8	-37.4	0	0	0	113.7	M25 V47 H49 L238	M25-P43 HydrophobicContact CE-CB 4.33Å; P43-V47 WeakPolarHBondContact CD-O 3.43Å; P43-V47 HydrophobicContact CG-CG1 4.36Å; P43-H49 HydrophobicContact CG-CB 3.84Å; P43-L238 HydrophobicContact CB-CD2 3.97Å; P43-L238 HydrophobicContact CG-CD2 3.72Å
44	A	95.1	Very high	97.2	Very high	38 Å²	38	37.3 Å²	37.3	31%	0.314	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	163.1	175.9	0	0	0	0	0	110.3	Q42 S46 V47	Q42-A44 VanDerWaalsContact C-N 3.26Å; Q42-A44 WeakPolarHBondContact CG-O 3.28Å; Q42-A44 PolarHBondContact O-N 2.99Å; A44-S46 PolarHBondContact O-N 3.45Å; A44-V47 HydrophobicContact CB-CB 4.21Å; A44-V47 HydrophobicContact CB-CG2 4.17Å; A44-V47 PolarHBondContact O-N 3.1Å; A44-V47 VanDerWaalsContact O-N 3.1Å
45	E	93.4	Very high	97.5	Very high	170 Å²	170	35 Å²	35	79%	0.794	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	131.9	175.8	-173.8	177.6	-176.1	0	0	110.9	V47	E45-V47 PolarHBondContact O-N 2.95Å
46	S	97.4	Very high	97.6	Very high	15 Å²	15	39.1 Å²	39.1	11%	0.105	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	11.5	-178.6	-67.6	0	0	0	0	116.6	A44 T81 R83 V84	A44-S46 PolarHBondContact O-N 3.45Å; S46-T81 VanDerWaalsContact CA-O 3.27Å; S46-T81 WeakPolarHBondContact CA-O 3.23Å; S46-T81 VanDerWaalsContact CB-O 3.25Å; S46-T81 WeakPolarHBondContact CB-O 3.44Å; S46-T81 PolarHBondContact OG-O 3.41Å; S46-R83 PolarHBondContact O-N 2.66Å; S46-V84 PolarHBondContact O-N 3.11Å
47	V	98.4	Very high	97.6	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	115	175.7	-177.8	0	0	0	0	109.8	Q42 P43 A44 E45 V84 L86 L238 A241	Q42-V47 WeakPolarHBondContact CA-O 2.9Å; Q42-V47 WeakPolarHBondContact CG-O 3.39Å; P43-V47 WeakPolarHBondContact CD-O 3.43Å; P43-V47 HydrophobicContact CG-CG1 4.36Å; A44-V47 HydrophobicContact CB-CB 4.21Å; A44-V47 HydrophobicContact CB-CG2 4.17Å; A44-V47 PolarHBondContact O-N 3.1Å; A44-V47 VanDerWaalsContact O-N 3.1Å; E45-V47 PolarHBondContact O-N 2.95Å; V47-V84 WeakPolarHBondContact CA-O 3.4Å; V47-L86 HydrophobicContact CG1-CD1 4.02Å; V47-L86 HydrophobicContact CG1-CG 3.88Å; V47-L238 HydrophobicContact CG1-CD2 4.46Å; V47-A241 HydrophobicContact CG1-CB 3.89Å; V47-A241 HydrophobicContact CG2-CB 3.74Å
48	T	98.6	Very high	97.6	Very high	10 Å²	10	45.3 Å²	45.3	6%	0.061	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	129.3	172.6	-57.5	0	0	0	0	109.1	V40 V50 I76 C82 V84 V85 L86	V40-T48 HydrophobicContact CG1-CG2 3.76Å; T48-V50 HydrophobicContact CG2-CG2 4.41Å; T48-I76 HydrophobicContact CG2-CD1 4.07Å; T48-I76 HydrophobicContact CG2-CG1 4.26Å; T48-C82 PolarHBondContact OG1-SG 2.71Å; T48-V84 PolarHBondContact N-O 2.97Å; T48-V85 CarbonylContact O-C 2.98Å; T48-V85 VanDerWaalsContact O-CA 3.26Å; T48-V85 WeakPolarHBondContact O-CA 3.45Å; T48-L86 PolarHBondContact O-N 2.87Å
49	H	98.8	Very high	97.6	Very high	12 Å²	12	45.4 Å²	45.4	6%	0.056	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	118.5	175.6	174	-144.1	0	0	0	110	V40 S41 P43 L86 S88	V40-H49 WeakPolarHBondContact CA-O 3.37Å; S41-H49 PolarHBondContact N-O 3.09Å; S41-H49 PolarHBondContact O-N 2.86Å; P43-H49 HydrophobicContact CG-CB 3.84Å; H49-L86 WeakPolarHBondContact CA-O 3.39Å; H49-L86 HydrophobicContact CB-CB 4.4Å; H49-S88 PolarHBondContact CE1-OG 2.76Å; H49-S88 PolarHBondContact NE2-OG 3.18Å
50	V	98.8	Very high	97.6	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	110.9	174.6	-177.8	0	0	0	0	108.3	L38 V40 T48 F73 I76 V85 L86 I87 S88	L38-V50 HydrophobicContact CD1-CG1 4.39Å; L38-V50 HydrophobicContact CD2-CG1 4.27Å; V40-V50 HydrophobicContact CG2-CG2 4.42Å; T48-V50 HydrophobicContact CG2-CG2 4.41Å; V50-F73 HydrophobicContact CG2-CE2 4.38Å; V50-F73 HydrophobicContact CG2-CZ 4.47Å; V50-I76 HydrophobicContact CG2-CD1 3.64Å; V50-V85 HydrophobicContact CG2-CG1 3.95Å; V50-L86 PolarHBondContact N-O 3.47Å; V50-I87 HydrophobicContact CB-CG1 4.44Å; V50-I87 VanDerWaalsContact O-CA 3.25Å; V50-I87 WeakPolarHBondContact O-CA 3.38Å; V50-S88 PolarHBondContact O-N 3.29Å
51	Q	98.8	Very high	97.6	Very high	26 Å²	26	44.3 Å²	44.3	12%	0.121	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	129.5	178.6	-168.5	-178.6	50.5	0	0	110.5	L38 A39 H53 S88 G89 A90	L38-Q51 WeakPolarHBondContact CA-O 3.41Å; A39-Q51 HydrophobicContact CB-CB 4.3Å; A39-Q51 PolarHBondContact N-O 2.86Å; A39-Q51 PolarHBondContact O-N 3.15Å; Q51-H53 PolarHBondContact O-N 3.07Å; Q51-H53 PolarHBondContact OE1-ND1 3.44Å; Q51-S88 CarbonylContact C-O 3.55Å; Q51-S88 VanDerWaalsContact CA-O 3.28Å; Q51-S88 WeakPolarHBondContact CA-O 3.3Å; Q51-G89 PolarHBondContact NE2-O 2.88Å; Q51-A90 HydrophobicContact CG-CB 4.12Å
52	L	98.8	Very high	97.6	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	121.3	166.4	-41.5	-175.7	0	0	0	108.1	L38 N59 F65 I87 S88 A90 F94 L158	L38-L52 HydrophobicContact CD2-CD2 4.02Å; L52-N59 HydrophobicContact CB-CB 3.85Å; L52-N59 HydrophobicContact CD1-CB 4.44Å; L52-N59 PolarHBondContact O-OD1 3.32Å; L52-F65 HydrophobicContact CD2-CE2 3.63Å; L52-F65 HydrophobicContact CD2-CZ 4.23Å; L52-I87 HydrophobicContact CD2-CG2 4.35Å; L52-S88 PolarHBondContact N-O 3.42Å; L52-A90 VanDerWaalsContact O-CB 3.28Å; L52-A90 WeakPolarHBondContact O-CB 3.44Å; L52-A90 PolarHBondContact O-N 3.19Å; L52-F94 HydrophobicContact CD1-CE1 4.16Å; L52-F94 HydrophobicContact CD1-CE2 4.38Å; L52-F94 HydrophobicContact CD1-CZ 4.08Å; L52-L158 HydrophobicContact CD1-CD1 4.18Å; L52-L158 HydrophobicContact CD2-CD1 4.15Å
53	H	98.2	Very high	97.5	Very high	28 Å²	28	42.1 Å²	42.1	13%	0.13	23%	0.231	C	C	.	.			trans	-130.4	61.5	-164.1	-155.8	96.3	0	0	0	112.1	G30 T37 A39 Q51 P55	G30-H53 WeakPolarHBondContact CA-NE2 3.42Å; T37-H53 PolarHBondContact O-N 3.5Å; A39-H53 HydrophobicContact CB-CB 3.85Å; Q51-H53 PolarHBondContact O-N 3.07Å; Q51-H53 PolarHBondContact OE1-ND1 3.44Å; H53-P55 VanDerWaalsContact C-CD 3.41Å
54	R	97.8	Very high	97.6	Very high	45 Å²	45	40.6 Å²	40.6	17%	0.17	22%	0.222	C	C	.	.			trans	-128.4	58.8	162.6	-58.1	175.9	69.4	-141	7	109.5	T37 A56 K57 L58 N59 A60 D99	T37-R54 HydrophobicContact CG2-CG 4.33Å; R54-A56 VanDerWaalsContact C-N 3.28Å; R54-A56 PolarHBondContact O-N 2.9Å; R54-K57 HydrophobicContact CB-CB 4.31Å; R54-K57 CarbonylContact O-C 3.58Å; R54-K57 VanDerWaalsContact O-C 3.31Å; R54-K57 WeakPolarHBondContact O-CA 3.35Å; R54-K57 PolarHBondContact O-N 3.21Å; R54-L58 PolarHBondContact O-N 3.31Å; R54-N59 PolarHBondContact N-OD1 2.71Å; R54-N59 PolarHBondContact O-N 3.48Å; R54-N59 PolarHBondContact O-OD1 3.28Å; R54-A60 PolarHBondContact NH1-O 3.44Å; R54-D99 IonicContact CZ-OD2 3.37Å; R54-D99 IonicContact NH1-OD2 2.7Å; R54-D99 PolarHBondContact NH1-OD2 2.96Å; R54-D99 IonicContact NH2-OD2 3.12Å; R54-D99 PolarHBondContact NH2-OD2 3.29Å
55	P	97.4	Very high	97.7	Very high	52 Å²	52	39 Å²	39	34%	0.338	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-60	-35.9	-169.5	22.9	-33.9	0	0	0	113	H53 K57 L58 A90	H53-P55 VanDerWaalsContact C-CD 3.41Å; P55-K57 PolarHBondContact O-N 3.35Å; P55-K57 VanDerWaalsContact O-N 3.12Å; P55-L58 PolarHBondContact O-N 2.85Å; P55-A90 HydrophobicContact CB-CB 4.1Å; P55-A90 HydrophobicContact CG-CB 4.19Å
56	A	97	Very high	98	Very high	100 Å²	100	31.3 Å²	31.3	83%	0.826	17%	0.172	S	C	*	.	G	3₁₀ helix	trans	-64.1	-14.6	174.8	0	0	0	0	0	114.2	R54	R54-A56 VanDerWaalsContact C-N 3.28Å; R54-A56 PolarHBondContact O-N 2.9Å
57	K	97.7	Very high	98	Very high	133 Å²	133	36.6 Å²	36.6	58%	0.578	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-118.7	22.2	175.3	-61.9	-66.1	-174.3	176.8	0	111.5	R54 P55 N59 A60	R54-K57 HydrophobicContact CB-CB 4.31Å; R54-K57 CarbonylContact O-C 3.58Å; R54-K57 VanDerWaalsContact O-C 3.31Å; R54-K57 WeakPolarHBondContact O-CA 3.35Å; R54-K57 PolarHBondContact O-N 3.21Å; P55-K57 PolarHBondContact O-N 3.35Å; P55-K57 VanDerWaalsContact O-N 3.12Å; K57-N59 PolarHBondContact O-N 2.86Å; K57-N59 VanDerWaalsContact O-N 3.1Å; K57-A60 WeakPolarHBondContact O-CB 3.45Å; K57-A60 PolarHBondContact O-N 2.96Å
58	L	98.1	Very high	98	Very high	81 Å²	81	36.6 Å²	36.6	42%	0.424	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	34.8	-179.9	-55.2	177.2	0	0	0	112.7	R54 P55 A60 T93 T95 A96	R54-L58 PolarHBondContact O-N 3.31Å; P55-L58 PolarHBondContact O-N 2.85Å; L58-A60 PolarHBondContact O-N 2.69Å; L58-T93 HydrophobicContact CB-CG2 3.82Å; L58-T93 HydrophobicContact CD2-CG2 4.13Å; L58-T93 HydrophobicContact CG-CG2 4.5Å; L58-T95 CarbonylContact O-C 3.33Å; L58-T95 WeakPolarHBondContact O-CA 3.41Å; L58-A96 HydrophobicContact CB-CB 3.81Å; L58-A96 HydrophobicContact CD1-CB 4.5Å; L58-A96 PolarHBondContact O-N 3.03Å
59	N	98.6	Very high	98	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.016	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	34.7	-176.4	-51.2	-39.5	0	0	0	114.1	L52 R54 K57 A90 T93 F94 T95	L52-N59 HydrophobicContact CB-CB 3.85Å; L52-N59 HydrophobicContact CD1-CB 4.44Å; L52-N59 PolarHBondContact O-OD1 3.32Å; R54-N59 PolarHBondContact N-OD1 2.71Å; R54-N59 PolarHBondContact O-N 3.48Å; R54-N59 PolarHBondContact O-OD1 3.28Å; K57-N59 PolarHBondContact O-N 2.86Å; K57-N59 VanDerWaalsContact O-N 3.1Å; N59-A90 PolarHBondContact ND2-N 3.04Å; N59-A90 PolarHBondContact ND2-O 2.94Å; N59-T93 PolarHBondContact ND2-O 3.47Å; N59-T93 VanDerWaalsContact ND2-O 3.08Å; N59-F94 VanDerWaalsContact CB-O 3.31Å; N59-F94 WeakPolarHBondContact CB-O 3.26Å; N59-F94 PolarHBondContact ND2-O 2.75Å; N59-T95 PolarHBondContact O-OG1 2.68Å
60	A	98.4	Very high	98	Very high	12 Å²	12	36.6 Å²	36.6	10%	0.099	19%	0.19	C	C	.	.			trans	-57.9	146.9	172.8	0	0	0	0	0	111.3	R54 K57 L58 N62 G97 D99	R54-A60 PolarHBondContact NH1-O 3.44Å; K57-A60 WeakPolarHBondContact O-CB 3.45Å; K57-A60 PolarHBondContact O-N 2.96Å; L58-A60 PolarHBondContact O-N 2.69Å; A60-N62 PolarHBondContact O-N 2.97Å; A60-G97 CarbonylContact C-O 3.58Å; A60-G97 VanDerWaalsContact CA-O 3.23Å; A60-G97 WeakPolarHBondContact CA-O 3.29Å; A60-D99 HydrophobicContact CB-CB 3.9Å
61	M	98.4	Very high	98	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-94.8	96.7	-172.1	-60.2	176	-179.2	0	0	110	F65 W66 T95 G97 D99 F133 L158	M61-F65 HydrophobicContact CB-CB 4.47Å; M61-F65 HydrophobicContact CB-CD1 3.53Å; M61-F65 HydrophobicContact CB-CE1 3.98Å; M61-F65 HydrophobicContact CB-CG 4.07Å; M61-F65 HydrophobicContact CE-CE1 4.03Å; M61-F65 HydrophobicContact CE-CZ 4.01Å; M61-F65 HydrophobicContact CG-CD1 3.55Å; M61-F65 HydrophobicContact CG-CE1 3.5Å; M61-F65 VanDerWaalsContact CG-CE1 3.5Å; M61-F65 HydrophobicContact CG-CG 4.11Å; M61-F65 HydrophobicContact CG-CZ 4.02Å; M61-F65 HydrophobicContact SD-CD1 4.12Å; M61-F65 HydrophobicContact SD-CE1 3.56Å; M61-F65 VanDerWaalsContact SD-CE1 3.56Å; M61-F65 HydrophobicContact SD-CZ 4.15Å; M61-W66 HydrophobicContact CB-CZ2 3.79Å; M61-W66 PolarHBondContact O-NE1 3.07Å; M61-W66 HydrophobicContact SD-CH2 4.08Å; M61-W66 HydrophobicContact SD-CZ2 4.12Å; M61-T95 HydrophobicContact CE-CG2 3.86Å; M61-G97 PolarHBondContact N-O 2.77Å; M61-D99 WeakPolarHBondContact O-CB 3.07Å; M61-D99 PolarHBondContact O-N 3.22Å; M61-F133 HydrophobicContact CE-CZ 4.29Å; M61-F133 HydrophobicContact SD-CZ 3.89Å; M61-L158 HydrophobicContact CE-CD1 4.17Å
62	N	97.3	Very high	98	Very high	22 Å²	22	38.7 Å²	38.7	12%	0.118	20%	0.2	C	C	.	.			trans	-91.8	179.2	179	76	-14.6	0	0	0	111.3	T37 A60 A64 F65 W66 D99 D102	T37-N62 VanDerWaalsContact CG2-OD1 3.29Å; T37-N62 WeakPolarHBondContact CG2-OD1 3.25Å; A60-N62 PolarHBondContact O-N 2.97Å; N62-A64 PolarHBondContact O-N 3.2Å; N62-A64 VanDerWaalsContact O-N 3.14Å; N62-A64 PolarHBondContact OD1-N 3.45Å; N62-F65 WeakPolarHBondContact O-CB 3.22Å; N62-F65 PolarHBondContact O-N 3.38Å; N62-F65 VanDerWaalsContact O-N 3.08Å; N62-F65 PolarHBondContact OD1-N 2.86Å; N62-F65 VanDerWaalsContact OD1-N 3.11Å; N62-W66 PolarHBondContact O-N 3.19Å; N62-D99 HydrophobicContact CB-CB 4.01Å; N62-D102 HydrophobicContact CB-CB 4Å; N62-D102 VanDerWaalsContact CB-OD2 3.29Å; N62-D102 WeakPolarHBondContact CB-OD2 3.35Å
63	K	95.4	Very high	98	Very high	88 Å²	88	38.6 Å²	38.6	38%	0.383	20%	0.2	S	C	.	.	H	α-helix	trans	-50.9	-40.8	-179.1	-73.4	-178.9	-163.7	-150.5	0	113.9	D102 M103 D106	K63-D102 WeakPolarHBondContact CE-O 3.22Å; K63-D102 WeakPolarHBondContact CG-OD2 3.23Å; K63-D102 PolarHBondContact N-OD2 3.16Å; K63-M103 HydrophobicContact CB-CE 4.4Å; K63-M103 HydrophobicContact CD-CE 4.23Å; K63-M103 HydrophobicContact CG-CE 3.3Å; K63-D106 WeakPolarHBondContact CE-OD2 3.42Å; K63-D106 IonicContact NZ-OD1 3.81Å; K63-D106 PolarHBondContact NZ-OD1 2.81Å; K63-D106 IonicContact NZ-OD2 3.11Å; K63-D106 PolarHBondContact NZ-OD2 2.83Å; K63-D106 VanDerWaalsContact NZ-OD2 3.12Å
64	A	97	Very high	98	Very high	14 Å²	14	42 Å²	42	12%	0.116	22%	0.216	C	C	.	.	H	α-helix	trans	-65.8	-44.4	-179.2	0	0	0	0	0	111.4	T37 N62 W66 R67 E68	T37-A64 HydrophobicContact CG2-CB 3.75Å; N62-A64 PolarHBondContact O-N 3.2Å; N62-A64 VanDerWaalsContact O-N 3.14Å; N62-A64 PolarHBondContact OD1-N 3.45Å; A64-W66 VanDerWaalsContact C-N 3.31Å; A64-W66 PolarHBondContact O-N 3.48Å; A64-R67 PolarHBondContact O-N 3.48Å; A64-R67 VanDerWaalsContact O-N 3.08Å; A64-E68 WeakPolarHBondContact O-CB 3.48Å; A64-E68 VanDerWaalsContact O-CG 3.25Å; A64-E68 WeakPolarHBondContact O-CG 3.49Å; A64-E68 PolarHBondContact O-N 2.76Å
65	F	98.5	Very high	98	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.018	23%	0.233	C	C	.	.	H	α-helix	trans	-52.9	-47.2	178.4	174.7	-92.9	0	0	0	112.9	T37 L38 L52 M61 N62 R67 E68 M69 T132 F133 L158	T37-F65 HydrophobicContact CG2-CB 4.22Å; T37-F65 VanDerWaalsContact OG1-CA 3.31Å; T37-F65 WeakPolarHBondContact OG1-CA 3.29Å; L38-F65 HydrophobicContact CD2-CD2 4.12Å; L38-F65 HydrophobicContact CD2-CE2 3.99Å; L52-F65 HydrophobicContact CD2-CE2 3.63Å; L52-F65 HydrophobicContact CD2-CZ 4.23Å; M61-F65 HydrophobicContact CB-CB 4.47Å; M61-F65 HydrophobicContact CB-CD1 3.53Å; M61-F65 HydrophobicContact CB-CE1 3.98Å; M61-F65 HydrophobicContact CB-CG 4.07Å; M61-F65 HydrophobicContact CE-CE1 4.03Å; M61-F65 HydrophobicContact CE-CZ 4.01Å; M61-F65 HydrophobicContact CG-CD1 3.55Å; M61-F65 HydrophobicContact CG-CE1 3.5Å; M61-F65 VanDerWaalsContact CG-CE1 3.5Å; M61-F65 HydrophobicContact CG-CG 4.11Å; M61-F65 HydrophobicContact CG-CZ 4.02Å; M61-F65 HydrophobicContact SD-CD1 4.12Å; M61-F65 HydrophobicContact SD-CE1 3.56Å; M61-F65 VanDerWaalsContact SD-CE1 3.56Å; M61-F65 HydrophobicContact SD-CZ 4.15Å; N62-F65 WeakPolarHBondContact O-CB 3.22Å; N62-F65 PolarHBondContact O-N 3.38Å; N62-F65 VanDerWaalsContact O-N 3.08Å; N62-F65 PolarHBondContact OD1-N 2.86Å; N62-F65 VanDerWaalsContact OD1-N 3.11Å; F65-R67 PolarHBondContact O-N 3.18Å; F65-E68 PolarHBondContact O-N 3.11Å; F65-M69 HydrophobicContact CD1-CG 4.43Å; F65-M69 HydrophobicContact CD2-CG 4.06Å; F65-M69 HydrophobicContact CE1-CG 4Å; F65-M69 HydrophobicContact CE2-CG 3.57Å; F65-M69 HydrophobicContact CE2-SD 3.92Å; F65-M69 HydrophobicContact CG-CG 4.47Å; F65-M69 HydrophobicContact CZ-CG 3.55Å; F65-M69 HydrophobicContact CZ-SD 4.12Å; F65-M69 WeakPolarHBondContact O-CG 3.35Å; F65-M69 PolarHBondContact O-N 2.87Å; F65-M69 VanDerWaalsContact O-N 3.08Å; F65-T132 HydrophobicContact CD1-CG2 4.36Å; F65-T132 HydrophobicContact CE1-CG2 4Å; F65-F133 AromaticContact CE1-CE1 3.97Å; F65-F133 HydrophobicContact CE1-CE1 3.97Å; F65-F133 HydrophobicContact CE1-CZ 4.26Å; F65-F133 HydrophobicContact CZ-CE1 4.26Å; F65-L158 HydrophobicContact CZ-CD1 4.15Å
66	W	97.9	Very high	98	Very high	9 Å²	9	43.1 Å²	43.1	3%	0.034	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-34.2	-178.6	-61.6	104.7	0	0	0	112.8	M61 N62 A64 L98 M103 Y129 T132 F133 V186	M61-W66 HydrophobicContact CB-CZ2 3.79Å; M61-W66 PolarHBondContact O-NE1 3.07Å; M61-W66 HydrophobicContact SD-CH2 4.08Å; M61-W66 HydrophobicContact SD-CZ2 4.12Å; N62-W66 PolarHBondContact O-N 3.19Å; A64-W66 VanDerWaalsContact C-N 3.31Å; A64-W66 PolarHBondContact O-N 3.48Å; W66-L98 HydrophobicContact CZ2-CD1 3.57Å; W66-M103 PolarHBondContact NE1-SD 3.24Å; W66-M103 VanDerWaalsContact NE1-SD 3.4Å; W66-Y129 HydrophobicContact CB-CD1 3.61Å; W66-Y129 HydrophobicContact CB-CE1 3.61Å; W66-Y129 AromaticContact CD1-CE1 3.89Å; W66-Y129 AromaticContact CD2-CD1 3.84Å; W66-Y129 HydrophobicContact CD2-CD1 3.84Å; W66-Y129 HydrophobicContact CD2-CD2 4.33Å; W66-Y129 HydrophobicContact CD2-CE1 4.21Å; W66-Y129 AromaticContact CD2-CG 3.91Å; W66-Y129 HydrophobicContact CD2-CG 3.91Å; W66-Y129 HydrophobicContact CE3-CD1 4.01Å; W66-Y129 HydrophobicContact CE3-CD2 4.49Å; W66-Y129 AromaticContact CE3-CG 3.83Å; W66-Y129 HydrophobicContact CE3-CG 3.83Å; W66-Y129 AromaticContact CG-CD1 3.63Å; W66-Y129 HydrophobicContact CG-CD1 3.63Å; W66-Y129 AromaticContact CG-CE1 3.62Å; W66-Y129 HydrophobicContact CG-CE1 3.62Å; W66-Y129 HydrophobicContact CG-CG 4.19Å; W66-Y129 HydrophobicContact CZ3-CG 4.43Å; W66-T132 WeakPolarHBondContact CA-OG1 3.36Å; W66-T132 HydrophobicContact CD2-CG2 4.42Å; W66-T132 HydrophobicContact CE3-CG2 3.64Å; W66-T132 HydrophobicContact CZ3-CG2 4.21Å; W66-T132 PolarHBondContact O-OG1 2.89Å; W66-F133 HydrophobicContact CE3-CZ 4.47Å; W66-F133 AromaticContact CH2-CE2 3.85Å; W66-F133 HydrophobicContact CH2-CE2 3.85Å; W66-F133 AromaticContact CH2-CZ 3.8Å; W66-F133 HydrophobicContact CH2-CZ 3.8Å; W66-F133 HydrophobicContact CZ3-CD2 4.37Å; W66-F133 HydrophobicContact CZ3-CE1 4.46Å; W66-F133 AromaticContact CZ3-CE2 3.47Å; W66-F133 HydrophobicContact CZ3-CE2 3.47Å; W66-F133 VanDerWaalsContact CZ3-CE2 3.47Å; W66-F133 AromaticContact CZ3-CZ 3.53Å; W66-F133 HydrophobicContact CZ3-CZ 3.53Å; W66-V186 HydrophobicContact CH2-CG2 4.32Å; W66-V186 HydrophobicContact CZ3-CG1 4.43Å; W66-V186 HydrophobicContact CZ3-CG2 4.41Å
67	R	98	Very high	98.1	Very high	127 Å²	127	40 Å²	40	48%	0.479	19%	0.191	S	C	.	.	H	α-helix	trans	-81.7	-48.7	176.2	-176.8	-167.3	64.8	-115.5	-7.9	111.8	A64 F65 M69 V70 E71	A64-R67 PolarHBondContact O-N 3.48Å; A64-R67 VanDerWaalsContact O-N 3.08Å; F65-R67 PolarHBondContact O-N 3.18Å; R67-M69 VanDerWaalsContact C-N 3.31Å; R67-M69 PolarHBondContact O-N 3.46Å; R67-V70 WeakPolarHBondContact O-CB 3.44Å; R67-V70 PolarHBondContact O-N 3.07Å; R67-E71 WeakPolarHBondContact CD-OE1 3.21Å; R67-E71 HydrophobicContact CG-CG 4.41Å; R67-E71 WeakPolarHBondContact CG-OE1 3.21Å; R67-E71 IonicContact NE-OE1 3.51Å; R67-E71 PolarHBondContact NE-OE1 3.4Å; R67-E71 IonicContact NE-OE2 2.71Å; R67-E71 PolarHBondContact O-N 3.36Å; R67-E71 VanDerWaalsContact O-N 3.13Å
68	E	98.6	Very high	98.1	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-64	-34	-172.1	-71.5	179.3	-179.1	0	0	112.5	F35 T36 T37 L38 A64 F65 V70 E71 C72	F35-E68 HydrophobicContact CD1-CB 3.75Å; F35-E68 HydrophobicContact CD1-CG 3.82Å; F35-E68 HydrophobicContact CE1-CB 4.36Å; T36-E68 WeakPolarHBondContact CB-OE1 3.46Å; T36-E68 PolarHBondContact N-OE1 3.29Å; T36-E68 PolarHBondContact N-OE2 3.13Å; T36-E68 PolarHBondContact OG1-OE1 3.34Å; T37-E68 WeakPolarHBondContact CB-OE2 3.38Å; T37-E68 PolarHBondContact N-OE2 3.33Å; T37-E68 PolarHBondContact OG1-OE2 2.99Å; L38-E68 HydrophobicContact CD1-CB 4.02Å; L38-E68 HydrophobicContact CG-CB 4.46Å; A64-E68 WeakPolarHBondContact O-CB 3.48Å; A64-E68 VanDerWaalsContact O-CG 3.25Å; A64-E68 WeakPolarHBondContact O-CG 3.49Å; A64-E68 PolarHBondContact O-N 2.76Å; F65-E68 PolarHBondContact O-N 3.11Å; E68-V70 VanDerWaalsContact C-N 3.33Å; E68-V70 PolarHBondContact O-N 3.35Å; E68-E71 PolarHBondContact O-N 3.38Å; E68-C72 WeakPolarHBondContact O-CB 3.46Å; E68-C72 PolarHBondContact O-N 3.02Å
69	M	98.8	Very high	98.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.5	-39.7	173.1	-77	-67	-63.7	0	0	112.4	L38 F65 R67 F73 T132 L136	L38-M69 HydrophobicContact CD1-CG 4.18Å; L38-M69 HydrophobicContact CD1-SD 3.74Å; L38-M69 HydrophobicContact CD2-CG 4.39Å; L38-M69 HydrophobicContact CD2-SD 3.67Å; L38-M69 HydrophobicContact CG-SD 4.36Å; F65-M69 HydrophobicContact CD1-CG 4.43Å; F65-M69 HydrophobicContact CD2-CG 4.06Å; F65-M69 HydrophobicContact CE1-CG 4Å; F65-M69 HydrophobicContact CE2-CG 3.57Å; F65-M69 HydrophobicContact CE2-SD 3.92Å; F65-M69 HydrophobicContact CG-CG 4.47Å; F65-M69 HydrophobicContact CZ-CG 3.55Å; F65-M69 HydrophobicContact CZ-SD 4.12Å; F65-M69 WeakPolarHBondContact O-CG 3.35Å; F65-M69 PolarHBondContact O-N 2.87Å; F65-M69 VanDerWaalsContact O-N 3.08Å; R67-M69 VanDerWaalsContact C-N 3.31Å; R67-M69 PolarHBondContact O-N 3.46Å; M69-F73 HydrophobicContact CE-CD2 3.9Å; M69-F73 HydrophobicContact CE-CE2 3.6Å; M69-F73 WeakPolarHBondContact O-CB 3.36Å; M69-F73 WeakPolarHBondContact O-CD2 3.38Å; M69-F73 PolarHBondContact O-N 3.16Å; M69-F73 HydrophobicContact SD-CE2 4.43Å; M69-T132 HydrophobicContact CB-CG2 3.66Å; M69-T132 HydrophobicContact CG-CG2 4.03Å; M69-L136 HydrophobicContact CE-CD1 4.38Å; M69-L136 HydrophobicContact CE-CD2 4.16Å; M69-L136 HydrophobicContact CE-CG 4.49Å
70	V	98.8	Very high	98.1	Very high	22 Å²	22	42.4 Å²	42.4	13%	0.133	21%	0.208	C	C	.	.	H	α-helix	trans	-64.1	-50.7	176.8	177.6	0	0	0	0	109.9	R67 E68 C72 F73 Q74 E131 V135	R67-V70 WeakPolarHBondContact O-CB 3.44Å; R67-V70 PolarHBondContact O-N 3.07Å; E68-V70 VanDerWaalsContact C-N 3.33Å; E68-V70 PolarHBondContact O-N 3.35Å; V70-C72 PolarHBondContact O-N 3Å; V70-F73 PolarHBondContact O-N 2.84Å; V70-Q74 WeakPolarHBondContact O-CB 3.4Å; V70-Q74 VanDerWaalsContact O-CG 3.23Å; V70-Q74 WeakPolarHBondContact O-CG 3.37Å; V70-Q74 PolarHBondContact O-N 2.99Å; V70-E131 HydrophobicContact CG1-CG 4.33Å; V70-E131 HydrophobicContact CG2-CB 4.39Å; V70-E131 HydrophobicContact CG2-CG 4.13Å; V70-V135 HydrophobicContact CB-CG1 4.39Å; V70-V135 HydrophobicContact CG1-CG1 4.04Å; V70-V135 HydrophobicContact CG2-CG1 4.35Å
71	E	98.6	Very high	98	Very high	67 Å²	67	45 Å²	45	31%	0.313	22%	0.223	S	C	.	.	H	α-helix	trans	-59.5	-45.3	178.8	-67.4	167.8	176.3	0	0	111.6	F35 R67 E68 Q74 Q75	F35-E71 HydrophobicContact CE1-CB 4.15Å; R67-E71 WeakPolarHBondContact CD-OE1 3.21Å; R67-E71 HydrophobicContact CG-CG 4.41Å; R67-E71 WeakPolarHBondContact CG-OE1 3.21Å; R67-E71 IonicContact NE-OE1 3.51Å; R67-E71 PolarHBondContact NE-OE1 3.4Å; R67-E71 IonicContact NE-OE2 2.71Å; R67-E71 PolarHBondContact O-N 3.36Å; R67-E71 VanDerWaalsContact O-N 3.13Å; E68-E71 PolarHBondContact O-N 3.38Å; E71-Q74 PolarHBondContact O-N 3.23Å; E71-Q75 WeakPolarHBondContact O-CG 3.29Å; E71-Q75 PolarHBondContact O-N 3.39Å; E71-Q75 VanDerWaalsContact O-N 3.13Å
72	C	98.7	Very high	98	Very high	2 Å²	2	45 Å²	45	1%	0.014	22%	0.223	C	C	.	.	H	α-helix	trans	-62.3	-49.2	179.3	-179.1	0	0	0	0	112	F35 L38 E68 V70 Q74 Q75 I76	F35-C72 HydrophobicContact CE1-CB 4.13Å; F35-C72 HydrophobicContact CE2-CB 4.19Å; F35-C72 HydrophobicContact CZ-CB 3.71Å; L38-C72 HydrophobicContact CD1-CB 3.98Å; E68-C72 WeakPolarHBondContact O-CB 3.46Å; E68-C72 PolarHBondContact O-N 3.02Å; V70-C72 PolarHBondContact O-N 3Å; C72-Q74 VanDerWaalsContact C-N 3.35Å; C72-Q74 PolarHBondContact O-N 3.22Å; C72-Q75 PolarHBondContact O-N 3.15Å; C72-I76 WeakPolarHBondContact O-CG1 3.35Å; C72-I76 PolarHBondContact O-N 3.23Å
73	F	98.7	Very high	98.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-74.4	-24.5	-178	-87.8	-93.1	0	0	0	113.6	V50 M69 V70 I76 S77 V85 I87 V135 L136 C139 V143	V50-F73 HydrophobicContact CG2-CE2 4.38Å; V50-F73 HydrophobicContact CG2-CZ 4.47Å; M69-F73 HydrophobicContact CE-CD2 3.9Å; M69-F73 HydrophobicContact CE-CE2 3.6Å; M69-F73 WeakPolarHBondContact O-CB 3.36Å; M69-F73 WeakPolarHBondContact O-CD2 3.38Å; M69-F73 PolarHBondContact O-N 3.16Å; M69-F73 HydrophobicContact SD-CE2 4.43Å; V70-F73 PolarHBondContact O-N 2.84Å; F73-I76 HydrophobicContact CE1-CD1 4.49Å; F73-I76 HydrophobicContact CZ-CD1 4.44Å; F73-S77 VanDerWaalsContact O-CB 3.3Å; F73-S77 WeakPolarHBondContact O-CB 3.37Å; F73-S77 PolarHBondContact O-N 3.47Å; F73-S77 PolarHBondContact O-OG 2.97Å; F73-V85 HydrophobicContact CE1-CB 4.47Å; F73-V85 HydrophobicContact CE1-CG1 4.07Å; F73-V85 HydrophobicContact CE1-CG2 4.31Å; F73-V85 HydrophobicContact CZ-CG1 3.82Å; F73-I87 HydrophobicContact CE2-CD1 4.13Å; F73-I87 HydrophobicContact CZ-CD1 3.65Å; F73-I87 HydrophobicContact CZ-CG1 4.23Å; F73-V135 HydrophobicContact CB-CB 3.76Å; F73-V135 HydrophobicContact CB-CG2 3.65Å; F73-V135 HydrophobicContact CG-CG2 4.16Å; F73-L136 HydrophobicContact CD1-CD2 4.17Å; F73-L136 HydrophobicContact CD2-CD2 4.25Å; F73-L136 HydrophobicContact CE1-CD2 3.58Å; F73-L136 HydrophobicContact CE1-CG 4.42Å; F73-L136 HydrophobicContact CE2-CD2 3.67Å; F73-L136 HydrophobicContact CG-CD2 4.49Å; F73-L136 HydrophobicContact CZ-CD2 3.32Å; F73-L136 HydrophobicContact CZ-CG 4.42Å; F73-C139 HydrophobicContact CD1-CB 4.01Å; F73-V143 HydrophobicContact CE1-CG1 4.42Å; F73-V143 HydrophobicContact CE1-CG2 3.89Å; F73-V143 HydrophobicContact CZ-CG1 4.44Å
74	Q	97.9	Very high	98.3	Very high	101 Å²	101	41.6 Å²	41.6	47%	0.472	21%	0.205	S	C	.	.	H	α-helix	trans	-63.8	-48.3	167.4	-75.7	172.3	-8.5	0	0	110.7	V70 E71 C72 I76 S77 D78	V70-Q74 WeakPolarHBondContact O-CB 3.4Å; V70-Q74 VanDerWaalsContact O-CG 3.23Å; V70-Q74 WeakPolarHBondContact O-CG 3.37Å; V70-Q74 PolarHBondContact O-N 2.99Å; E71-Q74 PolarHBondContact O-N 3.23Å; C72-Q74 VanDerWaalsContact C-N 3.35Å; C72-Q74 PolarHBondContact O-N 3.22Å; Q74-I76 VanDerWaalsContact C-N 3.35Å; Q74-I76 PolarHBondContact O-N 2.97Å; Q74-S77 WeakPolarHBondContact O-CB 3.45Å; Q74-S77 PolarHBondContact O-N 2.82Å; Q74-S77 VanDerWaalsContact O-N 3.13Å; Q74-D78 PolarHBondContact O-N 2.9Å
75	Q	98.2	Very high	98.4	Very high	112 Å²	112	40.9 Å²	40.9	52%	0.523	20%	0.2	S	C	.	.	H	α-helix	trans	-59.9	-43.3	175.9	-68.1	171.6	20.7	0	0	112.3	E71 C72 S77 D78 D79	E71-Q75 WeakPolarHBondContact O-CG 3.29Å; E71-Q75 PolarHBondContact O-N 3.39Å; E71-Q75 VanDerWaalsContact O-N 3.13Å; C72-Q75 PolarHBondContact O-N 3.15Å; Q75-S77 VanDerWaalsContact C-N 3.31Å; Q75-S77 PolarHBondContact O-N 3.27Å; Q75-D78 PolarHBondContact O-N 3.4Å; Q75-D79 PolarHBondContact O-N 2.99Å
76	I	98.5	Very high	98.4	Very high	8 Å²	8	40.7 Å²	40.7	4%	0.041	20%	0.199	C	C	.	.	H	α-helix	trans	-64.8	-36.2	176.7	-68.9	167.9	0	0	0	111.6	T48 V50 C72 F73 Q74 D78 D79 V85 K141	T48-I76 HydrophobicContact CG2-CD1 4.07Å; T48-I76 HydrophobicContact CG2-CG1 4.26Å; V50-I76 HydrophobicContact CG2-CD1 3.64Å; C72-I76 WeakPolarHBondContact O-CG1 3.35Å; C72-I76 PolarHBondContact O-N 3.23Å; F73-I76 HydrophobicContact CE1-CD1 4.49Å; F73-I76 HydrophobicContact CZ-CD1 4.44Å; Q74-I76 VanDerWaalsContact C-N 3.35Å; Q74-I76 PolarHBondContact O-N 2.97Å; I76-D78 PolarHBondContact O-N 3.4Å; I76-D79 PolarHBondContact O-N 3.35Å; I76-V85 HydrophobicContact CD1-CG1 4.35Å; I76-V85 HydrophobicContact CG2-CG2 3.57Å; I76-K141 PolarHBondContact O-NZ 2.86Å
77	S	98.1	Very high	98.4	Very high	34 Å²	34	40.3 Å²	40.3	24%	0.238	20%	0.198	C	C	.	.	H	α-helix	trans	-64.2	-32.5	178.4	-63.4	0	0	0	0	111.9	F73 Q74 Q75 C139 K141	F73-S77 VanDerWaalsContact O-CB 3.3Å; F73-S77 WeakPolarHBondContact O-CB 3.37Å; F73-S77 PolarHBondContact O-N 3.47Å; F73-S77 PolarHBondContact O-OG 2.97Å; Q74-S77 WeakPolarHBondContact O-CB 3.45Å; Q74-S77 PolarHBondContact O-N 2.82Å; Q74-S77 VanDerWaalsContact O-N 3.13Å; Q75-S77 VanDerWaalsContact C-N 3.31Å; Q75-S77 PolarHBondContact O-N 3.27Å; S77-C139 WeakPolarHBondContact OG-CA 3.45Å; S77-K141 VanDerWaalsContact C-NZ 3.28Å; S77-K141 PolarHBondContact O-NZ 3.19Å
78	D	97.7	Very high	98.5	Very high	135 Å²	135	34.3 Å²	34.3	72%	0.722	18%	0.175	S	C	*	.	H	α-helix	trans	-89.6	-16.4	177.9	-64.5	-24.2	0	0	0	113.7	Q74 Q75 I76 Q80	Q74-D78 PolarHBondContact O-N 2.9Å; Q75-D78 PolarHBondContact O-N 3.4Å; I76-D78 PolarHBondContact O-N 3.4Å; D78-Q80 PolarHBondContact O-N 3.31Å
79	D	98.2	Very high	98.5	Very high	51 Å²	51	34.2 Å²	34.2	27%	0.273	18%	0.175	S	C	.	.			trans	-70.7	110.5	176.9	-180	4.7	0	0	0	111.4	Q75 I76 T81 C82 K141	Q75-D79 PolarHBondContact O-N 2.99Å; I76-D79 PolarHBondContact O-N 3.35Å; D79-T81 PolarHBondContact O-N 2.96Å; D79-T81 WeakPolarHBondContact OD1-CA 3.22Å; D79-T81 WeakPolarHBondContact OD1-CB 3.47Å; D79-T81 PolarHBondContact OD1-N 2.81Å; D79-T81 PolarHBondContact OD1-OG1 2.96Å; D79-T81 PolarHBondContact OD2-OG1 2.89Å; D79-C82 HydrophobicContact CB-CB 4.14Å; D79-C82 PolarHBondContact OD1-N 3.31Å; D79-C82 WeakPolarHBondContact OD2-CB 3.5Å; D79-K141 WeakPolarHBondContact O-CE 3.41Å; D79-K141 PolarHBondContact O-NZ 3.39Å
80	Q	97.9	Very high	98.4	Very high	81 Å²	81	34.6 Å²	34.6	38%	0.379	18%	0.178	S	C	.	.	S	Bend	trans	-73.8	-15.9	-179.5	-50.7	-166.4	-66	0	0	113.8	D78 K307 L308	D78-Q80 PolarHBondContact O-N 3.31Å; Q80-K307 HydrophobicContact CB-CB 4.02Å; Q80-K307 HydrophobicContact CB-CD 4Å; Q80-K307 HydrophobicContact CB-CG 4.24Å; Q80-K307 VanDerWaalsContact O-CB 3.32Å; Q80-K307 WeakPolarHBondContact O-CB 3.45Å; Q80-K307 VanDerWaalsContact OE1-CE 3.32Å; Q80-L308 VanDerWaalsContact CA-OXT 3.3Å; Q80-L308 WeakPolarHBondContact CA-OXT 3.4Å; Q80-L308 VanDerWaalsContact CG-O 3.28Å; Q80-L308 WeakPolarHBondContact CG-O 3.28Å; Q80-L308 PolarHBondContact NE2-O 3.48Å; Q80-L308 PolarHBondContact O-N 3.11Å
81	T	97.6	Very high	98.4	Very high	68 Å²	68	35.7 Å²	35.7	42%	0.417	19%	0.193	S	C	.	.	S	Bend	trans	-88.9	-27.2	-178.4	73.3	0	0	0	0	111.8	S46 D79	S46-T81 VanDerWaalsContact CA-O 3.27Å; S46-T81 WeakPolarHBondContact CA-O 3.23Å; S46-T81 VanDerWaalsContact CB-O 3.25Å; S46-T81 WeakPolarHBondContact CB-O 3.44Å; S46-T81 PolarHBondContact OG-O 3.41Å; D79-T81 PolarHBondContact O-N 2.96Å; D79-T81 WeakPolarHBondContact OD1-CA 3.22Å; D79-T81 WeakPolarHBondContact OD1-CB 3.47Å; D79-T81 PolarHBondContact OD1-N 2.81Å; D79-T81 PolarHBondContact OD1-OG1 2.96Å; D79-T81 PolarHBondContact OD2-OG1 2.89Å
82	C	98.5	Very high	98.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.208	C	C	.	.			trans	-71.4	129.2	172.6	-173.8	0	0	0	0	111.1	T48 D79 K141	T48-C82 PolarHBondContact OG1-SG 2.71Å; D79-C82 HydrophobicContact CB-CB 4.14Å; D79-C82 PolarHBondContact OD1-N 3.31Å; D79-C82 WeakPolarHBondContact OD2-CB 3.5Å; C82-K141 WeakPolarHBondContact O-CE 3.28Å
83	R	98.6	Very high	98.3	Very high	37 Å²	37	37.1 Å²	37.1	14%	0.14	21%	0.211	C	C	.	.			trans	-116	-26.3	173.3	-64.4	-177.6	179.3	-179.4	2.2	112.9	S46 P142 A245 P249 F305 S306	S46-R83 PolarHBondContact O-N 2.66Å; R83-P142 WeakPolarHBondContact O-CD 3.25Å; R83-A245 HydrophobicContact CB-CB 4.14Å; R83-A245 VanDerWaalsContact CD-O 3.23Å; R83-A245 WeakPolarHBondContact CD-O 3.42Å; R83-A245 PolarHBondContact NH1-O 3.32Å; R83-P249 HydrophobicContact CG-CB 4.42Å; R83-F305 PolarHBondContact NH2-O 2.71Å; R83-S306 PolarHBondContact NH2-O 3.29Å
84	V	98.8	Very high	98.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	141.9	-178.3	-170.4	0	0	0	0	109.7	S46 V47 T48 V144 A241 I244 A245	S46-V84 PolarHBondContact O-N 3.11Å; V47-V84 WeakPolarHBondContact CA-O 3.4Å; T48-V84 PolarHBondContact N-O 2.97Å; V84-V144 HydrophobicContact CG1-CG2 4.23Å; V84-A241 HydrophobicContact CB-CB 4.16Å; V84-A241 HydrophobicContact CG1-CB 3.81Å; V84-I244 HydrophobicContact CG2-CB 3.69Å; V84-I244 HydrophobicContact CG2-CG2 3.45Å; V84-I244 VanDerWaalsContact CG2-CG2 3.45Å; V84-A245 HydrophobicContact CG2-CB 4.13Å
85	V	98.9	Very high	98.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.6	174.8	-168.9	0	0	0	0	109.9	T48 V50 F73 I76 I87 K141 P142 V143 V144	T48-V85 CarbonylContact O-C 2.98Å; T48-V85 VanDerWaalsContact O-CA 3.26Å; T48-V85 WeakPolarHBondContact O-CA 3.45Å; V50-V85 HydrophobicContact CG2-CG1 3.95Å; F73-V85 HydrophobicContact CE1-CB 4.47Å; F73-V85 HydrophobicContact CE1-CG1 4.07Å; F73-V85 HydrophobicContact CE1-CG2 4.31Å; F73-V85 HydrophobicContact CZ-CG1 3.82Å; I76-V85 HydrophobicContact CD1-CG1 4.35Å; I76-V85 HydrophobicContact CG2-CG2 3.57Å; V85-I87 HydrophobicContact CG1-CG1 4.34Å; V85-K141 HydrophobicContact CG2-CB 4.47Å; V85-P142 PolarHBondContact N-O 3.39Å; V85-V143 HydrophobicContact CB-CG1 4.33Å; V85-V143 HydrophobicContact CB-CG2 4.18Å; V85-V143 HydrophobicContact CG2-CG2 4.4Å; V85-V143 CarbonylContact O-C 3.51Å; V85-V143 WeakPolarHBondContact O-CA 3.47Å; V85-V144 PolarHBondContact O-N 2.81Å
86	L	98.9	Very high	98.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	138.4	165.2	-62.4	-173.8	0	0	0	109.3	V47 T48 H49 V50 V144 A237 L238 A241	V47-L86 HydrophobicContact CG1-CD1 4.02Å; V47-L86 HydrophobicContact CG1-CG 3.88Å; T48-L86 PolarHBondContact O-N 2.87Å; H49-L86 WeakPolarHBondContact CA-O 3.39Å; H49-L86 HydrophobicContact CB-CB 4.4Å; V50-L86 PolarHBondContact N-O 3.47Å; L86-V144 CarbonylContact C-O 3.58Å; L86-V144 WeakPolarHBondContact CA-O 3.26Å; L86-V144 HydrophobicContact CD2-CB 3.68Å; L86-V144 HydrophobicContact CD2-CG1 4.24Å; L86-V144 HydrophobicContact CD2-CG2 4.16Å; L86-A237 HydrophobicContact CD1-CB 4.24Å; L86-A237 HydrophobicContact CD2-CB 4.12Å; L86-L238 HydrophobicContact CD1-CD2 3.78Å; L86-L238 HydrophobicContact CD1-CG 4.25Å; L86-A241 HydrophobicContact CD2-CB 3.97Å; L86-A241 HydrophobicContact CG-CB 4.35Å
87	I	98.9	Very high	98.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	128.7	170	-54.9	-178.6	0	0	0	110.2	V50 L52 F73 V85 F94 L136 V143 V144 A146 L158	V50-I87 HydrophobicContact CB-CG1 4.44Å; V50-I87 VanDerWaalsContact O-CA 3.25Å; V50-I87 WeakPolarHBondContact O-CA 3.38Å; L52-I87 HydrophobicContact CD2-CG2 4.35Å; F73-I87 HydrophobicContact CE2-CD1 4.13Å; F73-I87 HydrophobicContact CZ-CD1 3.65Å; F73-I87 HydrophobicContact CZ-CG1 4.23Å; V85-I87 HydrophobicContact CG1-CG1 4.34Å; I87-F94 HydrophobicContact CG2-CE2 4.22Å; I87-F94 HydrophobicContact CG2-CZ 4.18Å; I87-L136 HydrophobicContact CD1-CD2 3.23Å; I87-V143 HydrophobicContact CD1-CG1 3.51Å; I87-V143 HydrophobicContact CG1-CG1 3.83Å; I87-V144 PolarHBondContact N-O 3.34Å; I87-A146 PolarHBondContact O-N 3.46Å; I87-L158 HydrophobicContact CD1-CD2 4.29Å; I87-L158 HydrophobicContact CG2-CD2 4.31Å
88	S	98.9	Very high	98.2	Very high	1 Å²	1	29 Å²	29	1%	0.007	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	175.1	172.6	73.7	0	0	0	0	111.6	H49 V50 Q51 L52	H49-S88 PolarHBondContact CE1-OG 2.76Å; H49-S88 PolarHBondContact NE2-OG 3.18Å; V50-S88 PolarHBondContact O-N 3.29Å; Q51-S88 CarbonylContact C-O 3.55Å; Q51-S88 VanDerWaalsContact CA-O 3.28Å; Q51-S88 WeakPolarHBondContact CA-O 3.3Å; L52-S88 PolarHBondContact N-O 3.42Å
89	G	98.6	Very high	98.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	150	172.8	0	0	0	0	0	112.3	Q51 H148 Q230	Q51-G89 PolarHBondContact NE2-O 2.88Å; G89-H148 PolarHBondContact O-CE1 2.81Å; G89-Q230 PolarHBondContact O-NE2 3.21Å
90	A	98.3	Very high	97.7	Very high	7 Å²	7	25.5 Å²	25.5	6%	0.058	16%	0.157	C	C	.	.	S	Bend	trans	-83.1	153.7	167.8	0	0	0	0	0	111.1	Q51 L52 P55 N59	Q51-A90 HydrophobicContact CG-CB 4.12Å; L52-A90 VanDerWaalsContact O-CB 3.28Å; L52-A90 WeakPolarHBondContact O-CB 3.44Å; L52-A90 PolarHBondContact O-N 3.19Å; P55-A90 HydrophobicContact CB-CB 4.1Å; P55-A90 HydrophobicContact CG-CB 4.19Å; N59-A90 PolarHBondContact ND2-N 3.04Å; N59-A90 PolarHBondContact ND2-O 2.94Å
91	G	97.1	Very high	97.2	Very high	45 Å²	45	29.8 Å²	29.8	46%	0.464	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	76	-152	176.2	0	0	0	0	0	113.5	T93 H148	G91-T93 VanDerWaalsContact C-N 3.34Å; G91-T93 PolarHBondContact O-N 2.93Å; G91-H148 PolarHBondContact O-NE2 2.81Å
92	S	96.7	Very high	96.7	Very high	89 Å²	89	29.6 Å²	29.6	62%	0.622	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80	-8.6	-167.3	55.5	0	0	0	0	115.5
93	T	98.4	Very high	96.2	Very high	11 Å²	11	29.6 Å²	29.6	7%	0.067	18%	0.176	C	C	.	.			trans	-151	157.3	-174	-161.4	0	0	0	0	111.1	L58 N59 G91 H148 A150	L58-T93 HydrophobicContact CB-CG2 3.82Å; L58-T93 HydrophobicContact CD2-CG2 4.13Å; L58-T93 HydrophobicContact CG-CG2 4.5Å; N59-T93 PolarHBondContact ND2-O 3.47Å; N59-T93 VanDerWaalsContact ND2-O 3.08Å; G91-T93 VanDerWaalsContact C-N 3.34Å; G91-T93 PolarHBondContact O-N 2.93Å; T93-H148 CarbonylContact C-O 3.57Å; T93-H148 PolarHBondContact N-NE2 3.33Å; T93-A150 WeakPolarHBondContact OG1-CA 3.43Å; T93-A150 WeakPolarHBondContact OG1-CB 3.27Å; T93-A150 PolarHBondContact OG1-N 3.25Å; T93-A150 PolarHBondContact OG1-O 2.82Å
94	F	98.9	Very high	95.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	-63.3	-61.5	173.2	-175.2	-106.2	0	0	0	111	L52 N59 I87 V147 H148 A150 C151 L158 I159	L52-F94 HydrophobicContact CD1-CE1 4.16Å; L52-F94 HydrophobicContact CD1-CE2 4.38Å; L52-F94 HydrophobicContact CD1-CZ 4.08Å; N59-F94 VanDerWaalsContact CB-O 3.31Å; N59-F94 WeakPolarHBondContact CB-O 3.26Å; N59-F94 PolarHBondContact ND2-O 2.75Å; I87-F94 HydrophobicContact CG2-CE2 4.22Å; I87-F94 HydrophobicContact CG2-CZ 4.18Å; F94-V147 HydrophobicContact CB-CG1 3.78Å; F94-V147 HydrophobicContact CD1-CG1 4.3Å; F94-V147 HydrophobicContact CD1-CG2 4.38Å; F94-V147 HydrophobicContact CD2-CB 4.48Å; F94-V147 HydrophobicContact CD2-CG2 4.22Å; F94-V147 HydrophobicContact CE2-CG2 4.33Å; F94-V147 HydrophobicContact CG-CB 4.41Å; F94-V147 HydrophobicContact CG-CG1 3.96Å; F94-V147 HydrophobicContact CG-CG2 4.26Å; F94-V147 HydrophobicContact CZ-CG2 4.49Å; F94-H148 WeakPolarHBondContact CB-O 3.19Å; F94-H148 PolarHBondContact N-O 3.25Å; F94-A150 WeakPolarHBondContact CB-O 3.46Å; F94-A150 PolarHBondContact N-O 2.83Å; F94-C151 HydrophobicContact CD1-CB 4.14Å; F94-L158 HydrophobicContact CE1-CD1 4.31Å; F94-L158 HydrophobicContact CE1-CD2 4.41Å; F94-L158 HydrophobicContact CZ-CD1 4.22Å; F94-L158 HydrophobicContact CZ-CD2 4.01Å; F94-I159 HydrophobicContact CE1-CG2 3.68Å; F94-I159 HydrophobicContact CZ-CG2 3.89Å
95	T	98.9	Very high	94.8	Very high	0 Å²	0	31 Å²	31	0%	0	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-162.7	144.1	173.6	-177.2	0	0	0	0	113.1	L58 N59 M61 G97 A150 I152 G155	L58-T95 CarbonylContact O-C 3.33Å; L58-T95 WeakPolarHBondContact O-CA 3.41Å; N59-T95 PolarHBondContact O-OG1 2.68Å; M61-T95 HydrophobicContact CE-CG2 3.86Å; T95-G97 VanDerWaalsContact C-N 3.26Å; T95-G97 PolarHBondContact OG1-N 2.84Å; T95-A150 PolarHBondContact N-O 2.98Å; T95-A150 VanDerWaalsContact O-O 3.14Å; T95-I152 PolarHBondContact O-N 3.22Å; T95-G155 VanDerWaalsContact CG2-CA 3.41Å
96	A	98.4	Very high	94	Very high	37 Å²	37	32.9 Å²	32.9	31%	0.306	21%	0.208	S	C	.	.			trans	-80	-0.6	168	0	0	0	0	0	114.1	L58	L58-A96 HydrophobicContact CB-CB 3.81Å; L58-A96 HydrophobicContact CD1-CB 4.5Å; L58-A96 PolarHBondContact O-N 3.03Å
97	G	97.9	Very high	93.1	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.01	23%	0.227	C	C	.	.			trans	86.7	-147.3	179.6	0	0	0	0	0	112.9	A60 M61 T95 I152	A60-G97 CarbonylContact C-O 3.58Å; A60-G97 VanDerWaalsContact CA-O 3.23Å; A60-G97 WeakPolarHBondContact CA-O 3.29Å; M61-G97 PolarHBondContact N-O 2.77Å; T95-G97 VanDerWaalsContact C-N 3.26Å; T95-G97 PolarHBondContact OG1-N 2.84Å; G97-I152 WeakPolarHBondContact CA-O 3.32Å
98	L	96.7	Very high	92.4	Very high	47 Å²	47	42.9 Å²	42.9	25%	0.246	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-60.3	132.8	-176.9	-174.3	71.1	0	0	0	112.4	W66 L100 M103 I107	W66-L98 HydrophobicContact CZ2-CD1 3.57Å; L98-L100 HydrophobicContact CD2-CD2 3.81Å; L98-L100 HydrophobicContact CG-CD2 4.49Å; L98-L100 PolarHBondContact O-N 2.79Å; L98-M103 HydrophobicContact CD1-CB 4.23Å; L98-M103 HydrophobicContact CD1-CG 3.51Å; L98-M103 HydrophobicContact CD1-SD 3.66Å; L98-M103 HydrophobicContact CG-CB 4.37Å; L98-M103 HydrophobicContact CG-CG 3.98Å; L98-I107 HydrophobicContact CD2-CD1 3.82Å
99	D	95.9	Very high	91.9	Very high	27 Å²	27	50.3 Å²	50.3	14%	0.144	30%	0.295	C	S	.	.			trans	-78.1	85	170.1	-164.1	-31.5	0	0	0	109.5	R54 A60 M61 N62 M101 D102 M103	R54-D99 IonicContact CZ-OD2 3.37Å; R54-D99 IonicContact NH1-OD2 2.7Å; R54-D99 PolarHBondContact NH1-OD2 2.96Å; R54-D99 IonicContact NH2-OD2 3.12Å; R54-D99 PolarHBondContact NH2-OD2 3.29Å; A60-D99 HydrophobicContact CB-CB 3.9Å; M61-D99 WeakPolarHBondContact O-CB 3.07Å; M61-D99 PolarHBondContact O-N 3.22Å; N62-D99 HydrophobicContact CB-CB 4.01Å; D99-M101 PolarHBondContact O-N 3.36Å; D99-M101 VanDerWaalsContact O-N 3.13Å; D99-D102 HydrophobicContact CB-CB 4.11Å; D99-D102 PolarHBondContact O-N 2.56Å; D99-D102 VanDerWaalsContact O-N 3.17Å; D99-D102 PolarHBondContact OD1-N 3.39Å; D99-M103 WeakPolarHBondContact O-CB 3.38Å; D99-M103 WeakPolarHBondContact O-CG 3.41Å; D99-M103 PolarHBondContact O-N 3.19Å
100	L	88.5	Confident	91.4	Very high	85 Å²	85	52.3 Å²	52.3	45%	0.445	31%	0.308	S	S	.	.	H	α-helix	trans	-55	-32.9	-174.6	-74.4	171.8	0	0	0	113.5	L98 A104 I180	L98-L100 HydrophobicContact CD2-CD2 3.81Å; L98-L100 HydrophobicContact CG-CD2 4.49Å; L98-L100 PolarHBondContact O-N 2.79Å; L100-A104 WeakPolarHBondContact O-CA 3.33Å; L100-A104 WeakPolarHBondContact O-CB 3.29Å; L100-A104 PolarHBondContact O-N 3.36Å; L100-I180 HydrophobicContact CD2-CG2 4.04Å
101	M	87.9	Confident	91.1	Very high	170 Å²	170	59.6 Å²	59.6	84%	0.837	34%	0.341	S	S	*	.	H	α-helix	trans	-72.4	-44.5	-179.6	-67.3	-63.7	179.7	0	0	111.4	D99 M103	D99-M101 PolarHBondContact O-N 3.36Å; D99-M101 VanDerWaalsContact O-N 3.13Å; M101-M103 PolarHBondContact O-N 3.33Å
102	D	87.9	Confident	90.9	Very high	65 Å²	65	59 Å²	59	35%	0.348	34%	0.335	S	S	.	.	H	α-helix	trans	-69.3	-26	176.7	-162.9	68.5	0	0	0	112.1	N62 K63 D99	N62-D102 HydrophobicContact CB-CB 4Å; N62-D102 VanDerWaalsContact CB-OD2 3.29Å; N62-D102 WeakPolarHBondContact CB-OD2 3.35Å; K63-D102 WeakPolarHBondContact CE-O 3.22Å; K63-D102 WeakPolarHBondContact CG-OD2 3.23Å; K63-D102 PolarHBondContact N-OD2 3.16Å; D99-D102 HydrophobicContact CB-CB 4.11Å; D99-D102 PolarHBondContact O-N 2.56Å; D99-D102 VanDerWaalsContact O-N 3.17Å; D99-D102 PolarHBondContact OD1-N 3.39Å
103	M	86.4	Confident	90.9	Very high	0 Å²	0	62 Å²	62	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-95.5	-10.1	-177.7	-57.6	-93.8	63.8	0	0	114	K63 W66 L98 D99 M101 G105 D106 I107 Y129	K63-M103 HydrophobicContact CB-CE 4.4Å; K63-M103 HydrophobicContact CD-CE 4.23Å; K63-M103 HydrophobicContact CG-CE 3.3Å; W66-M103 PolarHBondContact NE1-SD 3.24Å; W66-M103 VanDerWaalsContact NE1-SD 3.4Å; L98-M103 HydrophobicContact CD1-CB 4.23Å; L98-M103 HydrophobicContact CD1-CG 3.51Å; L98-M103 HydrophobicContact CD1-SD 3.66Å; L98-M103 HydrophobicContact CG-CB 4.37Å; L98-M103 HydrophobicContact CG-CG 3.98Å; D99-M103 WeakPolarHBondContact O-CB 3.38Å; D99-M103 WeakPolarHBondContact O-CG 3.41Å; D99-M103 PolarHBondContact O-N 3.19Å; M101-M103 PolarHBondContact O-N 3.33Å; M103-G105 VanDerWaalsContact C-N 3.28Å; M103-G105 PolarHBondContact O-N 2.98Å; M103-D106 HydrophobicContact CE-CB 4.36Å; M103-D106 VanDerWaalsContact CE-OD2 3.23Å; M103-D106 WeakPolarHBondContact CE-OD2 3.25Å; M103-D106 PolarHBondContact O-N 2.48Å; M103-I107 HydrophobicContact CB-CD1 3.78Å; M103-I107 HydrophobicContact CB-CG1 4.44Å; M103-I107 WeakPolarHBondContact O-CG1 3.27Å; M103-I107 PolarHBondContact O-N 3.02Å; M103-Y129 HydrophobicContact CE-CE2 4.41Å; M103-Y129 WeakPolarHBondContact CE-OH 3.37Å; M103-Y129 HydrophobicContact SD-CE2 3.99Å
104	A	85.9	Confident	90.8	Very high	31 Å²	31	64.5 Å²	64.5	26%	0.256	36%	0.357	S	S	.	.	H	α-helix	trans	-55.3	-41.5	-175.2	0	0	0	0	0	112.6	L100 I107 L108	L100-A104 WeakPolarHBondContact O-CA 3.33Å; L100-A104 WeakPolarHBondContact O-CB 3.29Å; L100-A104 PolarHBondContact O-N 3.36Å; A104-I107 PolarHBondContact O-N 2.97Å; A104-L108 HydrophobicContact CB-CD1 4.2Å; A104-L108 WeakPolarHBondContact O-CA 3.3Å; A104-L108 WeakPolarHBondContact O-CB 3.48Å; A104-L108 WeakPolarHBondContact O-CG 3.3Å; A104-L108 PolarHBondContact O-N 3.03Å
105	G	82.8	Confident	90.7	Very high	34 Å²	34	69.3 Å²	69.3	35%	0.351	39%	0.391	S	S	.	.	H	α-helix	trans	-63.1	-43.1	177.4	0	0	0	0	0	112.8	M103 I107 Q109	M103-G105 VanDerWaalsContact C-N 3.28Å; M103-G105 PolarHBondContact O-N 2.98Å; G105-I107 VanDerWaalsContact C-N 3.3Å; G105-I107 PolarHBondContact O-N 3.28Å; G105-Q109 CarbonylContact O-C 3.5Å; G105-Q109 WeakPolarHBondContact O-CA 3.48Å; G105-Q109 PolarHBondContact O-N 2.92Å; G105-Q109 VanDerWaalsContact O-N 3.17Å
106	D	82.4	Confident	90.7	Very high	40 Å²	40	71.9 Å²	71.9	21%	0.214	41%	0.412	C	S	.	.	H	α-helix	trans	-71.1	-28.3	-178.3	-64.4	-10.5	0	0	0	111.9	K63 M103 L125 Y129	K63-D106 WeakPolarHBondContact CE-OD2 3.42Å; K63-D106 IonicContact NZ-OD1 3.81Å; K63-D106 PolarHBondContact NZ-OD1 2.81Å; K63-D106 IonicContact NZ-OD2 3.11Å; K63-D106 PolarHBondContact NZ-OD2 2.83Å; K63-D106 VanDerWaalsContact NZ-OD2 3.12Å; M103-D106 HydrophobicContact CE-CB 4.36Å; M103-D106 VanDerWaalsContact CE-OD2 3.23Å; M103-D106 WeakPolarHBondContact CE-OD2 3.25Å; M103-D106 PolarHBondContact O-N 2.48Å; D106-L125 HydrophobicContact CB-CD2 3.91Å; D106-Y129 PolarHBondContact OD2-OH 3.24Å
107	I	79.4	Confident	90.6	Very high	76 Å²	76	76.1 Å²	76.1	39%	0.39	42%	0.42	S	S	.	.	H	α-helix	trans	-94.1	-47.3	-175.6	-63.9	171.5	0	0	0	112.3	L98 M103 A104 G105	L98-I107 HydrophobicContact CD2-CD1 3.82Å; M103-I107 HydrophobicContact CB-CD1 3.78Å; M103-I107 HydrophobicContact CB-CG1 4.44Å; M103-I107 WeakPolarHBondContact O-CG1 3.27Å; M103-I107 PolarHBondContact O-N 3.02Å; A104-I107 PolarHBondContact O-N 2.97Å; G105-I107 VanDerWaalsContact C-N 3.3Å; G105-I107 PolarHBondContact O-N 3.28Å
108	L	84.4	Confident	90.6	Very high	134 Å²	134	78.6 Å²	78.6	70%	0.702	43%	0.432	S	S	*	.	H	α-helix	trans	-91.4	-19.9	-172.1	-57.4	176.8	0	0	0	112.9	A104	A104-L108 HydrophobicContact CB-CD1 4.2Å; A104-L108 WeakPolarHBondContact O-CA 3.3Å; A104-L108 WeakPolarHBondContact O-CB 3.48Å; A104-L108 WeakPolarHBondContact O-CG 3.3Å; A104-L108 PolarHBondContact O-N 3.03Å
109	Q	88.4	Confident	90.5	Very high	158 Å²	158	79.1 Å²	79.1	74%	0.738	44%	0.444	S	S	*	.	S	Bend	trans	-131.4	55.8	-178.4	-60.9	-179.1	-2.2	0	0	111.4	G105	G105-Q109 CarbonylContact O-C 3.5Å; G105-Q109 WeakPolarHBondContact O-CA 3.48Å; G105-Q109 PolarHBondContact O-N 2.92Å; G105-Q109 VanDerWaalsContact O-N 3.17Å
110	P	88.1	Confident	90.6	Very high	41 Å²	41	85.3 Å²	85.3	27%	0.266	47%	0.465	S	S	.	.			trans	-65.7	137.4	180	30	-36.1	0	0	0	111.2	I118 V122	P110-I118 HydrophobicContact CB-CG2 3.95Å; P110-I118 HydrophobicContact CG-CG2 3.54Å; P110-V122 HydrophobicContact CB-CG2 3.72Å; P110-V122 HydrophobicContact CG-CG2 4.22Å
111	E	90.9	Very high	90.9	Very high	160 Å²	160	84 Å²	84	75%	0.748	46%	0.458	S	S	*	.			trans	-67.9	138.7	179.3	-62.9	-179.3	168.5	0	0	112.2	N121	E111-N121 PolarHBondContact O-ND2 3.1Å
112	G	93.7	Very high	91.3	Very high	34 Å²	34	78.2 Å²	78.2	35%	0.351	43%	0.432	S	S	.	.			trans	153.9	147.5	168.9	0	0	0	0	0	113.5	D114	G112-D114 VanDerWaalsContact C-N 3.34Å; G112-D114 PolarHBondContact O-N 2.79Å
113	D	95.9	Very high	91.7	Very high	151 Å²	151	81.5 Å²	81.5	81%	0.807	44%	0.44	S	S	*	.	S	Bend	trans	-74.4	-23.6	-175.4	-50.8	-39.2	0	0	0	113.8	R117	D113-R117 IonicContact OD2-NE 2.82Å
114	D	97.3	Very high	92.2	Very high	64 Å²	64	87.4 Å²	87.4	34%	0.342	47%	0.466	S	S	.	.	S	Bend	trans	-148.1	172.2	179.7	67.8	8.9	0	0	0	111.7	G112 A116 R117 I118	G112-D114 VanDerWaalsContact C-N 3.34Å; G112-D114 PolarHBondContact O-N 2.79Å; D114-A116 PolarHBondContact O-N 2.86Å; D114-A116 PolarHBondContact OD1-N 3.47Å; D114-R117 PolarHBondContact O-N 3.5Å; D114-R117 WeakPolarHBondContact OD1-CB 3.36Å; D114-R117 WeakPolarHBondContact OD1-CD 3.26Å; D114-R117 VanDerWaalsContact OD1-CG 3.28Å; D114-R117 WeakPolarHBondContact OD1-CG 3.14Å; D114-R117 PolarHBondContact OD1-N 3.34Å; D114-R117 IonicContact OD1-NH1 3.56Å; D114-R117 PolarHBondContact OD1-NH1 3.36Å; D114-R117 VanDerWaalsContact OD1-NH1 3.11Å; D114-R117 IonicContact OD2-CZ 3.8Å; D114-R117 IonicContact OD2-NH1 3.62Å; D114-R117 PolarHBondContact OD2-NH1 2.87Å; D114-I118 WeakPolarHBondContact O-CB 3.42Å; D114-I118 VanDerWaalsContact O-CG1 3.28Å; D114-I118 WeakPolarHBondContact O-CG1 3.46Å; D114-I118 PolarHBondContact O-N 3.3Å
115	S	97.1	Very high	92.6	Very high	101 Å²	101	87.2 Å²	87.2	71%	0.706	46%	0.46	S	S	*	.	H	α-helix	trans	-58.2	-33.1	-177.5	58.7	0	0	0	0	113.3	A119	S115-A119 VanDerWaalsContact O-CB 3.23Å; S115-A119 WeakPolarHBondContact O-CB 3.31Å; S115-A119 PolarHBondContact O-N 3.32Å
116	A	97.9	Very high	93.2	Very high	53 Å²	53	87.7 Å²	87.7	44%	0.438	45%	0.454	S	S	.	.	H	α-helix	trans	-70.8	-44.7	178.8	0	0	0	0	0	111.9	D114 A119 W120	D114-A116 PolarHBondContact O-N 2.86Å; D114-A116 PolarHBondContact OD1-N 3.47Å; A116-A119 PolarHBondContact O-N 3.4Å; A116-W120 PolarHBondContact O-N 3.12Å
117	R	97.6	Very high	94	Very high	126 Å²	126	90.8 Å²	90.8	48%	0.475	47%	0.466	S	S	.	.	H	α-helix	trans	-66.1	-43.1	176.5	-72.5	160.5	178.5	71.7	-3.5	111.5	D113 D114 A119 W120 N121	D113-R117 IonicContact OD2-NE 2.82Å; D114-R117 PolarHBondContact O-N 3.5Å; D114-R117 WeakPolarHBondContact OD1-CB 3.36Å; D114-R117 WeakPolarHBondContact OD1-CD 3.26Å; D114-R117 VanDerWaalsContact OD1-CG 3.28Å; D114-R117 WeakPolarHBondContact OD1-CG 3.14Å; D114-R117 PolarHBondContact OD1-N 3.34Å; D114-R117 IonicContact OD1-NH1 3.56Å; D114-R117 PolarHBondContact OD1-NH1 3.36Å; D114-R117 VanDerWaalsContact OD1-NH1 3.11Å; D114-R117 IonicContact OD2-CZ 3.8Å; D114-R117 IonicContact OD2-NH1 3.62Å; D114-R117 PolarHBondContact OD2-NH1 2.87Å; R117-A119 PolarHBondContact O-N 3.22Å; R117-W120 PolarHBondContact O-N 2.67Å; R117-N121 PolarHBondContact O-N 3.38Å
118	I	96.4	Very high	94.9	Very high	54 Å²	54	94.2 Å²	94.2	28%	0.277	47%	0.474	S	S	.	.	H	α-helix	trans	-55.9	-51.3	172.7	-70.6	168.6	0	0	0	109.9	P110 D114 W120 N121 V122	P110-I118 HydrophobicContact CB-CG2 3.95Å; P110-I118 HydrophobicContact CG-CG2 3.54Å; D114-I118 WeakPolarHBondContact O-CB 3.42Å; D114-I118 VanDerWaalsContact O-CG1 3.28Å; D114-I118 WeakPolarHBondContact O-CG1 3.46Å; D114-I118 PolarHBondContact O-N 3.3Å; I118-W120 VanDerWaalsContact C-N 3.3Å; I118-W120 PolarHBondContact O-N 2.82Å; I118-N121 PolarHBondContact O-N 3Å; I118-N121 VanDerWaalsContact O-N 3.09Å; I118-V122 HydrophobicContact CG2-CG2 4.22Å; I118-V122 WeakPolarHBondContact O-CG2 3.41Å; I118-V122 PolarHBondContact O-N 3.22Å
119	A	96.4	Very high	95.5	Very high	58 Å²	58	88.8 Å²	88.8	48%	0.479	44%	0.444	S	S	.	.	H	α-helix	trans	-59.2	-39.5	-179.9	0	0	0	0	0	112.7	S115 A116 R117 R123	S115-A119 VanDerWaalsContact O-CB 3.23Å; S115-A119 WeakPolarHBondContact O-CB 3.31Å; S115-A119 PolarHBondContact O-N 3.32Å; A116-A119 PolarHBondContact O-N 3.4Å; R117-A119 PolarHBondContact O-N 3.22Å; A119-R123 WeakPolarHBondContact O-CB 3.17Å; A119-R123 PolarHBondContact O-N 3.19Å
120	W	96.8	Very high	96	Very high	157 Å²	157	83.5 Å²	83.5	60%	0.595	42%	0.419	S	S	*	.	H	α-helix	trans	-64.6	-39	175.1	-93.5	101.3	0	0	0	113.1	A116 R117 I118 K124	A116-W120 PolarHBondContact O-N 3.12Å; R117-W120 PolarHBondContact O-N 2.67Å; I118-W120 VanDerWaalsContact C-N 3.3Å; I118-W120 PolarHBondContact O-N 2.82Å; W120-K124 WeakPolarHBondContact O-CG 3.43Å; W120-K124 PolarHBondContact O-N 2.89Å; W120-K124 VanDerWaalsContact O-N 3.13Å
121	N	95.5	Very high	96.5	Very high	57 Å²	57	84.2 Å²	84.2	31%	0.305	42%	0.419	S	S	.	.	H	α-helix	trans	-71.2	-42.8	177.4	-72.1	-21.7	0	0	0	111.8	E111 R117 I118 R123 K124 L125	E111-N121 PolarHBondContact O-ND2 3.1Å; R117-N121 PolarHBondContact O-N 3.38Å; I118-N121 PolarHBondContact O-N 3Å; I118-N121 VanDerWaalsContact O-N 3.09Å; N121-R123 VanDerWaalsContact C-N 3.32Å; N121-R123 PolarHBondContact O-N 3.27Å; N121-K124 WeakPolarHBondContact O-CB 3.3Å; N121-K124 PolarHBondContact O-N 3.3Å; N121-K124 VanDerWaalsContact O-N 3.15Å; N121-L125 PolarHBondContact O-N 3.13Å
122	V	95.3	Very high	96.9	Very high	48 Å²	48	76.6 Å²	76.6	29%	0.291	38%	0.384	S	S	.	.	H	α-helix	trans	-59.8	-42.6	172.5	172.7	0	0	0	0	110.9	P110 I118 K124 L125 I126	P110-V122 HydrophobicContact CB-CG2 3.72Å; P110-V122 HydrophobicContact CG-CG2 4.22Å; I118-V122 HydrophobicContact CG2-CG2 4.22Å; I118-V122 WeakPolarHBondContact O-CG2 3.41Å; I118-V122 PolarHBondContact O-N 3.22Å; V122-K124 VanDerWaalsContact C-N 3.33Å; V122-K124 PolarHBondContact O-N 3.27Å; V122-L125 WeakPolarHBondContact O-CB 3.37Å; V122-L125 PolarHBondContact O-N 2.98Å; V122-L125 VanDerWaalsContact O-N 3.16Å; V122-I126 HydrophobicContact CG1-CD1 3.75Å; V122-I126 HydrophobicContact CG1-CG1 4.29Å; V122-I126 WeakPolarHBondContact O-CG1 3.3Å; V122-I126 PolarHBondContact O-N 2.72Å
123	R	96.9	Very high	97.1	Very high	134 Å²	134	75 Å²	75	51%	0.506	37%	0.367	S	S	.	.	H	α-helix	trans	-59.3	-42.4	175	-176.8	-176	175.8	-77.8	2.4	112.2	A119 N121 L125 K127	A119-R123 WeakPolarHBondContact O-CB 3.17Å; A119-R123 PolarHBondContact O-N 3.19Å; N121-R123 VanDerWaalsContact C-N 3.32Å; N121-R123 PolarHBondContact O-N 3.27Å; R123-L125 VanDerWaalsContact C-N 3.33Å; R123-K127 WeakPolarHBondContact O-CB 3.47Å; R123-K127 WeakPolarHBondContact O-CG 3.45Å; R123-K127 PolarHBondContact O-N 2.88Å
124	K	96	Very high	97.3	Very high	125 Å²	125	68.9 Å²	68.9	54%	0.543	34%	0.336	S	S	.	.	H	α-helix	trans	-63.1	-41.8	176.3	-70.1	168.8	-172.3	168	0	111.1	W120 N121 V122 K127 R128	W120-K124 WeakPolarHBondContact O-CG 3.43Å; W120-K124 PolarHBondContact O-N 2.89Å; W120-K124 VanDerWaalsContact O-N 3.13Å; N121-K124 WeakPolarHBondContact O-CB 3.3Å; N121-K124 PolarHBondContact O-N 3.3Å; N121-K124 VanDerWaalsContact O-N 3.15Å; V122-K124 VanDerWaalsContact C-N 3.33Å; V122-K124 PolarHBondContact O-N 3.27Å; K124-K127 PolarHBondContact O-N 3.25Å; K124-R128 PolarHBondContact O-N 3.46Å
125	L	95.1	Very high	97.3	Very high	27 Å²	27	66.1 Å²	66.1	14%	0.141	32%	0.321	C	S	.	.	H	α-helix	trans	-60	-52.6	176.4	-177.5	64.6	0	0	0	111.5	D106 N121 V122 R123 K127 R128 Y129	D106-L125 HydrophobicContact CB-CD2 3.91Å; N121-L125 PolarHBondContact O-N 3.13Å; V122-L125 WeakPolarHBondContact O-CB 3.37Å; V122-L125 PolarHBondContact O-N 2.98Å; V122-L125 VanDerWaalsContact O-N 3.16Å; R123-L125 VanDerWaalsContact C-N 3.33Å; L125-K127 VanDerWaalsContact C-N 3.29Å; L125-K127 PolarHBondContact O-N 3.04Å; L125-R128 WeakPolarHBondContact O-CB 3.38Å; L125-R128 PolarHBondContact O-N 2.86Å; L125-R128 VanDerWaalsContact O-N 3.08Å; L125-Y129 HydrophobicContact CD1-CD2 4.45Å; L125-Y129 HydrophobicContact CD1-CE1 3.9Å; L125-Y129 HydrophobicContact CD1-CE2 3.76Å; L125-Y129 VanDerWaalsContact CD1-CZ 3.44Å; L125-Y129 WeakPolarHBondContact CD1-OH 3.31Å; L125-Y129 HydrophobicContact CD2-CE2 4.35Å; L125-Y129 HydrophobicContact CG-CD2 4.34Å; L125-Y129 HydrophobicContact CG-CE2 3.89Å; L125-Y129 PolarHBondContact O-N 3.34Å
126	I	96.7	Very high	97.4	Very high	44 Å²	44	61.3 Å²	61.3	23%	0.226	29%	0.288	C	S	.	.	H	α-helix	trans	-57.4	-44.2	177.8	-66.3	167.2	0	0	0	110.3	V122 R128 Y129 Q130 D185	V122-I126 HydrophobicContact CG1-CD1 3.75Å; V122-I126 HydrophobicContact CG1-CG1 4.29Å; V122-I126 WeakPolarHBondContact O-CG1 3.3Å; V122-I126 PolarHBondContact O-N 2.72Å; I126-R128 VanDerWaalsContact C-N 3.31Å; I126-R128 PolarHBondContact O-N 3.07Å; I126-Y129 PolarHBondContact O-N 2.89Å; I126-Q130 HydrophobicContact CG2-CG 4.3Å; I126-Q130 WeakPolarHBondContact O-CG 3.12Å; I126-Q130 PolarHBondContact O-N 3.48Å; I126-D185 HydrophobicContact CG2-CB 4.29Å
127	K	98.3	Very high	97.4	Very high	105 Å²	105	60.5 Å²	60.5	46%	0.457	28%	0.275	S	S	.	.	H	α-helix	trans	-61.1	-38.2	177.3	-77.5	-62.8	-178.8	-166.6	0	113.1	R123 K124 L125 E131	R123-K127 WeakPolarHBondContact O-CB 3.47Å; R123-K127 WeakPolarHBondContact O-CG 3.45Å; R123-K127 PolarHBondContact O-N 2.88Å; K124-K127 PolarHBondContact O-N 3.25Å; L125-K127 VanDerWaalsContact C-N 3.29Å; L125-K127 PolarHBondContact O-N 3.04Å; K127-E131 PolarHBondContact O-N 3.09Å
128	R	97.4	Very high	97.5	Very high	148 Å²	148	60.7 Å²	60.7	56%	0.558	28%	0.279	S	S	*	.	H	α-helix	trans	-65.5	-40.3	175	-176.2	173.5	60.5	-179.3	0.5	111.7	K124 L125 I126 E131	K124-R128 PolarHBondContact O-N 3.46Å; L125-R128 WeakPolarHBondContact O-CB 3.38Å; L125-R128 PolarHBondContact O-N 2.86Å; L125-R128 VanDerWaalsContact O-N 3.08Å; I126-R128 VanDerWaalsContact C-N 3.31Å; I126-R128 PolarHBondContact O-N 3.07Å; R128-E131 WeakPolarHBondContact O-CB 3.41Å; R128-E131 PolarHBondContact O-N 3.3Å
129	Y	97.8	Very high	97.6	Very high	19 Å²	19	58.1 Å²	58.1	8%	0.075	27%	0.266	C	S	.	.	H	α-helix	trans	-76.4	-30.5	178.9	-65	-11.2	0	0	0	113.5	W66 M103 D106 L125 I126 E131 T132	W66-Y129 HydrophobicContact CB-CD1 3.61Å; W66-Y129 HydrophobicContact CB-CE1 3.61Å; W66-Y129 AromaticContact CD1-CE1 3.89Å; W66-Y129 AromaticContact CD2-CD1 3.84Å; W66-Y129 HydrophobicContact CD2-CD1 3.84Å; W66-Y129 HydrophobicContact CD2-CD2 4.33Å; W66-Y129 HydrophobicContact CD2-CE1 4.21Å; W66-Y129 AromaticContact CD2-CG 3.91Å; W66-Y129 HydrophobicContact CD2-CG 3.91Å; W66-Y129 HydrophobicContact CE3-CD1 4.01Å; W66-Y129 HydrophobicContact CE3-CD2 4.49Å; W66-Y129 AromaticContact CE3-CG 3.83Å; W66-Y129 HydrophobicContact CE3-CG 3.83Å; W66-Y129 AromaticContact CG-CD1 3.63Å; W66-Y129 HydrophobicContact CG-CD1 3.63Å; W66-Y129 AromaticContact CG-CE1 3.62Å; W66-Y129 HydrophobicContact CG-CE1 3.62Å; W66-Y129 HydrophobicContact CG-CG 4.19Å; W66-Y129 HydrophobicContact CZ3-CG 4.43Å; M103-Y129 HydrophobicContact CE-CE2 4.41Å; M103-Y129 WeakPolarHBondContact CE-OH 3.37Å; M103-Y129 HydrophobicContact SD-CE2 3.99Å; D106-Y129 PolarHBondContact OD2-OH 3.24Å; L125-Y129 HydrophobicContact CD1-CD2 4.45Å; L125-Y129 HydrophobicContact CD1-CE1 3.9Å; L125-Y129 HydrophobicContact CD1-CE2 3.76Å; L125-Y129 VanDerWaalsContact CD1-CZ 3.44Å; L125-Y129 WeakPolarHBondContact CD1-OH 3.31Å; L125-Y129 HydrophobicContact CD2-CE2 4.35Å; L125-Y129 HydrophobicContact CG-CD2 4.34Å; L125-Y129 HydrophobicContact CG-CE2 3.89Å; L125-Y129 PolarHBondContact O-N 3.34Å; I126-Y129 PolarHBondContact O-N 2.89Å; Y129-E131 PolarHBondContact O-N 3.36Å; Y129-T132 WeakPolarHBondContact O-CB 3.46Å; Y129-T132 PolarHBondContact O-N 3.2Å; Y129-T132 PolarHBondContact O-OG1 3.04Å
130	Q	98.8	Very high	97.7	Very high	47 Å²	47	56.6 Å²	56.6	22%	0.22	25%	0.251	C	S	.	.	H	α-helix	trans	-58.9	-36.6	167.2	-76.7	175.2	2	0	0	111.4	I126 T132 F133 S134 D185	I126-Q130 HydrophobicContact CG2-CG 4.3Å; I126-Q130 WeakPolarHBondContact O-CG 3.12Å; I126-Q130 PolarHBondContact O-N 3.48Å; Q130-T132 VanDerWaalsContact C-N 3.32Å; Q130-T132 PolarHBondContact O-N 3.3Å; Q130-F133 PolarHBondContact O-N 3.25Å; Q130-S134 WeakPolarHBondContact O-CB 3.34Å; Q130-S134 PolarHBondContact O-N 2.71Å; Q130-S134 PolarHBondContact O-OG 3.02Å; Q130-D185 WeakPolarHBondContact CG-O 3.21Å; Q130-D185 PolarHBondContact NE2-O 3.02Å
131	E	98.8	Very high	97.8	Very high	56 Å²	56	49.2 Å²	49.2	26%	0.262	22%	0.223	S	C	.	.	H	α-helix	trans	-65.4	-35.5	179.9	-169.3	59.7	-160.8	0	0	112	V70 K127 R128 Y129 F133 S134 V135 K138	V70-E131 HydrophobicContact CG1-CG 4.33Å; V70-E131 HydrophobicContact CG2-CB 4.39Å; V70-E131 HydrophobicContact CG2-CG 4.13Å; K127-E131 PolarHBondContact O-N 3.09Å; R128-E131 WeakPolarHBondContact O-CB 3.41Å; R128-E131 PolarHBondContact O-N 3.3Å; Y129-E131 PolarHBondContact O-N 3.36Å; E131-F133 PolarHBondContact O-N 2.81Å; E131-S134 PolarHBondContact O-N 2.96Å; E131-V135 HydrophobicContact CG-CG1 4.17Å; E131-V135 WeakPolarHBondContact O-CG1 3.41Å; E131-V135 WeakPolarHBondContact O-CG2 3.24Å; E131-V135 PolarHBondContact O-N 2.94Å; E131-V135 WeakPolarHBondContact OE1-CG1 3.45Å; E131-K138 IonicContact OE1-NZ 2.77Å; E131-K138 PolarHBondContact OE1-NZ 2.73Å; E131-K138 IonicContact OE2-NZ 3.72Å; E131-K138 PolarHBondContact OE2-NZ 2.79Å
132	T	98.8	Very high	98	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-48.1	-37.4	175.6	-54.6	0	0	0	0	113.3	F65 W66 M69 Y129 Q130 V135	F65-T132 HydrophobicContact CD1-CG2 4.36Å; F65-T132 HydrophobicContact CE1-CG2 4Å; W66-T132 WeakPolarHBondContact CA-OG1 3.36Å; W66-T132 HydrophobicContact CD2-CG2 4.42Å; W66-T132 HydrophobicContact CE3-CG2 3.64Å; W66-T132 HydrophobicContact CZ3-CG2 4.21Å; W66-T132 PolarHBondContact O-OG1 2.89Å; M69-T132 HydrophobicContact CB-CG2 3.66Å; M69-T132 HydrophobicContact CG-CG2 4.03Å; Y129-T132 WeakPolarHBondContact O-CB 3.46Å; Y129-T132 PolarHBondContact O-N 3.2Å; Y129-T132 PolarHBondContact O-OG1 3.04Å; Q130-T132 VanDerWaalsContact C-N 3.32Å; Q130-T132 PolarHBondContact O-N 3.3Å; T132-V135 VanDerWaalsContact O-CG2 3.26Å; T132-V135 WeakPolarHBondContact O-CG2 3.21Å
133	F	98.8	Very high	98.2	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-101.8	-26.4	176.3	-53	-46.5	0	0	0	113.2	M61 F65 W66 Q130 E131 V135 L136 G154 D157 L158 A161 V186	M61-F133 HydrophobicContact CE-CZ 4.29Å; M61-F133 HydrophobicContact SD-CZ 3.89Å; F65-F133 AromaticContact CE1-CE1 3.97Å; F65-F133 HydrophobicContact CE1-CE1 3.97Å; F65-F133 HydrophobicContact CE1-CZ 4.26Å; F65-F133 HydrophobicContact CZ-CE1 4.26Å; W66-F133 HydrophobicContact CE3-CZ 4.47Å; W66-F133 AromaticContact CH2-CE2 3.85Å; W66-F133 HydrophobicContact CH2-CE2 3.85Å; W66-F133 AromaticContact CH2-CZ 3.8Å; W66-F133 HydrophobicContact CH2-CZ 3.8Å; W66-F133 HydrophobicContact CZ3-CD2 4.37Å; W66-F133 HydrophobicContact CZ3-CE1 4.46Å; W66-F133 AromaticContact CZ3-CE2 3.47Å; W66-F133 HydrophobicContact CZ3-CE2 3.47Å; W66-F133 VanDerWaalsContact CZ3-CE2 3.47Å; W66-F133 AromaticContact CZ3-CZ 3.53Å; W66-F133 HydrophobicContact CZ3-CZ 3.53Å; Q130-F133 PolarHBondContact O-N 3.25Å; E131-F133 PolarHBondContact O-N 2.81Å; F133-V135 PolarHBondContact O-N 3.2Å; F133-L136 HydrophobicContact CB-CD1 4.05Å; F133-L136 HydrophobicContact CD1-CD1 4.04Å; F133-L136 VanDerWaalsContact O-CB 3.29Å; F133-L136 WeakPolarHBondContact O-CB 3.17Å; F133-L136 WeakPolarHBondContact O-CD1 3.45Å; F133-L136 PolarHBondContact O-N 2.77Å; F133-L136 VanDerWaalsContact O-N 3.09Å; F133-G154 WeakPolarHBondContact CZ-O 3.42Å; F133-D157 HydrophobicContact CD2-CB 3.57Å; F133-D157 HydrophobicContact CE2-CB 3.5Å; F133-D157 VanDerWaalsContact CE2-CB 3.5Å; F133-D157 HydrophobicContact CZ-CB 4.41Å; F133-L158 HydrophobicContact CD1-CB 3.82Å; F133-L158 HydrophobicContact CD1-CG 4.05Å; F133-L158 HydrophobicContact CE1-CB 3.6Å; F133-L158 HydrophobicContact CE1-CD1 4.19Å; F133-L158 HydrophobicContact CE1-CG 3.94Å; F133-L158 HydrophobicContact CZ-CB 4.19Å; F133-A161 HydrophobicContact CB-CB 4.1Å; F133-A161 WeakPolarHBondContact O-CB 3.33Å; F133-V186 HydrophobicContact CD2-CB 4.2Å; F133-V186 HydrophobicContact CD2-CG2 4.13Å; F133-V186 HydrophobicContact CE2-CB 4.18Å; F133-V186 HydrophobicContact CE2-CG2 3.72Å
134	S	98.9	Very high	98.3	Very high	23 Å²	23	38.5 Å²	38.5	16%	0.161	18%	0.175	C	C	.	.	H	α-helix	trans	-66	-26.1	178.4	-56.7	0	0	0	0	112.6	Q130 E131 L136 E137 K138 R191	Q130-S134 WeakPolarHBondContact O-CB 3.34Å; Q130-S134 PolarHBondContact O-N 2.71Å; Q130-S134 PolarHBondContact O-OG 3.02Å; E131-S134 PolarHBondContact O-N 2.96Å; S134-L136 PolarHBondContact O-N 2.85Å; S134-E137 PolarHBondContact O-N 3.02Å; S134-K138 WeakPolarHBondContact O-CG 3.1Å; S134-K138 PolarHBondContact O-N 3.28Å; S134-R191 PolarHBondContact OG-NH2 3.47Å
135	V	98.8	Very high	98.4	Very high	6 Å²	6	32.5 Å²	32.5	4%	0.036	15%	0.149	C	C	.	.	H	α-helix	trans	-61.7	-26.8	171.9	-68.3	0	0	0	0	113.9	V70 F73 E131 T132 F133 C139	V70-V135 HydrophobicContact CB-CG1 4.39Å; V70-V135 HydrophobicContact CG1-CG1 4.04Å; V70-V135 HydrophobicContact CG2-CG1 4.35Å; F73-V135 HydrophobicContact CB-CB 3.76Å; F73-V135 HydrophobicContact CB-CG2 3.65Å; F73-V135 HydrophobicContact CG-CG2 4.16Å; E131-V135 HydrophobicContact CG-CG1 4.17Å; E131-V135 WeakPolarHBondContact O-CG1 3.41Å; E131-V135 WeakPolarHBondContact O-CG2 3.24Å; E131-V135 PolarHBondContact O-N 2.94Å; E131-V135 WeakPolarHBondContact OE1-CG1 3.45Å; T132-V135 VanDerWaalsContact O-CG2 3.26Å; T132-V135 WeakPolarHBondContact O-CG2 3.21Å; F133-V135 PolarHBondContact O-N 3.2Å; V135-C139 VanDerWaalsContact O-CB 3.29Å; V135-C139 WeakPolarHBondContact O-CB 3.4Å; V135-C139 PolarHBondContact O-N 2.84Å
136	L	98.8	Very high	98.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.5	-42.5	176.3	-63.6	147.6	0	0	0	111	M69 F73 I87 F133 S134 V143 L158 A161 K256	M69-L136 HydrophobicContact CE-CD1 4.38Å; M69-L136 HydrophobicContact CE-CD2 4.16Å; M69-L136 HydrophobicContact CE-CG 4.49Å; F73-L136 HydrophobicContact CD1-CD2 4.17Å; F73-L136 HydrophobicContact CD2-CD2 4.25Å; F73-L136 HydrophobicContact CE1-CD2 3.58Å; F73-L136 HydrophobicContact CE1-CG 4.42Å; F73-L136 HydrophobicContact CE2-CD2 3.67Å; F73-L136 HydrophobicContact CG-CD2 4.49Å; F73-L136 HydrophobicContact CZ-CD2 3.32Å; F73-L136 HydrophobicContact CZ-CG 4.42Å; I87-L136 HydrophobicContact CD1-CD2 3.23Å; F133-L136 HydrophobicContact CB-CD1 4.05Å; F133-L136 HydrophobicContact CD1-CD1 4.04Å; F133-L136 VanDerWaalsContact O-CB 3.29Å; F133-L136 WeakPolarHBondContact O-CB 3.17Å; F133-L136 WeakPolarHBondContact O-CD1 3.45Å; F133-L136 PolarHBondContact O-N 2.77Å; F133-L136 VanDerWaalsContact O-N 3.09Å; S134-L136 PolarHBondContact O-N 2.85Å; L136-V143 HydrophobicContact CD2-CG1 3.96Å; L136-L158 HydrophobicContact CD1-CG 4.3Å; L136-A161 HydrophobicContact CB-CB 4.19Å; L136-A161 HydrophobicContact CD1-CB 3.98Å; L136-K256 PolarHBondContact O-NZ 3.49Å
137	E	98.7	Very high	98.7	Very high	36 Å²	36	29.1 Å²	29.1	17%	0.168	13%	0.132	C	C	.	.	H	α-helix	trans	-74.5	-39.6	179.1	-170.3	173.5	113.5	0	0	111	S134 C139 R191 I260 R263	S134-E137 PolarHBondContact O-N 3.02Å; E137-C139 VanDerWaalsContact C-N 3.35Å; E137-R191 IonicContact OE2-NE 2.82Å; E137-R191 PolarHBondContact OE2-NE 3.43Å; E137-I260 HydrophobicContact CG-CD1 3.67Å; E137-I260 HydrophobicContact CG-CG1 4.09Å; E137-I260 HydrophobicContact CG-CG2 4.16Å; E137-I260 WeakPolarHBondContact O-CD1 3.25Å; E137-R263 VanDerWaalsContact CD-NH1 3.34Å; E137-R263 IonicContact OE1-CZ 3.42Å; E137-R263 IonicContact OE1-NH1 2.76Å; E137-R263 IonicContact OE1-NH2 2.67Å; E137-R263 PolarHBondContact OE1-NH2 3.47Å; E137-R263 IonicContact OE2-CZ 2.71Å; E137-R263 IonicContact OE2-NH1 3.29Å; E137-R263 PolarHBondContact OE2-NH1 3.29Å; E137-R263 IonicContact OE2-NH2 3.66Å; E137-R263 PolarHBondContact OE2-NH2 2.72Å
138	K	98.7	Very high	98.7	Very high	131 Å²	131	24.5 Å²	24.5	57%	0.57	11%	0.112	S	C	*	.	H	α-helix	trans	-69.4	-28.9	176.3	-68.1	174.5	-168.5	174.4	0	113.4	E131 S134 P140	E131-K138 IonicContact OE1-NZ 2.77Å; E131-K138 PolarHBondContact OE1-NZ 2.73Å; E131-K138 IonicContact OE2-NZ 3.72Å; E131-K138 PolarHBondContact OE2-NZ 2.79Å; S134-K138 WeakPolarHBondContact O-CG 3.1Å; S134-K138 PolarHBondContact O-N 3.28Å; K138-P140 WeakPolarHBondContact O-CD 3.44Å
139	C	98.8	Very high	98.8	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.088	C	C	.	.	S	Bend	trans	-60.8	122.4	175.3	176.6	0	0	0	0	109.4	F73 S77 V135 E137 K141 K256	F73-C139 HydrophobicContact CD1-CB 4.01Å; S77-C139 WeakPolarHBondContact OG-CA 3.45Å; V135-C139 VanDerWaalsContact O-CB 3.29Å; V135-C139 WeakPolarHBondContact O-CB 3.4Å; V135-C139 PolarHBondContact O-N 2.84Å; E137-C139 VanDerWaalsContact C-N 3.35Å; C139-K141 PolarHBondContact O-N 2.82Å; C139-K256 WeakPolarHBondContact O-CE 3.4Å; C139-K256 PolarHBondContact O-NZ 2.99Å
140	P	98.6	Very high	98.8	Very high	25 Å²	25	17.3 Å²	17.3	16%	0.162	9%	0.089	C	C	.	.	S	Bend	trans	-72.4	-16.1	-174.4	29	-34.8	0	0	0	112.7	K138 Q253 I257	K138-P140 WeakPolarHBondContact O-CD 3.44Å; P140-Q253 HydrophobicContact CB-CB 4.08Å; P140-Q253 HydrophobicContact CB-CG 4.2Å; P140-Q253 WeakPolarHBondContact O-CA 3.45Å; P140-Q253 WeakPolarHBondContact O-CG 3.4Å; P140-I257 HydrophobicContact CB-CD1 4.12Å; P140-I257 HydrophobicContact CB-CG1 4.45Å
141	K	98.8	Very high	98.8	Very high	2 Å²	2	15.1 Å²	15.1	1%	0.009	8%	0.078	C	C	.	.	S	Bend	trans	-78	138.5	175.6	-64.9	92.6	-175	-161.2	0	110.4	I76 S77 D79 C82 V85 C139 K256	I76-K141 PolarHBondContact O-NZ 2.86Å; S77-K141 VanDerWaalsContact C-NZ 3.28Å; S77-K141 PolarHBondContact O-NZ 3.19Å; D79-K141 WeakPolarHBondContact O-CE 3.41Å; D79-K141 PolarHBondContact O-NZ 3.39Å; C82-K141 WeakPolarHBondContact O-CE 3.28Å; V85-K141 HydrophobicContact CG2-CB 4.47Å; C139-K141 PolarHBondContact O-N 2.82Å; K141-K256 PolarHBondContact O-NZ 2.61Å
142	P	98.9	Very high	98.8	Very high	14 Å²	14	13.9 Å²	13.9	9%	0.091	7%	0.073	C	C	.	.			trans	-59.3	139.8	172.7	-26.8	36.6	0	0	0	112.4	R83 V85 D163 I244 V252	R83-P142 WeakPolarHBondContact O-CD 3.25Å; V85-P142 PolarHBondContact N-O 3.39Å; P142-D163 WeakPolarHBondContact CA-OD2 3.48Å; P142-I244 HydrophobicContact CB-CG2 4.47Å; P142-I244 HydrophobicContact CG-CG2 4.02Å; P142-V252 HydrophobicContact CG-CG1 3.36Å
143	V	98.9	Very high	98.8	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	120.2	-179.2	-173.8	0	0	0	0	108.9	F73 V85 I87 L136 C162 D163 I164	F73-V143 HydrophobicContact CE1-CG1 4.42Å; F73-V143 HydrophobicContact CE1-CG2 3.89Å; F73-V143 HydrophobicContact CZ-CG1 4.44Å; V85-V143 HydrophobicContact CB-CG1 4.33Å; V85-V143 HydrophobicContact CB-CG2 4.18Å; V85-V143 HydrophobicContact CG2-CG2 4.4Å; V85-V143 CarbonylContact O-C 3.51Å; V85-V143 WeakPolarHBondContact O-CA 3.47Å; I87-V143 HydrophobicContact CD1-CG1 3.51Å; I87-V143 HydrophobicContact CG1-CG1 3.83Å; L136-V143 HydrophobicContact CD2-CG1 3.96Å; V143-C162 HydrophobicContact CB-CB 4.45Å; V143-C162 HydrophobicContact CG1-CB 4.2Å; V143-D163 PolarHBondContact N-OD2 3.44Å; V143-D163 PolarHBondContact O-N 2.98Å; V143-I164 PolarHBondContact O-N 2.9Å
144	V	98.9	Very high	98.8	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	115.9	179.1	-173.3	0	0	0	0	109.1	V84 V85 L86 I87 I164 L166 M240	V84-V144 HydrophobicContact CG1-CG2 4.23Å; V85-V144 PolarHBondContact O-N 2.81Å; L86-V144 CarbonylContact C-O 3.58Å; L86-V144 WeakPolarHBondContact CA-O 3.26Å; L86-V144 HydrophobicContact CD2-CB 3.68Å; L86-V144 HydrophobicContact CD2-CG1 4.24Å; L86-V144 HydrophobicContact CD2-CG2 4.16Å; I87-V144 PolarHBondContact N-O 3.34Å; V144-I164 CarbonylContact C-O 3.53Å; V144-I164 WeakPolarHBondContact CA-O 3.12Å; V144-I164 HydrophobicContact CG1-CB 4.21Å; V144-I164 HydrophobicContact CG1-CG2 4.17Å; V144-I164 HydrophobicContact CG2-CB 4.23Å; V144-I164 HydrophobicContact CG2-CD1 4.37Å; V144-L166 HydrophobicContact CG1-CD1 3.87Å; V144-L166 HydrophobicContact CG1-CG 4.05Å; V144-M240 HydrophobicContact CG1-SD 4.37Å
145	A	98.9	Very high	98.8	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	128.7	170.6	0	0	0	0	0	110.5	V147 I159 C162 I164 R165 L166	A145-V147 HydrophobicContact CB-CG2 4.35Å; A145-I159 HydrophobicContact CB-CB 4.17Å; A145-I159 HydrophobicContact CB-CG2 3.88Å; A145-C162 HydrophobicContact CB-CB 4.09Å; A145-I164 PolarHBondContact N-O 3.39Å; A145-R165 HydrophobicContact CB-CG 4.19Å; A145-R165 CarbonylContact O-C 3.31Å; A145-R165 WeakPolarHBondContact O-CA 3.45Å; A145-L166 PolarHBondContact O-N 3.03Å
146	A	98.9	Very high	98.8	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	99.5	174.6	0	0	0	0	0	108.8	I87 M233 M234 A237	I87-A146 PolarHBondContact O-N 3.46Å; A146-M233 VanDerWaalsContact C-CE 3.45Å; A146-M233 VanDerWaalsContact C-SD 3.54Å; A146-M233 HydrophobicContact CB-CE 3.8Å; A146-M233 HydrophobicContact CB-CG 4.19Å; A146-M233 HydrophobicContact CB-SD 3.9Å; A146-M234 HydrophobicContact CB-SD 3.91Å; A146-A237 HydrophobicContact CB-CB 4.36Å
147	V	98.9	Very high	98.8	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	121.8	-168.2	-177.8	0	0	0	0	111.3	F94 A145 C151 I159 L166 C167 T168 F173 M233	F94-V147 HydrophobicContact CB-CG1 3.78Å; F94-V147 HydrophobicContact CD1-CG1 4.3Å; F94-V147 HydrophobicContact CD1-CG2 4.38Å; F94-V147 HydrophobicContact CD2-CB 4.48Å; F94-V147 HydrophobicContact CD2-CG2 4.22Å; F94-V147 HydrophobicContact CE2-CG2 4.33Å; F94-V147 HydrophobicContact CG-CB 4.41Å; F94-V147 HydrophobicContact CG-CG1 3.96Å; F94-V147 HydrophobicContact CG-CG2 4.26Å; F94-V147 HydrophobicContact CZ-CG2 4.49Å; A145-V147 HydrophobicContact CB-CG2 4.35Å; V147-C151 HydrophobicContact CG1-CB 3.71Å; V147-I159 HydrophobicContact CG2-CG2 3.8Å; V147-L166 PolarHBondContact N-O 3.04Å; V147-C167 HydrophobicContact CB-CB 4.2Å; V147-C167 CarbonylContact O-C 3.53Å; V147-C167 WeakPolarHBondContact O-CA 3.44Å; V147-C167 VanDerWaalsContact O-CB 3.29Å; V147-C167 WeakPolarHBondContact O-CB 3.36Å; V147-T168 PolarHBondContact O-N 3.35Å; V147-F173 HydrophobicContact CB-CE1 4.18Å; V147-F173 HydrophobicContact CB-CZ 4.38Å; V147-F173 HydrophobicContact CG1-CE1 3.78Å; V147-F173 HydrophobicContact CG1-CZ 4.16Å; V147-F173 HydrophobicContact CG2-CE1 4.22Å; V147-M233 PolarHBondContact N-SD 2.75Å; V147-M233 VanDerWaalsContact N-SD 3.36Å; V147-M233 VanDerWaalsContact O-SD 3.41Å
148	H	98.9	Very high	98.8	Very high	7 Å²	7	11.4 Å²	11.4	3%	0.032	6%	0.062	C	C	.	.			trans	-117.4	151.9	168.6	70.5	-62	0	0	0	111.9	G89 G91 T93 F94 T168 Q230 M233	G89-H148 PolarHBondContact O-CE1 2.81Å; G91-H148 PolarHBondContact O-NE2 2.81Å; T93-H148 CarbonylContact C-O 3.57Å; T93-H148 PolarHBondContact N-NE2 3.33Å; F94-H148 WeakPolarHBondContact CB-O 3.19Å; F94-H148 PolarHBondContact N-O 3.25Å; H148-T168 VanDerWaalsContact CA-OG1 3.26Å; H148-T168 WeakPolarHBondContact CA-OG1 3.33Å; H148-T168 HydrophobicContact CB-CG2 3.64Å; H148-Q230 HydrophobicContact CB-CB 4.26Å; H148-Q230 HydrophobicContact CB-CG 4.22Å; H148-Q230 PolarHBondContact CD2-OE1 3.21Å; H148-Q230 VanDerWaalsContact CD2-OE1 3.28Å; H148-Q230 PolarHBondContact CE1-NE2 3.08Å; H148-Q230 VanDerWaalsContact CE1-NE2 3.25Å; H148-Q230 PolarHBondContact ND1-NE2 3.49Å; H148-Q230 PolarHBondContact NE2-NE2 3.49Å; H148-Q230 PolarHBondContact NE2-OE1 2.83Å; H148-M233 HydrophobicContact CB-CE 4.09Å
149	G	98.8	Very high	98.9	Very high	7 Å²	7	5.1 Å²	5.1	7%	0.072	3%	0.034	C	C	.	.	S	Bend	trans	55.2	-140.2	-177	0	0	0	0	0	113.5	A171 W172	G149-A171 CarbonylContact O-C 3.44Å; G149-A171 WeakPolarHBondContact O-CA 3.47Å; G149-W172 PolarHBondContact O-N 3.28Å
150	A	98.8	Very high	98.9	Very high	10 Å²	10	5.3 Å²	5.3	8%	0.083	4%	0.035	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	136.2	-177.4	0	0	0	0	0	113.8	T93 F94 T95 I152 W172	T93-A150 WeakPolarHBondContact OG1-CA 3.43Å; T93-A150 WeakPolarHBondContact OG1-CB 3.27Å; T93-A150 PolarHBondContact OG1-N 3.25Å; T93-A150 PolarHBondContact OG1-O 2.82Å; F94-A150 WeakPolarHBondContact CB-O 3.46Å; F94-A150 PolarHBondContact N-O 2.83Å; T95-A150 PolarHBondContact N-O 2.98Å; T95-A150 VanDerWaalsContact O-O 3.14Å; A150-I152 HydrophobicContact CB-CD1 3.88Å; A150-I152 HydrophobicContact CB-CG1 3.82Å; A150-W172 HydrophobicContact CB-CD2 4.09Å; A150-W172 HydrophobicContact CB-CE3 4.43Å; A150-W172 HydrophobicContact CB-CH2 3.63Å; A150-W172 HydrophobicContact CB-CZ2 3.17Å; A150-W172 HydrophobicContact CB-CZ3 4.21Å
151	C	98.9	Very high	98.9	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	3%	0.029	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	97.7	167.5	-176.8	0	0	0	0	109	F94 V147 G155 W172 F173 Q174	F94-C151 HydrophobicContact CD1-CB 4.14Å; V147-C151 HydrophobicContact CG1-CB 3.71Å; C151-G155 PolarHBondContact SG-O 3.26Å; C151-G155 VanDerWaalsContact SG-O 3.34Å; C151-W172 PolarHBondContact N-O 2.72Å; C151-F173 HydrophobicContact CB-CD1 3.76Å; C151-F173 HydrophobicContact CB-CE1 4.15Å; C151-F173 WeakPolarHBondContact O-CA 3.21Å; C151-Q174 PolarHBondContact O-N 2.81Å
152	I	98.9	Very high	98.9	Very high	30 Å²	30	4.4 Å²	4.4	15%	0.154	3%	0.03	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	138.2	-165.3	-48.4	180	0	0	0	111.2	T95 G97 A150 G154 G155 W172 Q174 K176	T95-I152 PolarHBondContact O-N 3.22Å; G97-I152 WeakPolarHBondContact CA-O 3.32Å; A150-I152 HydrophobicContact CB-CD1 3.88Å; A150-I152 HydrophobicContact CB-CG1 3.82Å; I152-G154 PolarHBondContact O-N 3.4Å; I152-G155 PolarHBondContact O-N 2.84Å; I152-W172 HydrophobicContact CD1-CH2 3.37Å; I152-W172 HydrophobicContact CD1-CZ2 4.21Å; I152-W172 HydrophobicContact CD1-CZ3 3.93Å; I152-W172 HydrophobicContact CG1-CH2 3.62Å; I152-W172 HydrophobicContact CG1-CZ3 3.65Å; I152-Q174 HydrophobicContact CG2-CB 4.5Å; I152-K176 HydrophobicContact CG2-CB 3.63Å; I152-K176 HydrophobicContact CG2-CD 4.43Å; I152-K176 HydrophobicContact CG2-CG 3.77Å
153	G	98.7	Very high	98.9	Very high	5 Å²	5	6.2 Å²	6.2	5%	0.052	4%	0.039	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	-118.5	172.8	0	0	0	0	0	111.4	G155 V156 Q174 E177	G153-G155 PolarHBondContact O-N 3.44Å; G153-V156 WeakPolarHBondContact O-CA 3.38Å; G153-V156 WeakPolarHBondContact O-CB 3.35Å; G153-V156 PolarHBondContact O-N 2.8Å; G153-Q174 PolarHBondContact N-O 3.26Å; G153-E177 WeakPolarHBondContact CA-OE1 3.33Å
154	G	98.6	Very high	98.9	Very high	5 Å²	5	8.1 Å²	8.1	5%	0.052	5%	0.049	C	C	.	.	H	α-helix	trans	-50	-20.4	173.9	0	0	0	0	0	115.7	F133 I152 V156 D157 L158 E177	F133-G154 WeakPolarHBondContact CZ-O 3.42Å; I152-G154 PolarHBondContact O-N 3.4Å; G154-V156 VanDerWaalsContact C-N 3.34Å; G154-D157 WeakPolarHBondContact CA-OD2 3.48Å; G154-D157 PolarHBondContact O-N 2.81Å; G154-L158 WeakPolarHBondContact O-CB 3.48Å; G154-L158 PolarHBondContact O-N 3.49Å; G154-E177 PolarHBondContact N-OE1 2.96Å
155	G	98.9	Very high	98.9	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-61.2	-39	167.9	0	0	0	0	0	113.6	T95 C151 I152 G153 L158 I159	T95-G155 VanDerWaalsContact CG2-CA 3.41Å; C151-G155 PolarHBondContact SG-O 3.26Å; C151-G155 VanDerWaalsContact SG-O 3.34Å; I152-G155 PolarHBondContact O-N 2.84Å; G153-G155 PolarHBondContact O-N 3.44Å; G155-L158 WeakPolarHBondContact O-CB 3.39Å; G155-L158 PolarHBondContact O-N 2.92Å; G155-I159 WeakPolarHBondContact O-CG2 3.22Å; G155-I159 PolarHBondContact O-N 3.08Å
156	V	98.9	Very high	98.9	Very high	3 Å²	3	9 Å²	9	2%	0.018	5%	0.052	C	C	.	.	H	α-helix	trans	-68.3	-40	174.7	-175.5	0	0	0	0	110.5	G153 G154 L158 I159 T160 Q174 V175 T188	G153-V156 WeakPolarHBondContact O-CA 3.38Å; G153-V156 WeakPolarHBondContact O-CB 3.35Å; G153-V156 PolarHBondContact O-N 2.8Å; G154-V156 VanDerWaalsContact C-N 3.34Å; V156-L158 VanDerWaalsContact C-N 3.28Å; V156-L158 PolarHBondContact O-N 2.68Å; V156-I159 PolarHBondContact O-N 3.06Å; V156-T160 HydrophobicContact CG1-CG2 3.99Å; V156-T160 WeakPolarHBondContact O-CB 3.26Å; V156-T160 WeakPolarHBondContact O-CG2 3.46Å; V156-T160 PolarHBondContact O-N 3.3Å; V156-T160 PolarHBondContact O-OG1 3.31Å; V156-Q174 WeakPolarHBondContact CG2-O 3.41Å; V156-V175 HydrophobicContact CG1-CG2 4.22Å; V156-T188 HydrophobicContact CG1-CG2 4Å
157	D	98.9	Very high	98.9	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-60.1	-40.7	174.9	-59.9	-104.4	0	0	0	111.4	F133 G154 T160 A161 V186 G187 T188	F133-D157 HydrophobicContact CD2-CB 3.57Å; F133-D157 HydrophobicContact CE2-CB 3.5Å; F133-D157 VanDerWaalsContact CE2-CB 3.5Å; F133-D157 HydrophobicContact CZ-CB 4.41Å; G154-D157 WeakPolarHBondContact CA-OD2 3.48Å; G154-D157 PolarHBondContact O-N 2.81Å; D157-T160 PolarHBondContact O-OG1 3.28Å; D157-A161 PolarHBondContact O-N 2.84Å; D157-V186 HydrophobicContact CB-CG2 3.84Å; D157-V186 VanDerWaalsContact CG-CG2 3.49Å; D157-V186 VanDerWaalsContact OD1-CG2 3.29Å; D157-V186 WeakPolarHBondContact OD1-CG2 3.29Å; D157-G187 PolarHBondContact OD1-N 3.32Å; D157-T188 WeakPolarHBondContact CA-OG1 3.49Å; D157-T188 PolarHBondContact N-OG1 3.47Å; D157-T188 WeakPolarHBondContact OD1-CB 3.33Å; D157-T188 PolarHBondContact OD1-N 2.77Å; D157-T188 PolarHBondContact OD1-OG1 3Å; D157-T188 PolarHBondContact OD2-OG1 3.1Å
158	L	98.9	Very high	98.9	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-61.9	-59.5	174.8	-171	170	0	0	0	111.2	L52 M61 F65 I87 F94 F133 L136 G154 G155 V156 T160 A161 C162	L52-L158 HydrophobicContact CD1-CD1 4.18Å; L52-L158 HydrophobicContact CD2-CD1 4.15Å; M61-L158 HydrophobicContact CE-CD1 4.17Å; F65-L158 HydrophobicContact CZ-CD1 4.15Å; I87-L158 HydrophobicContact CD1-CD2 4.29Å; I87-L158 HydrophobicContact CG2-CD2 4.31Å; F94-L158 HydrophobicContact CE1-CD1 4.31Å; F94-L158 HydrophobicContact CE1-CD2 4.41Å; F94-L158 HydrophobicContact CZ-CD1 4.22Å; F94-L158 HydrophobicContact CZ-CD2 4.01Å; F133-L158 HydrophobicContact CD1-CB 3.82Å; F133-L158 HydrophobicContact CD1-CG 4.05Å; F133-L158 HydrophobicContact CE1-CB 3.6Å; F133-L158 HydrophobicContact CE1-CD1 4.19Å; F133-L158 HydrophobicContact CE1-CG 3.94Å; F133-L158 HydrophobicContact CZ-CB 4.19Å; L136-L158 HydrophobicContact CD1-CG 4.3Å; G154-L158 WeakPolarHBondContact O-CB 3.48Å; G154-L158 PolarHBondContact O-N 3.49Å; G155-L158 WeakPolarHBondContact O-CB 3.39Å; G155-L158 PolarHBondContact O-N 2.92Å; V156-L158 VanDerWaalsContact C-N 3.28Å; V156-L158 PolarHBondContact O-N 2.68Å; L158-T160 VanDerWaalsContact C-N 3.28Å; L158-T160 PolarHBondContact O-N 2.93Å; L158-A161 WeakPolarHBondContact O-CB 3.33Å; L158-A161 PolarHBondContact O-N 3.38Å; L158-C162 PolarHBondContact O-N 3.14Å
159	I	98.9	Very high	98.9	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-71	-24.7	-170.2	67.7	170.5	0	0	0	113.1	F94 A145 V147 G155 V156 C162 R165 F173	F94-I159 HydrophobicContact CE1-CG2 3.68Å; F94-I159 HydrophobicContact CZ-CG2 3.89Å; A145-I159 HydrophobicContact CB-CB 4.17Å; A145-I159 HydrophobicContact CB-CG2 3.88Å; V147-I159 HydrophobicContact CG2-CG2 3.8Å; G155-I159 WeakPolarHBondContact O-CG2 3.22Å; G155-I159 PolarHBondContact O-N 3.08Å; V156-I159 PolarHBondContact O-N 3.06Å; I159-C162 WeakPolarHBondContact O-CB 3.14Å; I159-C162 PolarHBondContact O-N 2.69Å; I159-R165 HydrophobicContact CB-CG 4.2Å; I159-R165 VanDerWaalsContact O-CD 3.3Å; I159-R165 WeakPolarHBondContact O-CD 3.43Å; I159-R165 PolarHBondContact O-NH1 3.5Å; I159-R165 VanDerWaalsContact O-NH1 3.07Å; I159-F173 HydrophobicContact CD1-CD1 3.4Å; I159-F173 VanDerWaalsContact CD1-CD1 3.4Å; I159-F173 HydrophobicContact CD1-CE1 3.37Å
160	T	98.9	Very high	98.9	Very high	3 Å²	3	17.3 Å²	17.3	2%	0.018	9%	0.092	C	C	.	.	H	α-helix	trans	-76.1	-15.1	174.7	57	0	0	0	0	112.3	V156 D157 L158 R191 L192 V195 L222	V156-T160 HydrophobicContact CG1-CG2 3.99Å; V156-T160 WeakPolarHBondContact O-CB 3.26Å; V156-T160 WeakPolarHBondContact O-CG2 3.46Å; V156-T160 PolarHBondContact O-N 3.3Å; V156-T160 PolarHBondContact O-OG1 3.31Å; D157-T160 PolarHBondContact O-OG1 3.28Å; L158-T160 VanDerWaalsContact C-N 3.28Å; L158-T160 PolarHBondContact O-N 2.93Å; T160-R191 WeakPolarHBondContact O-CD 3.39Å; T160-L192 HydrophobicContact CG2-CB 4.05Å; T160-L192 HydrophobicContact CG2-CD1 3.95Å; T160-V195 HydrophobicContact CG2-CG2 4.18Å; T160-L222 HydrophobicContact CG2-CD1 4.4Å
161	A	98.9	Very high	98.9	Very high	3 Å²	3	16.9 Å²	16.9	3%	0.025	9%	0.088	C	C	.	.	H	α-helix	trans	-87.5	-12.5	167.5	0	0	0	0	0	113.6	F133 L136 D157 L158	F133-A161 HydrophobicContact CB-CB 4.1Å; F133-A161 WeakPolarHBondContact O-CB 3.33Å; L136-A161 HydrophobicContact CB-CB 4.19Å; L136-A161 HydrophobicContact CD1-CB 3.98Å; D157-A161 PolarHBondContact O-N 2.84Å; L158-A161 WeakPolarHBondContact O-CB 3.33Å; L158-A161 PolarHBondContact O-N 3.38Å
162	C	98.9	Very high	98.9	Very high	5 Å²	5	18.7 Å²	18.7	3%	0.034	10%	0.095	C	C	.	.	S	Bend	trans	-77.6	159	171.9	-61.4	0	0	0	0	111.8	V143 A145 L158 I159 R165	V143-C162 HydrophobicContact CB-CB 4.45Å; V143-C162 HydrophobicContact CG1-CB 4.2Å; A145-C162 HydrophobicContact CB-CB 4.09Å; L158-C162 PolarHBondContact O-N 3.14Å; I159-C162 WeakPolarHBondContact O-CB 3.14Å; I159-C162 PolarHBondContact O-N 2.69Å; C162-R165 PolarHBondContact O-NH1 3.36Å
163	D	98.9	Very high	98.9	Very high	52 Å²	52	17.5 Å²	17.5	28%	0.278	9%	0.089	S	C	.	.	S	Bend	trans	-79.4	-45.6	-178.3	-55.4	-74.3	0	0	0	111.5	P142 V143 K256	P142-D163 WeakPolarHBondContact CA-OD2 3.48Å; V143-D163 PolarHBondContact N-OD2 3.44Å; V143-D163 PolarHBondContact O-N 2.98Å; D163-K256 WeakPolarHBondContact OD1-CD 3.41Å; D163-K256 WeakPolarHBondContact OD1-CE 3.35Å; D163-K256 IonicContact OD1-NZ 2.82Å; D163-K256 VanDerWaalsContact OD2-CE 3.31Å; D163-K256 WeakPolarHBondContact OD2-CE 3.43Å; D163-K256 IonicContact OD2-NZ 2.97Å; D163-K256 PolarHBondContact OD2-NZ 3.16Å
164	I	98.9	Very high	98.9	Very high	41 Å²	41	18.2 Å²	18.2	21%	0.21	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	141.5	-176.8	-58.4	168	0	0	0	109.3	V143 V144 A145 L166 M240 I244	V143-I164 PolarHBondContact O-N 2.9Å; V144-I164 CarbonylContact C-O 3.53Å; V144-I164 WeakPolarHBondContact CA-O 3.12Å; V144-I164 HydrophobicContact CG1-CB 4.21Å; V144-I164 HydrophobicContact CG1-CG2 4.17Å; V144-I164 HydrophobicContact CG2-CB 4.23Å; V144-I164 HydrophobicContact CG2-CD1 4.37Å; A145-I164 PolarHBondContact N-O 3.39Å; I164-L166 HydrophobicContact CG2-CD2 4.32Å; I164-M240 HydrophobicContact CD1-SD 3.91Å; I164-M240 HydrophobicContact CG2-CE 4.45Å; I164-M240 HydrophobicContact CG2-SD 3.73Å; I164-I244 HydrophobicContact CD1-CD1 4.05Å
165	R	98.9	Very high	98.9	Very high	18 Å²	18	18.3 Å²	18.3	7%	0.068	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.7	178.3	-70.1	156.7	-71.1	-70.8	-9.6	110.6	A145 I159 C162 L222 V223 S224	A145-R165 HydrophobicContact CB-CG 4.19Å; A145-R165 CarbonylContact O-C 3.31Å; A145-R165 WeakPolarHBondContact O-CA 3.45Å; I159-R165 HydrophobicContact CB-CG 4.2Å; I159-R165 VanDerWaalsContact O-CD 3.3Å; I159-R165 WeakPolarHBondContact O-CD 3.43Å; I159-R165 PolarHBondContact O-NH1 3.5Å; I159-R165 VanDerWaalsContact O-NH1 3.07Å; C162-R165 PolarHBondContact O-NH1 3.36Å; R165-L222 WeakPolarHBondContact CB-O 3.41Å; R165-L222 WeakPolarHBondContact CD-O 3.32Å; R165-L222 PolarHBondContact NE-O 2.84Å; R165-V223 HydrophobicContact CB-CG1 4.11Å; R165-S224 WeakPolarHBondContact O-CB 3.5Å; R165-S224 PolarHBondContact O-N 3.29Å
166	L	98.9	Very high	98.9	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	150.7	172.5	-50.7	176.7	0	0	0	107.5	V144 A145 V147 I164 R225 F227 M233 A237 M240	V144-L166 HydrophobicContact CG1-CD1 3.87Å; V144-L166 HydrophobicContact CG1-CG 4.05Å; A145-L166 PolarHBondContact O-N 3.03Å; V147-L166 PolarHBondContact N-O 3.04Å; I164-L166 HydrophobicContact CG2-CD2 4.32Å; L166-R225 HydrophobicContact CD2-CB 3.87Å; L166-R225 HydrophobicContact CD2-CG 4.14Å; L166-F227 HydrophobicContact CB-CE2 4.12Å; L166-F227 HydrophobicContact CD1-CE2 4.23Å; L166-F227 HydrophobicContact CD2-CE2 4.27Å; L166-F227 HydrophobicContact CG-CE2 4.43Å; L166-M233 HydrophobicContact CB-CG 4.25Å; L166-A237 HydrophobicContact CD1-CB 3.71Å; L166-M240 HydrophobicContact CD2-CE 3.88Å; L166-M240 HydrophobicContact CD2-SD 4.49Å
167	C	98.9	Very high	98.9	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	167.6	171.4	79.3	0	0	0	0	113.9	V147 A171 F173 V223 R225 V226 F227 M233	V147-C167 HydrophobicContact CB-CB 4.2Å; V147-C167 CarbonylContact O-C 3.53Å; V147-C167 WeakPolarHBondContact O-CA 3.44Å; V147-C167 VanDerWaalsContact O-CB 3.29Å; V147-C167 WeakPolarHBondContact O-CB 3.36Å; C167-A171 HydrophobicContact CB-CB 3.67Å; C167-F173 HydrophobicContact CB-CZ 3.91Å; C167-V223 HydrophobicContact CB-CG1 4.09Å; C167-R225 PolarHBondContact N-O 2.8Å; C167-V226 CarbonylContact O-C 3.49Å; C167-V226 VanDerWaalsContact O-CA 3.25Å; C167-V226 WeakPolarHBondContact O-CA 3.23Å; C167-F227 PolarHBondContact O-N 2.89Å; C167-M233 VanDerWaalsContact CA-SD 3.58Å
168	T	98.9	Very high	98.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	167.3	168.5	56.2	0	0	0	0	111.4	V147 H148 D170 A171 A214 F227 D229 Q230 M233	V147-T168 PolarHBondContact O-N 3.35Å; H148-T168 VanDerWaalsContact CA-OG1 3.26Å; H148-T168 WeakPolarHBondContact CA-OG1 3.33Å; H148-T168 HydrophobicContact CB-CG2 3.64Å; T168-D170 VanDerWaalsContact C-N 3.29Å; T168-D170 WeakPolarHBondContact CB-OD1 3.34Å; T168-D170 PolarHBondContact O-N 3.25Å; T168-D170 PolarHBondContact OG1-OD1 3.08Å; T168-A171 WeakPolarHBondContact O-CB 3.34Å; T168-A171 PolarHBondContact O-N 3.4Å; T168-A214 WeakPolarHBondContact O-CB 3.33Å; T168-F227 CarbonylContact C-O 3.31Å; T168-F227 VanDerWaalsContact C-O 3.31Å; T168-F227 VanDerWaalsContact CA-O 3.22Å; T168-F227 WeakPolarHBondContact CA-O 3.26Å; T168-D229 WeakPolarHBondContact CG2-O 3.48Å; T168-Q230 HydrophobicContact CG2-CB 4.33Å; T168-M233 HydrophobicContact CG2-CB 4.03Å; T168-M233 HydrophobicContact CG2-CE 3.92Å; T168-M233 HydrophobicContact CG2-SD 3.89Å
169	Q	98.9	Very high	98.8	Very high	91 Å²	91	29 Å²	29	43%	0.425	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-31.1	179.3	-169.9	63.9	47.8	0	0	112.4	A171 A214 D215 V226 F227	Q169-A171 PolarHBondContact O-N 3.11Å; Q169-A214 WeakPolarHBondContact O-CB 3.44Å; Q169-D215 PolarHBondContact NE2-OD1 2.96Å; Q169-D215 PolarHBondContact NE2-OD2 2.69Å; Q169-V226 HydrophobicContact CB-CG1 4.41Å; Q169-F227 PolarHBondContact N-O 2.77Å
170	D	98.7	Very high	98.5	Very high	98 Å²	98	32.2 Å²	32.2	52%	0.524	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	0.1	176.2	72.9	-25.9	0	0	0	113.3	T168	T168-D170 VanDerWaalsContact C-N 3.29Å; T168-D170 WeakPolarHBondContact CB-OD1 3.34Å; T168-D170 PolarHBondContact O-N 3.25Å; T168-D170 PolarHBondContact OG1-OD1 3.08Å
171	A	98.9	Very high	98.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.197	C	C	.	.			trans	-71.9	147.7	-178.4	0	0	0	0	0	112.7	G149 C167 T168 Q169 A214	G149-A171 CarbonylContact O-C 3.44Å; G149-A171 WeakPolarHBondContact O-CA 3.47Å; C167-A171 HydrophobicContact CB-CB 3.67Å; T168-A171 WeakPolarHBondContact O-CB 3.34Å; T168-A171 PolarHBondContact O-N 3.4Å; Q169-A171 PolarHBondContact O-N 3.11Å; A171-A214 PolarHBondContact O-N 3.24Å
172	W	98.9	Very high	98.1	Very high	39 Å²	39	38.2 Å²	38.2	15%	0.148	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	151.5	171.7	57.5	-88.6	0	0	0	112	G149 A150 C151 I152 Q174 K211 M212 Y213	G149-W172 PolarHBondContact O-N 3.28Å; A150-W172 HydrophobicContact CB-CD2 4.09Å; A150-W172 HydrophobicContact CB-CE3 4.43Å; A150-W172 HydrophobicContact CB-CH2 3.63Å; A150-W172 HydrophobicContact CB-CZ2 3.17Å; A150-W172 HydrophobicContact CB-CZ3 4.21Å; C151-W172 PolarHBondContact N-O 2.72Å; I152-W172 HydrophobicContact CD1-CH2 3.37Å; I152-W172 HydrophobicContact CD1-CZ2 4.21Å; I152-W172 HydrophobicContact CD1-CZ3 3.93Å; I152-W172 HydrophobicContact CG1-CH2 3.62Å; I152-W172 HydrophobicContact CG1-CZ3 3.65Å; W172-Q174 HydrophobicContact CE3-CB 4.18Å; W172-Q174 HydrophobicContact CZ3-CB 3.84Å; W172-K211 HydrophobicContact CD2-CD 3.8Å; W172-K211 HydrophobicContact CD2-CG 4.28Å; W172-K211 HydrophobicContact CE3-CB 4.15Å; W172-K211 HydrophobicContact CE3-CD 3.59Å; W172-K211 HydrophobicContact CE3-CG 3.62Å; W172-K211 HydrophobicContact CG-CD 4.43Å; W172-K211 HydrophobicContact CH2-CD 4.1Å; W172-K211 VanDerWaalsContact CH2-CE 3.42Å; W172-K211 HydrophobicContact CZ2-CD 4.3Å; W172-K211 HydrophobicContact CZ3-CD 3.76Å; W172-K211 HydrophobicContact CZ3-CG 3.81Å; W172-M212 CarbonylContact C-O 3.51Å; W172-M212 VanDerWaalsContact CA-O 3.23Å; W172-M212 WeakPolarHBondContact CA-O 3.3Å; W172-Y213 HydrophobicContact CB-CD1 3.77Å; W172-Y213 HydrophobicContact CB-CE1 4.08Å; W172-Y213 HydrophobicContact CB-CG 4.32Å; W172-Y213 HydrophobicContact CG-CD1 4.41Å; W172-Y213 HydrophobicContact CG-CE1 4.28Å
173	F	98.9	Very high	98	Very high	5 Å²	5	41.1 Å²	41.1	2%	0.022	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	141	-171.4	-52	-89.4	0	0	0	109.9	V147 C151 I159 C167 M212 A217 L222 V223	V147-F173 HydrophobicContact CB-CE1 4.18Å; V147-F173 HydrophobicContact CB-CZ 4.38Å; V147-F173 HydrophobicContact CG1-CE1 3.78Å; V147-F173 HydrophobicContact CG1-CZ 4.16Å; V147-F173 HydrophobicContact CG2-CE1 4.22Å; C151-F173 HydrophobicContact CB-CD1 3.76Å; C151-F173 HydrophobicContact CB-CE1 4.15Å; C151-F173 WeakPolarHBondContact O-CA 3.21Å; I159-F173 HydrophobicContact CD1-CD1 3.4Å; I159-F173 VanDerWaalsContact CD1-CD1 3.4Å; I159-F173 HydrophobicContact CD1-CE1 3.37Å; C167-F173 HydrophobicContact CB-CZ 3.91Å; F173-M212 HydrophobicContact CB-CE 4.38Å; F173-M212 PolarHBondContact N-O 2.87Å; F173-M212 PolarHBondContact O-N 2.92Å; F173-A217 HydrophobicContact CD2-CB 3.69Å; F173-A217 HydrophobicContact CE2-CB 3.5Å; F173-A217 VanDerWaalsContact CE2-CB 3.5Å; F173-L222 HydrophobicContact CB-CD2 4.25Å; F173-L222 HydrophobicContact CD1-CD2 4.01Å; F173-L222 HydrophobicContact CD2-CD2 4.06Å; F173-L222 HydrophobicContact CE1-CD2 4.39Å; F173-L222 HydrophobicContact CE2-CD2 4.47Å; F173-L222 HydrophobicContact CG-CD2 3.82Å; F173-V223 HydrophobicContact CE2-CG1 4.13Å; F173-V223 HydrophobicContact CZ-CG1 3.69Å
174	Q	98.9	Very high	98	Very high	19 Å²	19	39 Å²	39	9%	0.089	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	117.8	-177.4	-171	176	26.4	0	0	111.4	C151 I152 G153 V156 W172 K176 A209	C151-Q174 PolarHBondContact O-N 2.81Å; I152-Q174 HydrophobicContact CG2-CB 4.5Å; G153-Q174 PolarHBondContact N-O 3.26Å; V156-Q174 WeakPolarHBondContact CG2-O 3.41Å; W172-Q174 HydrophobicContact CE3-CB 4.18Å; W172-Q174 HydrophobicContact CZ3-CB 3.84Å; Q174-K176 HydrophobicContact CG-CB 4.24Å; Q174-K176 HydrophobicContact CG-CD 4.29Å; Q174-K176 PolarHBondContact O-N 3.48Å; Q174-K176 VanDerWaalsContact O-N 3.12Å; Q174-A209 WeakPolarHBondContact CG-O 3.44Å; Q174-A209 PolarHBondContact NE2-O 3.38Å
175	V	98.8	Very high	98	Very high	7 Å²	7	39.7 Å²	39.7	4%	0.042	23%	0.229	C	C	.	.			trans	-77.2	91.5	166.5	-175.2	0	0	0	0	107	V156 E177 T188 L192 A206 A209	V156-V175 HydrophobicContact CG1-CG2 4.22Å; V175-E177 VanDerWaalsContact C-OE2 3.29Å; V175-E177 VanDerWaalsContact CG1-OE2 3.3Å; V175-E177 WeakPolarHBondContact CG1-OE2 3.21Å; V175-T188 HydrophobicContact CB-CG2 4.45Å; V175-T188 HydrophobicContact CG1-CG2 3.86Å; V175-T188 HydrophobicContact CG2-CG2 3.75Å; V175-L192 HydrophobicContact CG2-CD2 4.01Å; V175-A206 HydrophobicContact CG1-CB 4.28Å; V175-A209 VanDerWaalsContact O-CA 3.26Å; V175-A209 WeakPolarHBondContact O-CA 3.2Å; V175-A209 VanDerWaalsContact O-CB 3.25Å; V175-A209 WeakPolarHBondContact O-CB 3.36Å
176	K	98.5	Very high	98	Very high	60 Å²	60	39.3 Å²	39.3	26%	0.261	23%	0.229	S	C	.	.			trans	-89.1	-13.5	-162.7	-175.9	59.2	-176.4	178	0	113.5	I152 Q174 V178 D179 I180	I152-K176 HydrophobicContact CG2-CB 3.63Å; I152-K176 HydrophobicContact CG2-CD 4.43Å; I152-K176 HydrophobicContact CG2-CG 3.77Å; Q174-K176 HydrophobicContact CG-CB 4.24Å; Q174-K176 HydrophobicContact CG-CD 4.29Å; Q174-K176 PolarHBondContact O-N 3.48Å; Q174-K176 VanDerWaalsContact O-N 3.12Å; K176-V178 VanDerWaalsContact C-N 3.29Å; K176-V178 PolarHBondContact O-N 3.38Å; K176-D179 HydrophobicContact CD-CB 3.97Å; K176-D179 WeakPolarHBondContact CE-OD2 3.43Å; K176-D179 IonicContact NZ-OD2 3.86Å; K176-D179 PolarHBondContact NZ-OD2 3.44Å; K176-D179 WeakPolarHBondContact O-CB 3.35Å; K176-D179 PolarHBondContact O-N 3.19Å; K176-I180 HydrophobicContact CG-CD1 4.24Å
177	E	98.3	Very high	97.9	Very high	16 Å²	16	39.5 Å²	39.5	8%	0.075	23%	0.23	C	C	.	.	H	α-helix	trans	-60.8	-34.4	-163.4	-69.7	79.6	-171.7	0	0	113.3	G153 G154 V175 D179 I180 G181 L182 A184	G153-E177 WeakPolarHBondContact CA-OE1 3.33Å; G154-E177 PolarHBondContact N-OE1 2.96Å; V175-E177 VanDerWaalsContact C-OE2 3.29Å; V175-E177 VanDerWaalsContact CG1-OE2 3.3Å; V175-E177 WeakPolarHBondContact CG1-OE2 3.21Å; E177-D179 VanDerWaalsContact C-N 3.28Å; E177-D179 PolarHBondContact O-N 3.01Å; E177-I180 CarbonylContact O-C 3.57Å; E177-I180 WeakPolarHBondContact O-CA 3.25Å; E177-I180 WeakPolarHBondContact O-CB 3.26Å; E177-I180 PolarHBondContact O-N 2.92Å; E177-G181 PolarHBondContact O-N 3.39Å; E177-G181 VanDerWaalsContact O-N 3.13Å; E177-L182 CarbonylContact C-O 3.51Å; E177-L182 HydrophobicContact CB-CD1 3.75Å; E177-L182 HydrophobicContact CB-CG 4.27Å; E177-L182 WeakPolarHBondContact CB-O 3.42Å; E177-L182 HydrophobicContact CG-CD1 3.87Å; E177-L182 PolarHBondContact O-N 2.62Å; E177-L182 VanDerWaalsContact O-N 3.14Å; E177-A184 HydrophobicContact CB-CB 3.97Å; E177-A184 VanDerWaalsContact CD-CB 3.49Å; E177-A184 HydrophobicContact CG-CB 3.58Å
178	V	98.3	Very high	97.9	Very high	58 Å²	58	39.5 Å²	39.5	35%	0.352	23%	0.23	S	C	.	.	H	α-helix	trans	-65.9	-29.7	177.7	-64.7	0	0	0	0	113	K176 I180 G181 L182 A206 A209	K176-V178 VanDerWaalsContact C-N 3.29Å; K176-V178 PolarHBondContact O-N 3.38Å; V178-I180 PolarHBondContact O-N 3.33Å; V178-G181 PolarHBondContact O-N 3.4Å; V178-L182 PolarHBondContact N-O 3.03Å; V178-A206 WeakPolarHBondContact CG1-O 3.39Å; V178-A206 WeakPolarHBondContact CG2-O 3.38Å; V178-A209 HydrophobicContact CG2-CB 3.63Å
179	D	97.5	Very high	97.9	Very high	93 Å²	93	42.7 Å²	42.7	50%	0.497	25%	0.247	S	C	.	.	H	α-helix	trans	-72	-16.4	172.5	-74.5	-16.2	0	0	0	112.4	K176 E177 A209	K176-D179 HydrophobicContact CD-CB 3.97Å; K176-D179 WeakPolarHBondContact CE-OD2 3.43Å; K176-D179 IonicContact NZ-OD2 3.86Å; K176-D179 PolarHBondContact NZ-OD2 3.44Å; K176-D179 WeakPolarHBondContact O-CB 3.35Å; K176-D179 PolarHBondContact O-N 3.19Å; E177-D179 VanDerWaalsContact C-N 3.28Å; E177-D179 PolarHBondContact O-N 3.01Å; D179-A209 HydrophobicContact CB-CB 4.45Å; D179-A209 WeakPolarHBondContact OD2-CB 3.46Å
180	I	92.8	Very high	97.9	Very high	69 Å²	69	43 Å²	43	35%	0.354	25%	0.249	S	C	.	.	H	α-helix	trans	-95.5	-7.4	176.3	-55.5	173.4	0	0	0	110.5	L100 K176 E177 V178 L182	L100-I180 HydrophobicContact CD2-CG2 4.04Å; K176-I180 HydrophobicContact CG-CD1 4.24Å; E177-I180 CarbonylContact O-C 3.57Å; E177-I180 WeakPolarHBondContact O-CA 3.25Å; E177-I180 WeakPolarHBondContact O-CB 3.26Å; E177-I180 PolarHBondContact O-N 2.92Å; V178-I180 PolarHBondContact O-N 3.33Å; I180-L182 HydrophobicContact CG2-CD2 4.18Å
181	G	94.4	Very high	97.9	Very high	71 Å²	71	39.5 Å²	39.5	73%	0.732	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.1	22.3	178	0	0	0	0	0	114.5	E177 V178	E177-G181 PolarHBondContact O-N 3.39Å; E177-G181 VanDerWaalsContact O-N 3.13Å; V178-G181 PolarHBondContact O-N 3.4Å
182	L	94.8	Very high	97.9	Very high	60 Å²	60	39.6 Å²	39.6	31%	0.314	23%	0.229	S	C	.	.	S	Bend	trans	-137.5	154.9	176	67	95.9	0	0	0	112.3	E177 V178 I180	E177-L182 CarbonylContact C-O 3.51Å; E177-L182 HydrophobicContact CB-CD1 3.75Å; E177-L182 HydrophobicContact CB-CG 4.27Å; E177-L182 WeakPolarHBondContact CB-O 3.42Å; E177-L182 HydrophobicContact CG-CD1 3.87Å; E177-L182 PolarHBondContact O-N 2.62Å; E177-L182 VanDerWaalsContact O-N 3.14Å; V178-L182 PolarHBondContact N-O 3.03Å; I180-L182 HydrophobicContact CG2-CD2 4.18Å
183	A	98.4	Very high	97.9	Very high	67 Å²	67	39.3 Å²	39.3	55%	0.554	23%	0.232	S	C	*	.			trans	-82.5	135.1	168.7	0	0	0	0	0	109.2	D185 L189	A183-D185 PolarHBondContact O-N 3.3Å; A183-L189 HydrophobicContact CB-CD1 4.21Å
184	A	98.4	Very high	97.9	Very high	6 Å²	6	44.3 Å²	44.3	5%	0.05	25%	0.253	C	S	.	.			trans	-58.3	124.5	-178.5	0	0	0	0	0	111.8	E177 L189	E177-A184 HydrophobicContact CB-CB 3.97Å; E177-A184 VanDerWaalsContact CD-CB 3.49Å; E177-A184 HydrophobicContact CG-CB 3.58Å; A184-L189 HydrophobicContact CB-CG 4.13Å; A184-L189 WeakPolarHBondContact O-CD1 3.48Å; A184-L189 WeakPolarHBondContact O-CG 3.39Å
185	D	98.1	Very high	97.9	Very high	57 Å²	57	45.2 Å²	45.2	31%	0.305	26%	0.26	S	S	.	.			trans	-123.4	-0.7	-164.9	61.4	-0.6	0	0	0	113.9	I126 Q130 A183	I126-D185 HydrophobicContact CG2-CB 4.29Å; Q130-D185 WeakPolarHBondContact CG-O 3.21Å; Q130-D185 PolarHBondContact NE2-O 3.02Å; A183-D185 PolarHBondContact O-N 3.3Å
186	V	98.6	Very high	97.9	Very high	10 Å²	10	45.6 Å²	45.6	6%	0.061	26%	0.262	C	S	.	.	S	Bend	trans	-105.6	-2.3	-179.4	-64.7	0	0	0	0	114.7	W66 F133 D157	W66-V186 HydrophobicContact CH2-CG2 4.32Å; W66-V186 HydrophobicContact CZ3-CG1 4.43Å; W66-V186 HydrophobicContact CZ3-CG2 4.41Å; F133-V186 HydrophobicContact CD2-CB 4.2Å; F133-V186 HydrophobicContact CD2-CG2 4.13Å; F133-V186 HydrophobicContact CE2-CB 4.18Å; F133-V186 HydrophobicContact CE2-CG2 3.72Å; D157-V186 HydrophobicContact CB-CG2 3.84Å; D157-V186 VanDerWaalsContact CG-CG2 3.49Å; D157-V186 VanDerWaalsContact OD1-CG2 3.29Å; D157-V186 WeakPolarHBondContact OD1-CG2 3.29Å
187	G	98.7	Very high	97.7	Very high	3 Å²	3	46.5 Å²	46.5	3%	0.031	29%	0.288	C	S	.	.	S	Bend	trans	156.6	-25.8	166.6	0	0	0	0	0	117.6	D157 L189 Q190 R191	D157-G187 PolarHBondContact OD1-N 3.32Å; G187-L189 PolarHBondContact O-N 3.47Å; G187-Q190 VanDerWaalsContact C-OE1 3.31Å; G187-Q190 PolarHBondContact O-N 3.15Å; G187-Q190 PolarHBondContact O-OE1 3.47Å; G187-R191 PolarHBondContact O-N 2.86Å
188	T	98.9	Very high	97.7	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.006	30%	0.302	C	S	.	.	H	α-helix	trans	-55.9	-48.9	-171.6	-77	0	0	0	0	111.5	V156 D157 V175 Q190 R191 L192	V156-T188 HydrophobicContact CG1-CG2 4Å; D157-T188 WeakPolarHBondContact CA-OG1 3.49Å; D157-T188 PolarHBondContact N-OG1 3.47Å; D157-T188 WeakPolarHBondContact OD1-CB 3.33Å; D157-T188 PolarHBondContact OD1-N 2.77Å; D157-T188 PolarHBondContact OD1-OG1 3Å; D157-T188 PolarHBondContact OD2-OG1 3.1Å; V175-T188 HydrophobicContact CB-CG2 4.45Å; V175-T188 HydrophobicContact CG1-CG2 3.86Å; V175-T188 HydrophobicContact CG2-CG2 3.75Å; T188-Q190 PolarHBondContact O-N 2.87Å; T188-R191 PolarHBondContact O-N 2.82Å; T188-L192 HydrophobicContact CG2-CB 4.18Å; T188-L192 HydrophobicContact CG2-CD2 4.13Å; T188-L192 WeakPolarHBondContact O-CB 3.46Å; T188-L192 PolarHBondContact O-N 2.9Å
189	L	98.8	Very high	97.7	Very high	67 Å²	67	52.4 Å²	52.4	35%	0.351	31%	0.312	S	S	.	.	H	α-helix	trans	-69.5	-17.7	-178.2	-58.8	-175.3	0	0	0	113.4	A183 A184 G187 P193 A206	A183-L189 HydrophobicContact CB-CD1 4.21Å; A184-L189 HydrophobicContact CB-CG 4.13Å; A184-L189 WeakPolarHBondContact O-CD1 3.48Å; A184-L189 WeakPolarHBondContact O-CG 3.39Å; G187-L189 PolarHBondContact O-N 3.47Å; L189-P193 WeakPolarHBondContact O-CG 2.99Å; L189-A206 HydrophobicContact CD2-CB 4.04Å
190	Q	98.9	Very high	97.7	Very high	98 Å²	98	52.2 Å²	52.2	46%	0.458	32%	0.318	S	S	.	.	H	α-helix	trans	-93.6	-31.2	179.2	-64.5	71.6	34	0	0	112.2	G187 T188 K194	G187-Q190 VanDerWaalsContact C-OE1 3.31Å; G187-Q190 PolarHBondContact O-N 3.15Å; G187-Q190 PolarHBondContact O-OE1 3.47Å; T188-Q190 PolarHBondContact O-N 2.87Å; Q190-K194 WeakPolarHBondContact O-CD 3.11Å
191	R	98.9	Very high	98	Very high	23 Å²	23	49.9 Å²	49.9	9%	0.087	31%	0.306	C	S	.	.	H	α-helix	trans	-108.2	-41.5	-173.2	-61.8	-169.2	-178.3	90.3	4.1	114.3	S134 E137 T160 G187 T188 P193 K194 V195	S134-R191 PolarHBondContact OG-NH2 3.47Å; E137-R191 IonicContact OE2-NE 2.82Å; E137-R191 PolarHBondContact OE2-NE 3.43Å; T160-R191 WeakPolarHBondContact O-CD 3.39Å; G187-R191 PolarHBondContact O-N 2.86Å; T188-R191 PolarHBondContact O-N 2.82Å; R191-P193 VanDerWaalsContact C-CD 3.43Å; R191-P193 VanDerWaalsContact C-N 3.35Å; R191-K194 WeakPolarHBondContact O-CA 3.44Å; R191-K194 WeakPolarHBondContact O-CB 3.42Å; R191-K194 PolarHBondContact O-N 3Å; R191-V195 PolarHBondContact O-N 2.82Å
192	L	98.9	Very high	98.2	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-51.9	-46.7	-179.8	-178.3	60.9	0	0	0	112.8	T160 V175 T188 K194 V195 I196 V202 L222	T160-L192 HydrophobicContact CG2-CB 4.05Å; T160-L192 HydrophobicContact CG2-CD1 3.95Å; V175-L192 HydrophobicContact CG2-CD2 4.01Å; T188-L192 HydrophobicContact CG2-CB 4.18Å; T188-L192 HydrophobicContact CG2-CD2 4.13Å; T188-L192 WeakPolarHBondContact O-CB 3.46Å; T188-L192 PolarHBondContact O-N 2.9Å; L192-K194 PolarHBondContact O-N 3.42Å; L192-K194 VanDerWaalsContact O-N 3.15Å; L192-V195 HydrophobicContact CD1-CG2 4.35Å; L192-V195 WeakPolarHBondContact O-CG2 3.29Å; L192-V195 PolarHBondContact O-N 2.91Å; L192-I196 HydrophobicContact CD1-CD1 4.2Å; L192-I196 HydrophobicContact CD1-CG1 4.2Å; L192-I196 WeakPolarHBondContact O-CG1 3.29Å; L192-I196 PolarHBondContact O-N 3.41Å; L192-V202 HydrophobicContact CD2-CG1 4.16Å; L192-V202 HydrophobicContact CG-CG1 4.26Å; L192-V202 HydrophobicContact CG-CG2 4.18Å; L192-L222 HydrophobicContact CD1-CD1 3.86Å
193	P	98.8	Very high	98.4	Very high	32 Å²	32	47 Å²	47	21%	0.208	27%	0.274	C	S	.	.	H	α-helix	trans	-69.3	-10.1	178.2	-6	18.8	0	0	0	114.9	L189 R191 R199 V202	L189-P193 WeakPolarHBondContact O-CG 2.99Å; R191-P193 VanDerWaalsContact C-CD 3.43Å; R191-P193 VanDerWaalsContact C-N 3.35Å; P193-R199 VanDerWaalsContact CG-NH1 3.34Å; P193-V202 HydrophobicContact CB-CG1 4.27Å; P193-V202 HydrophobicContact CG-CG1 3.95Å
194	K	98.8	Very high	98.5	Very high	110 Å²	110	48 Å²	48	48%	0.478	27%	0.267	S	S	.	.	H	α-helix	trans	-99.2	-11.1	177.7	-60.4	-173.7	178.6	-174.5	0	112.9	Q190 R191 L192 R263 D264	Q190-K194 WeakPolarHBondContact O-CD 3.11Å; R191-K194 WeakPolarHBondContact O-CA 3.44Å; R191-K194 WeakPolarHBondContact O-CB 3.42Å; R191-K194 PolarHBondContact O-N 3Å; L192-K194 PolarHBondContact O-N 3.42Å; L192-K194 VanDerWaalsContact O-N 3.15Å; K194-R263 HydrophobicContact CB-CG 4.48Å; K194-R263 HydrophobicContact CD-CG 4.05Å; K194-D264 IonicContact NZ-OD1 3.19Å; K194-D264 PolarHBondContact NZ-OD1 3.04Å
195	V	98.6	Very high	98.5	Very high	39 Å²	39	48 Å²	48	24%	0.236	27%	0.267	C	S	.	.	H	α-helix	trans	-109.7	-8.8	-178.9	-58	0	0	0	0	113.6	T160 R191 L192 L222	T160-V195 HydrophobicContact CG2-CG2 4.18Å; R191-V195 PolarHBondContact O-N 2.82Å; L192-V195 HydrophobicContact CD1-CG2 4.35Å; L192-V195 WeakPolarHBondContact O-CG2 3.29Å; L192-V195 PolarHBondContact O-N 2.91Å; V195-L222 HydrophobicContact CG2-CD1 4.35Å
196	I	98.1	Very high	98.5	Very high	14 Å²	14	46 Å²	46	7%	0.072	26%	0.258	C	S	.	.			trans	-133.5	151.8	171.2	62.9	163	0	0	0	112.1	L192 V202 L222	L192-I196 HydrophobicContact CD1-CD1 4.2Å; L192-I196 HydrophobicContact CD1-CG1 4.2Å; L192-I196 WeakPolarHBondContact O-CG1 3.29Å; L192-I196 PolarHBondContact O-N 3.41Å; I196-V202 HydrophobicContact CD1-CG2 3.46Å; I196-V202 VanDerWaalsContact CD1-CG2 3.46Å; I196-V202 HydrophobicContact CG1-CG2 3.62Å; I196-L222 VanDerWaalsContact CG2-CA 3.42Å; I196-L222 HydrophobicContact CG2-CB 3.84Å; I196-L222 HydrophobicContact CG2-CD1 4.27Å; I196-L222 VanDerWaalsContact CG2-N 3.28Å
197	G	94	Very high	98.5	Very high	79 Å²	79	52 Å²	52	81%	0.814	29%	0.289	S	S	*	.	S	Bend	trans	-82.9	-28	-171.6	0	0	0	0	0	115.6	R199	G197-R199 PolarHBondContact O-N 3.4Å
198	S	98.4	Very high	98.5	Very high	54 Å²	54	55.5 Å²	55.5	38%	0.378	31%	0.31	S	S	.	.			trans	-85.4	96.5	-174.5	-178.5	0	0	0	0	112	S200 L201 V202	S198-S200 VanDerWaalsContact C-N 3.29Å; S198-S200 PolarHBondContact O-N 3.39Å; S198-L201 PolarHBondContact O-N 2.69Å; S198-L201 WeakPolarHBondContact OG-CB 3.42Å; S198-L201 PolarHBondContact OG-N 2.85Å; S198-V202 WeakPolarHBondContact O-CG2 3.46Å; S198-V202 PolarHBondContact O-N 3.41Å; S198-V202 VanDerWaalsContact O-N 3.12Å
199	R	98.5	Very high	98.5	Very high	144 Å²	144	55.5 Å²	55.5	54%	0.543	31%	0.31	S	S	.	.	H	α-helix	trans	-63.9	-33.7	176.4	-174.7	63.7	-165.6	-149.7	3.9	113	P193 G197 V202 N203	P193-R199 VanDerWaalsContact CG-NH1 3.34Å; G197-R199 PolarHBondContact O-N 3.4Å; R199-V202 PolarHBondContact O-N 3.1Å; R199-N203 PolarHBondContact NE-OD1 2.82Å; R199-N203 VanDerWaalsContact O-CG 3.32Å; R199-N203 PolarHBondContact O-N 2.75Å
200	S	98.9	Very high	98.5	Very high	90 Å²	90	55.4 Å²	55.4	63%	0.629	31%	0.305	S	S	*	.	H	α-helix	trans	-60.8	-46.3	176	-169	0	0	0	0	111.1	S198 N203 E204	S198-S200 VanDerWaalsContact C-N 3.29Å; S198-S200 PolarHBondContact O-N 3.39Å; S200-N203 PolarHBondContact O-N 2.97Å; S200-E204 PolarHBondContact O-N 2.99Å
201	L	98.9	Very high	98.5	Very high	20 Å²	20	54.5 Å²	54.5	11%	0.105	30%	0.299	C	S	.	.	H	α-helix	trans	-62.4	-44.4	176.6	176.4	61	0	0	0	111.5	S198 N203 E204 L205 M212 E216 S220	S198-L201 PolarHBondContact O-N 2.69Å; S198-L201 WeakPolarHBondContact OG-CB 3.42Å; S198-L201 PolarHBondContact OG-N 2.85Å; L201-N203 VanDerWaalsContact C-N 3.3Å; L201-N203 PolarHBondContact O-N 3.04Å; L201-E204 WeakPolarHBondContact O-CB 3.46Å; L201-E204 PolarHBondContact O-N 3.12Å; L201-E204 VanDerWaalsContact O-N 3.16Å; L201-L205 HydrophobicContact CD1-CD1 4.11Å; L201-L205 HydrophobicContact CD1-CD2 4.29Å; L201-L205 HydrophobicContact CD1-CG 3.95Å; L201-L205 HydrophobicContact CG-CD1 3.97Å; L201-L205 HydrophobicContact CG-CG 4.26Å; L201-L205 VanDerWaalsContact O-CG 3.3Å; L201-L205 WeakPolarHBondContact O-CG 3.28Å; L201-L205 PolarHBondContact O-N 3.27Å; L201-M212 HydrophobicContact CD2-SD 4.26Å; L201-E216 WeakPolarHBondContact CD1-OE1 3.29Å; L201-S220 VanDerWaalsContact CD2-CB 3.46Å
202	V	98.9	Very high	98.5	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.024	30%	0.296	C	S	.	.	H	α-helix	trans	-56.8	-45.1	176.9	174.3	0	0	0	0	111.6	L192 P193 I196 S198 R199 L205 A206	L192-V202 HydrophobicContact CD2-CG1 4.16Å; L192-V202 HydrophobicContact CG-CG1 4.26Å; L192-V202 HydrophobicContact CG-CG2 4.18Å; P193-V202 HydrophobicContact CB-CG1 4.27Å; P193-V202 HydrophobicContact CG-CG1 3.95Å; I196-V202 HydrophobicContact CD1-CG2 3.46Å; I196-V202 VanDerWaalsContact CD1-CG2 3.46Å; I196-V202 HydrophobicContact CG1-CG2 3.62Å; S198-V202 WeakPolarHBondContact O-CG2 3.46Å; S198-V202 PolarHBondContact O-N 3.41Å; S198-V202 VanDerWaalsContact O-N 3.12Å; R199-V202 PolarHBondContact O-N 3.1Å; V202-L205 PolarHBondContact O-N 3.29Å; V202-A206 WeakPolarHBondContact O-CB 3.3Å; V202-A206 PolarHBondContact O-N 3.05Å
203	N	98.9	Very high	98.5	Very high	67 Å²	67	59.7 Å²	59.7	36%	0.358	32%	0.32	S	S	.	.	H	α-helix	trans	-62.8	-45	177.4	-68.2	-11	0	0	0	110.9	R199 S200 L201 L205 A206 L207	R199-N203 PolarHBondContact NE-OD1 2.82Å; R199-N203 VanDerWaalsContact O-CG 3.32Å; R199-N203 PolarHBondContact O-N 2.75Å; S200-N203 PolarHBondContact O-N 2.97Å; L201-N203 VanDerWaalsContact C-N 3.3Å; L201-N203 PolarHBondContact O-N 3.04Å; N203-L205 PolarHBondContact O-N 3.38Å; N203-A206 PolarHBondContact O-N 3.37Å; N203-L207 HydrophobicContact CB-CD1 4.35Å; N203-L207 VanDerWaalsContact O-CB 3.22Å; N203-L207 WeakPolarHBondContact O-CB 3.28Å; N203-L207 WeakPolarHBondContact O-CD1 3.31Å; N203-L207 WeakPolarHBondContact O-CG 3.38Å; N203-L207 PolarHBondContact O-N 3.4Å
204	E	98.9	Very high	98.5	Very high	87 Å²	87	58.3 Å²	58.3	41%	0.407	31%	0.311	S	S	.	.	H	α-helix	trans	-59	-48.4	177.6	-173.3	-175.7	132.1	0	0	111.8	S200 L201 A206 L207 T208 R210	S200-E204 PolarHBondContact O-N 2.99Å; L201-E204 WeakPolarHBondContact O-CB 3.46Å; L201-E204 PolarHBondContact O-N 3.12Å; L201-E204 VanDerWaalsContact O-N 3.16Å; E204-A206 PolarHBondContact O-N 3.04Å; E204-L207 PolarHBondContact O-N 2.73Å; E204-T208 HydrophobicContact CG-CG2 4.44Å; E204-T208 WeakPolarHBondContact O-CB 3.4Å; E204-T208 WeakPolarHBondContact O-CG2 3.4Å; E204-T208 PolarHBondContact O-N 3.39Å; E204-T208 PolarHBondContact O-OG1 3.42Å; E204-R210 IonicContact OE1-CZ 2.64Å; E204-R210 IonicContact OE1-NE 3.83Å; E204-R210 PolarHBondContact OE1-NE 3.46Å; E204-R210 IonicContact OE1-NH2 3.41Å; E204-R210 PolarHBondContact OE1-NH2 3.01Å
205	L	98.9	Very high	98.5	Very high	6 Å²	6	58.1 Å²	58.1	3%	0.031	32%	0.315	C	S	.	.	H	α-helix	trans	-60.8	-45.9	178.4	-65.8	174.5	0	0	0	111.9	L201 V202 N203 A209 R210 M212	L201-L205 HydrophobicContact CD1-CD1 4.11Å; L201-L205 HydrophobicContact CD1-CD2 4.29Å; L201-L205 HydrophobicContact CD1-CG 3.95Å; L201-L205 HydrophobicContact CG-CD1 3.97Å; L201-L205 HydrophobicContact CG-CG 4.26Å; L201-L205 VanDerWaalsContact O-CG 3.3Å; L201-L205 WeakPolarHBondContact O-CG 3.28Å; L201-L205 PolarHBondContact O-N 3.27Å; V202-L205 PolarHBondContact O-N 3.29Å; N203-L205 PolarHBondContact O-N 3.38Å; L205-A209 WeakPolarHBondContact O-CA 3.33Å; L205-A209 PolarHBondContact O-N 3.4Å; L205-A209 VanDerWaalsContact O-N 3.1Å; L205-R210 HydrophobicContact CD2-CG 4.01Å; L205-M212 HydrophobicContact CD1-CB 4.47Å; L205-M212 HydrophobicContact CD1-CE 3.81Å; L205-M212 HydrophobicContact CD1-SD 3.82Å; L205-M212 HydrophobicContact CD2-CB 3.85Å
206	A	98.8	Very high	98.5	Very high	14 Å²	14	58.9 Å²	58.9	12%	0.116	32%	0.316	C	S	.	.	H	α-helix	trans	-71.8	-33.6	-177.7	0	0	0	0	0	113.4	V175 V178 L189 V202 N203 E204	V175-A206 HydrophobicContact CG1-CB 4.28Å; V178-A206 WeakPolarHBondContact CG1-O 3.39Å; V178-A206 WeakPolarHBondContact CG2-O 3.38Å; L189-A206 HydrophobicContact CD2-CB 4.04Å; V202-A206 WeakPolarHBondContact O-CB 3.3Å; V202-A206 PolarHBondContact O-N 3.05Å; N203-A206 PolarHBondContact O-N 3.37Å; E204-A206 PolarHBondContact O-N 3.04Å
207	L	98.8	Very high	98.6	Very high	136 Å²	136	58.2 Å²	58.2	71%	0.712	31%	0.313	S	S	*	.	H	α-helix	trans	-87.4	-24.1	-176.3	-65.8	171.9	0	0	0	113.4	N203 E204	N203-L207 HydrophobicContact CB-CD1 4.35Å; N203-L207 VanDerWaalsContact O-CB 3.22Å; N203-L207 WeakPolarHBondContact O-CB 3.28Å; N203-L207 WeakPolarHBondContact O-CD1 3.31Å; N203-L207 WeakPolarHBondContact O-CG 3.38Å; N203-L207 PolarHBondContact O-N 3.4Å; E204-L207 PolarHBondContact O-N 2.73Å
208	T	98.8	Very high	98.8	Very high	77 Å²	77	59.1 Å²	59.1	47%	0.472	29%	0.294	S	S	.	.	H	α-helix	trans	-107.4	-11.7	-177.1	67.3	0	0	0	0	113.7	E204 R210	E204-T208 HydrophobicContact CG-CG2 4.44Å; E204-T208 WeakPolarHBondContact O-CB 3.4Å; E204-T208 WeakPolarHBondContact O-CG2 3.4Å; E204-T208 PolarHBondContact O-N 3.39Å; E204-T208 PolarHBondContact O-OG1 3.42Å; T208-R210 PolarHBondContact O-N 3.04Å; T208-R210 WeakPolarHBondContact OG1-CG 3.34Å; T208-R210 PolarHBondContact OG1-N 3.34Å
209	A	98.8	Very high	98.8	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.008	31%	0.309	C	S	.	.			trans	48.5	25	-169.4	0	0	0	0	0	113.9	Q174 V175 V178 D179 L205	Q174-A209 WeakPolarHBondContact CG-O 3.44Å; Q174-A209 PolarHBondContact NE2-O 3.38Å; V175-A209 VanDerWaalsContact O-CA 3.26Å; V175-A209 WeakPolarHBondContact O-CA 3.2Å; V175-A209 VanDerWaalsContact O-CB 3.25Å; V175-A209 WeakPolarHBondContact O-CB 3.36Å; V178-A209 HydrophobicContact CG2-CB 3.63Å; D179-A209 HydrophobicContact CB-CB 4.45Å; D179-A209 WeakPolarHBondContact OD2-CB 3.46Å; L205-A209 WeakPolarHBondContact O-CA 3.33Å; L205-A209 PolarHBondContact O-N 3.4Å; L205-A209 VanDerWaalsContact O-N 3.1Å
210	R	98.8	Very high	98.8	Very high	66 Å²	66	55.3 Å²	55.3	25%	0.249	29%	0.289	C	S	.	.			trans	-67.9	159.2	178	74.4	165.4	177.5	83.1	-7.1	111.2	E204 L205 T208 E216	E204-R210 IonicContact OE1-CZ 2.64Å; E204-R210 IonicContact OE1-NE 3.83Å; E204-R210 PolarHBondContact OE1-NE 3.46Å; E204-R210 IonicContact OE1-NH2 3.41Å; E204-R210 PolarHBondContact OE1-NH2 3.01Å; L205-R210 HydrophobicContact CD2-CG 4.01Å; T208-R210 PolarHBondContact O-N 3.04Å; T208-R210 WeakPolarHBondContact OG1-CG 3.34Å; T208-R210 PolarHBondContact OG1-N 3.34Å; R210-E216 IonicContact CZ-OE1 3.05Å; R210-E216 IonicContact CZ-OE2 3.9Å; R210-E216 IonicContact NH1-OE1 2.72Å; R210-E216 PolarHBondContact NH1-OE1 2.85Å; R210-E216 IonicContact NH1-OE2 2.69Å; R210-E216 PolarHBondContact NH1-OE2 2.87Å; R210-E216 IonicContact NH2-OE1 2.64Å; R210-E216 PolarHBondContact NH2-OE1 2.94Å; R210-E216 IonicContact NH2-OE2 2.66Å
211	K	98.9	Very high	98.8	Very high	78 Å²	78	52.9 Å²	52.9	34%	0.339	28%	0.279	S	S	.	.			trans	-74.9	138.4	171.9	-60	-177.7	-180	-171.9	0	110.1	W172 Y213	W172-K211 HydrophobicContact CD2-CD 3.8Å; W172-K211 HydrophobicContact CD2-CG 4.28Å; W172-K211 HydrophobicContact CE3-CB 4.15Å; W172-K211 HydrophobicContact CE3-CD 3.59Å; W172-K211 HydrophobicContact CE3-CG 3.62Å; W172-K211 HydrophobicContact CG-CD 4.43Å; W172-K211 HydrophobicContact CH2-CD 4.1Å; W172-K211 VanDerWaalsContact CH2-CE 3.42Å; W172-K211 HydrophobicContact CZ2-CD 4.3Å; W172-K211 HydrophobicContact CZ3-CD 3.76Å; W172-K211 HydrophobicContact CZ3-CG 3.81Å; K211-Y213 HydrophobicContact CB-CD2 4.49Å; K211-Y213 HydrophobicContact CB-CE2 3.93Å
212	M	98.9	Very high	98.8	Very high	3 Å²	3	52 Å²	52	2%	0.015	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	117.1	164.5	177.6	166.7	61.8	0	0	108.4	W172 F173 L201 L205 E216 A217 L222	W172-M212 CarbonylContact C-O 3.51Å; W172-M212 VanDerWaalsContact CA-O 3.23Å; W172-M212 WeakPolarHBondContact CA-O 3.3Å; F173-M212 HydrophobicContact CB-CE 4.38Å; F173-M212 PolarHBondContact N-O 2.87Å; F173-M212 PolarHBondContact O-N 2.92Å; L201-M212 HydrophobicContact CD2-SD 4.26Å; L205-M212 HydrophobicContact CD1-CB 4.47Å; L205-M212 HydrophobicContact CD1-CE 3.81Å; L205-M212 HydrophobicContact CD1-SD 3.82Å; L205-M212 HydrophobicContact CD2-CB 3.85Å; M212-E216 HydrophobicContact CG-CB 3.87Å; M212-E216 HydrophobicContact CG-CG 3.82Å; M212-E216 WeakPolarHBondContact CG-OE2 3.41Å; M212-E216 HydrophobicContact SD-CG 4.03Å; M212-A217 HydrophobicContact CE-CB 4.15Å; M212-A217 HydrophobicContact CG-CB 4.17Å; M212-A217 HydrophobicContact SD-CB 4.33Å; M212-L222 HydrophobicContact CE-CB 4.14Å; M212-L222 HydrophobicContact CE-CD2 3.3Å; M212-L222 HydrophobicContact CE-CG 4.31Å
213	Y	98.9	Very high	98.8	Very high	133 Å²	133	51.9 Å²	51.9	52%	0.522	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	165.9	-178.3	-68	-87.3	0	0	0	111.9	W172 K211 D215 E216 A217	W172-Y213 HydrophobicContact CB-CD1 3.77Å; W172-Y213 HydrophobicContact CB-CE1 4.08Å; W172-Y213 HydrophobicContact CB-CG 4.32Å; W172-Y213 HydrophobicContact CG-CD1 4.41Å; W172-Y213 HydrophobicContact CG-CE1 4.28Å; K211-Y213 HydrophobicContact CB-CD2 4.49Å; K211-Y213 HydrophobicContact CB-CE2 3.93Å; Y213-D215 VanDerWaalsContact C-N 3.33Å; Y213-D215 PolarHBondContact O-N 2.83Å; Y213-E216 PolarHBondContact O-N 2.81Å; Y213-E216 VanDerWaalsContact O-N 3.07Å; Y213-A217 PolarHBondContact O-N 3.23Å
214	A	98.9	Very high	98.8	Very high	2 Å²	2	51.4 Å²	51.4	2%	0.017	28%	0.275	C	S	.	.	H	α-helix	trans	-49.3	-44.8	-171.8	0	0	0	0	0	114.7	T168 Q169 A171 A217 K218 V226	T168-A214 WeakPolarHBondContact O-CB 3.33Å; Q169-A214 WeakPolarHBondContact O-CB 3.44Å; A171-A214 PolarHBondContact O-N 3.24Å; A214-A217 PolarHBondContact O-N 3.21Å; A214-K218 WeakPolarHBondContact O-CB 3.05Å; A214-K218 PolarHBondContact O-N 2.8Å; A214-V226 HydrophobicContact CB-CG1 4.04Å
215	D	98.8	Very high	98.8	Very high	107 Å²	107	53.4 Å²	53.4	57%	0.572	28%	0.279	S	S	*	.	H	α-helix	trans	-64.9	-42.8	-179.2	-63.6	-26.8	0	0	0	112	Q169 Y213 K218 S219	Q169-D215 PolarHBondContact NE2-OD1 2.96Å; Q169-D215 PolarHBondContact NE2-OD2 2.69Å; Y213-D215 VanDerWaalsContact C-N 3.33Å; Y213-D215 PolarHBondContact O-N 2.83Å; D215-K218 PolarHBondContact O-N 3.29Å; D215-S219 WeakPolarHBondContact O-CB 3.38Å; D215-S219 PolarHBondContact O-N 3.39Å; D215-S219 PolarHBondContact O-OG 3.01Å
216	E	98.8	Very high	98.8	Very high	55 Å²	55	55 Å²	55	26%	0.257	29%	0.289	S	S	.	.	H	α-helix	trans	-67.9	-42.5	175.8	-173.8	-176.4	-165.4	0	0	110.8	L201 R210 M212 Y213 K218 S219 S220	L201-E216 WeakPolarHBondContact CD1-OE1 3.29Å; R210-E216 IonicContact CZ-OE1 3.05Å; R210-E216 IonicContact CZ-OE2 3.9Å; R210-E216 IonicContact NH1-OE1 2.72Å; R210-E216 PolarHBondContact NH1-OE1 2.85Å; R210-E216 IonicContact NH1-OE2 2.69Å; R210-E216 PolarHBondContact NH1-OE2 2.87Å; R210-E216 IonicContact NH2-OE1 2.64Å; R210-E216 PolarHBondContact NH2-OE1 2.94Å; R210-E216 IonicContact NH2-OE2 2.66Å; M212-E216 HydrophobicContact CG-CB 3.87Å; M212-E216 HydrophobicContact CG-CG 3.82Å; M212-E216 WeakPolarHBondContact CG-OE2 3.41Å; M212-E216 HydrophobicContact SD-CG 4.03Å; Y213-E216 PolarHBondContact O-N 2.81Å; Y213-E216 VanDerWaalsContact O-N 3.07Å; E216-K218 PolarHBondContact O-N 3.31Å; E216-S219 WeakPolarHBondContact CA-OG 3.44Å; E216-S219 PolarHBondContact O-N 2.8Å; E216-S219 PolarHBondContact O-OG 3.2Å; E216-S220 WeakPolarHBondContact O-CB 3.49Å; E216-S220 PolarHBondContact O-N 3.12Å; E216-S220 PolarHBondContact O-OG 2.89Å
217	A	98.9	Very high	98.8	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-59.3	-36.6	175	0	0	0	0	0	111.8	F173 M212 Y213 A214 S220 G221 L222 V223	F173-A217 HydrophobicContact CD2-CB 3.69Å; F173-A217 HydrophobicContact CE2-CB 3.5Å; F173-A217 VanDerWaalsContact CE2-CB 3.5Å; M212-A217 HydrophobicContact CE-CB 4.15Å; M212-A217 HydrophobicContact CG-CB 4.17Å; M212-A217 HydrophobicContact SD-CB 4.33Å; Y213-A217 PolarHBondContact O-N 3.23Å; A214-A217 PolarHBondContact O-N 3.21Å; A217-S220 PolarHBondContact O-OG 3.18Å; A217-S220 VanDerWaalsContact O-OG 3.11Å; A217-G221 PolarHBondContact O-N 2.94Å; A217-L222 HydrophobicContact CB-CB 4.38Å; A217-L222 HydrophobicContact CB-CD2 4.46Å; A217-L222 PolarHBondContact O-N 2.71Å; A217-V223 HydrophobicContact CB-CG1 4.42Å; A217-V223 HydrophobicContact CB-CG2 4.02Å; A217-V223 PolarHBondContact O-N 2.94Å
218	K	98.8	Very high	98.8	Very high	98 Å²	98	54 Å²	54	43%	0.426	29%	0.286	S	S	.	.	H	α-helix	trans	-71.3	-45.4	175.5	178.3	55.8	-177.8	159	0	111.7	A214 D215 E216 S220 G221 V223 S224 V226	A214-K218 WeakPolarHBondContact O-CB 3.05Å; A214-K218 PolarHBondContact O-N 2.8Å; D215-K218 PolarHBondContact O-N 3.29Å; E216-K218 PolarHBondContact O-N 3.31Å; K218-S220 VanDerWaalsContact C-N 3.33Å; K218-S220 PolarHBondContact O-N 3.46Å; K218-G221 PolarHBondContact O-N 3.1Å; K218-V223 HydrophobicContact CB-CG2 3.95Å; K218-V223 HydrophobicContact CD-CG2 4.42Å; K218-V223 WeakPolarHBondContact CD-O 3.49Å; K218-S224 PolarHBondContact NZ-O 3.38Å; K218-V226 HydrophobicContact CB-CG2 3.66Å; K218-V226 HydrophobicContact CD-CG2 4.29Å; K218-V226 HydrophobicContact CG-CG2 4Å
219	S	98.6	Very high	98.8	Very high	98 Å²	98	53.9 Å²	53.9	69%	0.685	28%	0.283	S	S	*	.	H	α-helix	trans	-65.8	-34.3	-179.7	73.9	0	0	0	0	113	D215 E216 G221	D215-S219 WeakPolarHBondContact O-CB 3.38Å; D215-S219 PolarHBondContact O-N 3.39Å; D215-S219 PolarHBondContact O-OG 3.01Å; E216-S219 WeakPolarHBondContact CA-OG 3.44Å; E216-S219 PolarHBondContact O-N 2.8Å; E216-S219 PolarHBondContact O-OG 3.2Å; S219-G221 VanDerWaalsContact C-N 3.3Å; S219-G221 PolarHBondContact O-N 3.18Å
220	S	98.6	Very high	98.8	Very high	19 Å²	19	56.9 Å²	56.9	13%	0.133	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-14.3	178.3	61.5	0	0	0	0	113.7	L201 E216 A217 K218	L201-S220 VanDerWaalsContact CD2-CB 3.46Å; E216-S220 WeakPolarHBondContact O-CB 3.49Å; E216-S220 PolarHBondContact O-N 3.12Å; E216-S220 PolarHBondContact O-OG 2.89Å; A217-S220 PolarHBondContact O-OG 3.18Å; A217-S220 VanDerWaalsContact O-OG 3.11Å; K218-S220 VanDerWaalsContact C-N 3.33Å; K218-S220 PolarHBondContact O-N 3.46Å
221	G	98.7	Very high	98.8	Very high	39 Å²	39	61.5 Å²	61.5	40%	0.402	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	7.2	-176.4	0	0	0	0	0	114.5	A217 K218 S219 V223	A217-G221 PolarHBondContact O-N 2.94Å; K218-G221 PolarHBondContact O-N 3.1Å; S219-G221 VanDerWaalsContact C-N 3.3Å; S219-G221 PolarHBondContact O-N 3.18Å; G221-V223 VanDerWaalsContact C-N 3.3Å; G221-V223 PolarHBondContact O-N 3.2Å
222	L	98.9	Very high	98.7	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.01	32%	0.317	C	S	.	.	S	Bend	trans	-62.1	-42.4	175.3	-179.4	64.4	0	0	0	110.4	T160 R165 F173 L192 V195 I196 M212 A217	T160-L222 HydrophobicContact CG2-CD1 4.4Å; R165-L222 WeakPolarHBondContact CB-O 3.41Å; R165-L222 WeakPolarHBondContact CD-O 3.32Å; R165-L222 PolarHBondContact NE-O 2.84Å; F173-L222 HydrophobicContact CB-CD2 4.25Å; F173-L222 HydrophobicContact CD1-CD2 4.01Å; F173-L222 HydrophobicContact CD2-CD2 4.06Å; F173-L222 HydrophobicContact CE1-CD2 4.39Å; F173-L222 HydrophobicContact CE2-CD2 4.47Å; F173-L222 HydrophobicContact CG-CD2 3.82Å; L192-L222 HydrophobicContact CD1-CD1 3.86Å; V195-L222 HydrophobicContact CG2-CD1 4.35Å; I196-L222 VanDerWaalsContact CG2-CA 3.42Å; I196-L222 HydrophobicContact CG2-CB 3.84Å; I196-L222 HydrophobicContact CG2-CD1 4.27Å; I196-L222 VanDerWaalsContact CG2-N 3.28Å; M212-L222 HydrophobicContact CE-CB 4.14Å; M212-L222 HydrophobicContact CE-CD2 3.3Å; M212-L222 HydrophobicContact CE-CG 4.31Å; A217-L222 HydrophobicContact CB-CB 4.38Å; A217-L222 HydrophobicContact CB-CD2 4.46Å; A217-L222 PolarHBondContact O-N 2.71Å
223	V	98.9	Very high	98.7	Very high	2 Å²	2	59.2 Å²	59.2	1%	0.012	32%	0.317	C	S	.	.			trans	-112.7	138.9	177.6	-61.5	0	0	0	0	112.3	R165 C167 F173 A217 K218 G221 V226	R165-V223 HydrophobicContact CB-CG1 4.11Å; C167-V223 HydrophobicContact CB-CG1 4.09Å; F173-V223 HydrophobicContact CE2-CG1 4.13Å; F173-V223 HydrophobicContact CZ-CG1 3.69Å; A217-V223 HydrophobicContact CB-CG1 4.42Å; A217-V223 HydrophobicContact CB-CG2 4.02Å; A217-V223 PolarHBondContact O-N 2.94Å; K218-V223 HydrophobicContact CB-CG2 3.95Å; K218-V223 HydrophobicContact CD-CG2 4.42Å; K218-V223 WeakPolarHBondContact CD-O 3.49Å; G221-V223 VanDerWaalsContact C-N 3.3Å; G221-V223 PolarHBondContact O-N 3.2Å; V223-V226 HydrophobicContact CG2-CG2 4.06Å
224	S	98.9	Very high	98.7	Very high	56 Å²	56	53.6 Å²	53.6	39%	0.392	30%	0.296	S	S	.	.	S	Bend	trans	-77.7	-32.3	179.5	-67.4	0	0	0	0	112.7	R165 K218	R165-S224 WeakPolarHBondContact O-CB 3.5Å; R165-S224 PolarHBondContact O-N 3.29Å; K218-S224 PolarHBondContact NZ-O 3.38Å
225	R	98.8	Very high	98.7	Very high	130 Å²	130	54.8 Å²	54.8	49%	0.491	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	148	178.2	-57.4	-177.5	-177.7	175.4	1.1	110.8	L166 C167 F227	L166-R225 HydrophobicContact CD2-CB 3.87Å; L166-R225 HydrophobicContact CD2-CG 4.14Å; C167-R225 PolarHBondContact N-O 2.8Å; R225-F227 HydrophobicContact CB-CD2 4.41Å; R225-F227 HydrophobicContact CB-CE2 3.67Å; R225-F227 HydrophobicContact CB-CZ 4.07Å
226	V	98.9	Very high	98.7	Very high	39 Å²	39	50 Å²	50	24%	0.236	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	138.6	173.1	-173.9	0	0	0	0	108.3	C167 Q169 A214 K218 V223	C167-V226 CarbonylContact O-C 3.49Å; C167-V226 VanDerWaalsContact O-CA 3.25Å; C167-V226 WeakPolarHBondContact O-CA 3.23Å; Q169-V226 HydrophobicContact CB-CG1 4.41Å; A214-V226 HydrophobicContact CB-CG1 4.04Å; K218-V226 HydrophobicContact CB-CG2 3.66Å; K218-V226 HydrophobicContact CD-CG2 4.29Å; K218-V226 HydrophobicContact CG-CG2 4Å; V223-V226 HydrophobicContact CG2-CG2 4.06Å
227	F	98.9	Very high	98.7	Very high	32 Å²	32	47.4 Å²	47.4	14%	0.14	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	154.6	-178.5	-66.3	-91.4	0	0	0	110.6	L166 C167 T168 Q169 R225 D229 A232 M233	L166-F227 HydrophobicContact CB-CE2 4.12Å; L166-F227 HydrophobicContact CD1-CE2 4.23Å; L166-F227 HydrophobicContact CD2-CE2 4.27Å; L166-F227 HydrophobicContact CG-CE2 4.43Å; C167-F227 PolarHBondContact O-N 2.89Å; T168-F227 CarbonylContact C-O 3.31Å; T168-F227 VanDerWaalsContact C-O 3.31Å; T168-F227 VanDerWaalsContact CA-O 3.22Å; T168-F227 WeakPolarHBondContact CA-O 3.26Å; Q169-F227 PolarHBondContact N-O 2.77Å; R225-F227 HydrophobicContact CB-CD2 4.41Å; R225-F227 HydrophobicContact CB-CE2 3.67Å; R225-F227 HydrophobicContact CB-CZ 4.07Å; F227-D229 VanDerWaalsContact C-N 3.32Å; F227-D229 PolarHBondContact O-N 2.87Å; F227-A232 HydrophobicContact CB-CB 4.41Å; F227-A232 HydrophobicContact CD1-CB 4.47Å; F227-A232 WeakPolarHBondContact CD1-O 3.47Å; F227-M233 HydrophobicContact CB-CB 3.84Å; F227-M233 HydrophobicContact CD2-CB 3.92Å; F227-M233 HydrophobicContact CD2-CG 3.84Å; F227-M233 HydrophobicContact CE2-CG 4.37Å; F227-M233 HydrophobicContact CG-CB 3.97Å; F227-M233 HydrophobicContact CG-CG 4.4Å
228	P	98.7	Very high	98.7	Very high	96 Å²	96	48.8 Å²	48.8	62%	0.623	28%	0.276	S	S	*	.	S	Bend	trans	-62.1	-38.5	-178	23.6	-33.7	0	0	0	113	A232	P228-A232 HydrophobicContact CG-CB 3.85Å
229	D	98.6	Very high	98.6	Very high	76 Å²	76	47.5 Å²	47.5	41%	0.406	27%	0.274	S	S	.	.	S	Bend	trans	-151.4	175.2	-175.5	56.5	56.5	0	0	0	111.6	T168 F227 E231 A232 M233	T168-D229 WeakPolarHBondContact CG2-O 3.48Å; F227-D229 VanDerWaalsContact C-N 3.32Å; F227-D229 PolarHBondContact O-N 2.87Å; D229-E231 VanDerWaalsContact C-N 3.35Å; D229-E231 PolarHBondContact O-N 2.93Å; D229-E231 PolarHBondContact OD1-N 3.36Å; D229-E231 VanDerWaalsContact OD1-N 3.16Å; D229-A232 WeakPolarHBondContact OD1-CB 3.48Å; D229-A232 PolarHBondContact OD1-N 2.88Å; D229-M233 WeakPolarHBondContact O-CB 3.3Å; D229-M233 PolarHBondContact O-N 3.39Å
230	Q	98.1	Very high	98.6	Very high	64 Å²	64	44.2 Å²	44.2	30%	0.299	25%	0.248	S	C	.	.	H	α-helix	trans	-65.5	-36	-175.6	-172	178.9	6.2	0	0	112.5	G89 H148 T168 M233 M234	G89-Q230 PolarHBondContact O-NE2 3.21Å; H148-Q230 HydrophobicContact CB-CB 4.26Å; H148-Q230 HydrophobicContact CB-CG 4.22Å; H148-Q230 PolarHBondContact CD2-OE1 3.21Å; H148-Q230 VanDerWaalsContact CD2-OE1 3.28Å; H148-Q230 PolarHBondContact CE1-NE2 3.08Å; H148-Q230 VanDerWaalsContact CE1-NE2 3.25Å; H148-Q230 PolarHBondContact ND1-NE2 3.49Å; H148-Q230 PolarHBondContact NE2-NE2 3.49Å; H148-Q230 PolarHBondContact NE2-OE1 2.83Å; T168-Q230 HydrophobicContact CG2-CB 4.33Å; Q230-M233 HydrophobicContact CG-CE 4.18Å; Q230-M233 PolarHBondContact O-N 2.65Å; Q230-M234 HydrophobicContact CG-CG 4.39Å; Q230-M234 WeakPolarHBondContact O-CB 3.45Å; Q230-M234 VanDerWaalsContact O-CG 3.29Å; Q230-M234 WeakPolarHBondContact O-CG 3.36Å; Q230-M234 PolarHBondContact O-N 2.64Å
231	E	98.3	Very high	98.6	Very high	163 Å²	163	43.3 Å²	43.3	76%	0.762	24%	0.242	S	C	*	.	H	α-helix	trans	-65.4	-50.2	179.7	-174.6	-178.3	163.8	0	0	110.4	D229 M233 M234 A235	D229-E231 VanDerWaalsContact C-N 3.35Å; D229-E231 PolarHBondContact O-N 2.93Å; D229-E231 PolarHBondContact OD1-N 3.36Å; D229-E231 VanDerWaalsContact OD1-N 3.16Å; E231-M233 VanDerWaalsContact C-N 3.3Å; E231-M233 PolarHBondContact O-N 3.5Å; E231-M234 PolarHBondContact O-N 3.35Å; E231-A235 PolarHBondContact O-N 3.01Å
232	A	98.7	Very high	98.5	Very high	32 Å²	32	43.2 Å²	43.2	26%	0.264	24%	0.238	S	C	.	.	H	α-helix	trans	-61	-38.9	176	0	0	0	0	0	112.1	F227 P228 D229 G236	F227-A232 HydrophobicContact CB-CB 4.41Å; F227-A232 HydrophobicContact CD1-CB 4.47Å; F227-A232 WeakPolarHBondContact CD1-O 3.47Å; P228-A232 HydrophobicContact CG-CB 3.85Å; D229-A232 WeakPolarHBondContact OD1-CB 3.48Å; D229-A232 PolarHBondContact OD1-N 2.88Å; A232-G236 PolarHBondContact O-N 3.32Å
233	M	98.8	Very high	98.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.7	-47.2	175	-177.2	-175.9	60.3	0	0	111.8	A146 V147 H148 L166 C167 T168 F227 D229 Q230 E231 G236 A237	A146-M233 VanDerWaalsContact C-CE 3.45Å; A146-M233 VanDerWaalsContact C-SD 3.54Å; A146-M233 HydrophobicContact CB-CE 3.8Å; A146-M233 HydrophobicContact CB-CG 4.19Å; A146-M233 HydrophobicContact CB-SD 3.9Å; V147-M233 PolarHBondContact N-SD 2.75Å; V147-M233 VanDerWaalsContact N-SD 3.36Å; V147-M233 VanDerWaalsContact O-SD 3.41Å; H148-M233 HydrophobicContact CB-CE 4.09Å; L166-M233 HydrophobicContact CB-CG 4.25Å; C167-M233 VanDerWaalsContact CA-SD 3.58Å; T168-M233 HydrophobicContact CG2-CB 4.03Å; T168-M233 HydrophobicContact CG2-CE 3.92Å; T168-M233 HydrophobicContact CG2-SD 3.89Å; F227-M233 HydrophobicContact CB-CB 3.84Å; F227-M233 HydrophobicContact CD2-CB 3.92Å; F227-M233 HydrophobicContact CD2-CG 3.84Å; F227-M233 HydrophobicContact CE2-CG 4.37Å; F227-M233 HydrophobicContact CG-CB 3.97Å; F227-M233 HydrophobicContact CG-CG 4.4Å; D229-M233 WeakPolarHBondContact O-CB 3.3Å; D229-M233 PolarHBondContact O-N 3.39Å; Q230-M233 HydrophobicContact CG-CE 4.18Å; Q230-M233 PolarHBondContact O-N 2.65Å; E231-M233 VanDerWaalsContact C-N 3.3Å; E231-M233 PolarHBondContact O-N 3.5Å; M233-G236 PolarHBondContact O-N 3.18Å; M233-A237 WeakPolarHBondContact O-CB 3.12Å; M233-A237 PolarHBondContact O-N 3.05Å
234	M	98.6	Very high	98.3	Very high	16 Å²	16	48.3 Å²	48.3	8%	0.079	26%	0.262	C	S	.	.	H	α-helix	trans	-66.2	-38.5	-179.2	-72.1	-55.9	-58.5	0	0	111.7	M25 A146 Q230 E231 A237 L238	M25-M234 HydrophobicContact CE-CB 4.38Å; M25-M234 HydrophobicContact CE-CE 4.18Å; M25-M234 HydrophobicContact SD-CE 4.39Å; A146-M234 HydrophobicContact CB-SD 3.91Å; Q230-M234 HydrophobicContact CG-CG 4.39Å; Q230-M234 WeakPolarHBondContact O-CB 3.45Å; Q230-M234 VanDerWaalsContact O-CG 3.29Å; Q230-M234 WeakPolarHBondContact O-CG 3.36Å; Q230-M234 PolarHBondContact O-N 2.64Å; E231-M234 PolarHBondContact O-N 3.35Å; M234-A237 PolarHBondContact O-N 2.74Å; M234-L238 PolarHBondContact O-N 3.01Å
235	A	98.5	Very high	98.3	Very high	27 Å²	27	46 Å²	46	22%	0.223	25%	0.247	C	C	.	.	H	α-helix	trans	-60.4	-47.7	171.7	0	0	0	0	0	111.4	E231 A237 L238 D239	E231-A235 PolarHBondContact O-N 3.01Å; A235-A237 VanDerWaalsContact C-N 3.32Å; A235-A237 PolarHBondContact O-N 2.85Å; A235-L238 PolarHBondContact O-N 3.3Å; A235-D239 PolarHBondContact O-N 3.19Å
236	G	98.6	Very high	98.2	Very high	6 Å²	6	40.5 Å²	40.5	6%	0.062	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-32.7	176.9	0	0	0	0	0	114.1	A232 M233 M240	A232-G236 PolarHBondContact O-N 3.32Å; M233-G236 PolarHBondContact O-N 3.18Å; G236-M240 WeakPolarHBondContact O-CB 3.35Å; G236-M240 PolarHBondContact O-N 2.78Å; G236-M240 VanDerWaalsContact O-N 3.11Å
237	A	98.6	Very high	98.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-68.5	-44	174.8	0	0	0	0	0	111.5	L86 A146 L166 M233 M234 A235 M240 A241	L86-A237 HydrophobicContact CD1-CB 4.24Å; L86-A237 HydrophobicContact CD2-CB 4.12Å; A146-A237 HydrophobicContact CB-CB 4.36Å; L166-A237 HydrophobicContact CD1-CB 3.71Å; M233-A237 WeakPolarHBondContact O-CB 3.12Å; M233-A237 PolarHBondContact O-N 3.05Å; M234-A237 PolarHBondContact O-N 2.74Å; A235-A237 VanDerWaalsContact C-N 3.32Å; A235-A237 PolarHBondContact O-N 2.85Å; A237-M240 PolarHBondContact O-N 3.37Å; A237-A241 WeakPolarHBondContact O-CB 3.29Å; A237-A241 PolarHBondContact O-N 3.06Å
238	L	98.4	Very high	98.1	Very high	29 Å²	29	42.4 Å²	42.4	15%	0.152	23%	0.232	C	C	.	.	H	α-helix	trans	-62.1	-44.6	174.2	-79.6	179.4	0	0	0	112.2	M25 P43 V47 L86 M234 A235 M240 A241 A242	M25-L238 HydrophobicContact CE-CD1 3.14Å; M25-L238 HydrophobicContact CE-CD2 4.1Å; M25-L238 HydrophobicContact CE-CG 3.64Å; P43-L238 HydrophobicContact CB-CD2 3.97Å; P43-L238 HydrophobicContact CG-CD2 3.72Å; V47-L238 HydrophobicContact CG1-CD2 4.46Å; L86-L238 HydrophobicContact CD1-CD2 3.78Å; L86-L238 HydrophobicContact CD1-CG 4.25Å; M234-L238 PolarHBondContact O-N 3.01Å; A235-L238 PolarHBondContact O-N 3.3Å; L238-M240 VanDerWaalsContact C-N 3.29Å; L238-M240 PolarHBondContact O-N 2.99Å; L238-A241 PolarHBondContact O-N 2.96Å; L238-A242 WeakPolarHBondContact O-CB 3.49Å; L238-A242 PolarHBondContact O-N 3.35Å
239	D	97.9	Very high	98	Very high	71 Å²	71	38 Å²	38	38%	0.38	20%	0.204	S	C	.	.	H	α-helix	trans	-58.6	-45.1	177.1	-78.2	-16.9	0	0	0	110.7	A235 A242 E243	A235-D239 PolarHBondContact O-N 3.19Å; D239-A242 PolarHBondContact O-N 3.05Å; D239-E243 WeakPolarHBondContact O-CG 3.42Å; D239-E243 PolarHBondContact O-N 3.05Å
240	M	98.3	Very high	98	Very high	29 Å²	29	35.6 Å²	35.6	14%	0.143	19%	0.192	C	C	.	.	H	α-helix	trans	-62.2	-44.9	175.6	-177.5	177.3	-64.2	0	0	112.1	V144 I164 L166 G236 A237 L238 A242 E243 I244	V144-M240 HydrophobicContact CG1-SD 4.37Å; I164-M240 HydrophobicContact CD1-SD 3.91Å; I164-M240 HydrophobicContact CG2-CE 4.45Å; I164-M240 HydrophobicContact CG2-SD 3.73Å; L166-M240 HydrophobicContact CD2-CE 3.88Å; L166-M240 HydrophobicContact CD2-SD 4.49Å; G236-M240 WeakPolarHBondContact O-CB 3.35Å; G236-M240 PolarHBondContact O-N 2.78Å; G236-M240 VanDerWaalsContact O-N 3.11Å; A237-M240 PolarHBondContact O-N 3.37Å; L238-M240 VanDerWaalsContact C-N 3.29Å; L238-M240 PolarHBondContact O-N 2.99Å; M240-A242 VanDerWaalsContact C-N 3.34Å; M240-A242 PolarHBondContact O-N 3.37Å; M240-E243 PolarHBondContact O-N 3.2Å; M240-I244 HydrophobicContact CG-CD1 4.11Å; M240-I244 WeakPolarHBondContact O-CG1 3.33Å; M240-I244 PolarHBondContact O-N 2.88Å
241	A	98.1	Very high	98.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-41	178	0	0	0	0	0	111.7	V47 V84 L86 A237 L238 E243 I244 A245	V47-A241 HydrophobicContact CG1-CB 3.89Å; V47-A241 HydrophobicContact CG2-CB 3.74Å; V84-A241 HydrophobicContact CB-CB 4.16Å; V84-A241 HydrophobicContact CG1-CB 3.81Å; L86-A241 HydrophobicContact CD2-CB 3.97Å; L86-A241 HydrophobicContact CG-CB 4.35Å; A237-A241 WeakPolarHBondContact O-CB 3.29Å; A237-A241 PolarHBondContact O-N 3.06Å; L238-A241 PolarHBondContact O-N 2.96Å; A241-E243 VanDerWaalsContact C-N 3.33Å; A241-E243 PolarHBondContact O-N 3.28Å; A241-I244 PolarHBondContact O-N 2.97Å; A241-A245 VanDerWaalsContact O-CB 3.22Å; A241-A245 WeakPolarHBondContact O-CB 3.37Å; A241-A245 PolarHBondContact O-N 3.26Å
242	A	96.3	Very high	98.1	Very high	38 Å²	38	28.6 Å²	28.6	31%	0.314	17%	0.17	S	C	.	.	H	α-helix	trans	-63.2	-38.6	175.3	0	0	0	0	0	112	L238 D239 M240 A246	L238-A242 WeakPolarHBondContact O-CB 3.49Å; L238-A242 PolarHBondContact O-N 3.35Å; D239-A242 PolarHBondContact O-N 3.05Å; M240-A242 VanDerWaalsContact C-N 3.34Å; M240-A242 PolarHBondContact O-N 3.37Å; A242-A246 WeakPolarHBondContact O-CB 3.3Å; A242-A246 PolarHBondContact O-N 3.09Å
243	E	97	Very high	98.1	Very high	78 Å²	78	27.9 Å²	27.9	36%	0.364	16%	0.161	S	C	.	.	H	α-helix	trans	-65.8	-39.9	175.4	-68.8	-51.5	160.3	0	0	113.1	D239 M240 A241 R247 K301	D239-E243 WeakPolarHBondContact O-CG 3.42Å; D239-E243 PolarHBondContact O-N 3.05Å; M240-E243 PolarHBondContact O-N 3.2Å; A241-E243 VanDerWaalsContact C-N 3.33Å; A241-E243 PolarHBondContact O-N 3.28Å; E243-R247 PolarHBondContact O-NH1 3.07Å; E243-R247 VanDerWaalsContact O-NH1 3.13Å; E243-R247 IonicContact OE2-NH1 3.5Å; E243-K301 WeakPolarHBondContact OE1-CE 3.14Å; E243-K301 IonicContact OE1-NZ 2.75Å; E243-K301 PolarHBondContact OE1-NZ 3.39Å; E243-K301 WeakPolarHBondContact OE2-CE 3.45Å; E243-K301 IonicContact OE2-NZ 2.65Å
244	I	98.3	Very high	98.1	Very high	32 Å²	32	28.2 Å²	28.2	16%	0.164	16%	0.164	C	C	.	.	H	α-helix	trans	-68.8	-46.2	176.2	-64	166.7	0	0	0	110	V84 P142 I164 M240 A241 A246 R247 V252	V84-I244 HydrophobicContact CG2-CB 3.69Å; V84-I244 HydrophobicContact CG2-CG2 3.45Å; V84-I244 VanDerWaalsContact CG2-CG2 3.45Å; P142-I244 HydrophobicContact CB-CG2 4.47Å; P142-I244 HydrophobicContact CG-CG2 4.02Å; I164-I244 HydrophobicContact CD1-CD1 4.05Å; M240-I244 HydrophobicContact CG-CD1 4.11Å; M240-I244 WeakPolarHBondContact O-CG1 3.33Å; M240-I244 PolarHBondContact O-N 2.88Å; A241-I244 PolarHBondContact O-N 2.97Å; I244-A246 PolarHBondContact O-N 3.01Å; I244-R247 WeakPolarHBondContact O-CB 3.4Å; I244-R247 PolarHBondContact O-N 2.93Å; I244-V252 HydrophobicContact CG2-CG1 3.79Å; I244-V252 HydrophobicContact CG2-CG2 4.4Å
245	A	97.2	Very high	98.1	Very high	9 Å²	9	31.2 Å²	31.2	7%	0.074	18%	0.184	C	C	.	.	H	α-helix	trans	-63	-25.9	-178.9	0	0	0	0	0	113.1	R83 V84 A241 R247	R83-A245 HydrophobicContact CB-CB 4.14Å; R83-A245 VanDerWaalsContact CD-O 3.23Å; R83-A245 WeakPolarHBondContact CD-O 3.42Å; R83-A245 PolarHBondContact NH1-O 3.32Å; V84-A245 HydrophobicContact CG2-CB 4.13Å; A241-A245 VanDerWaalsContact O-CB 3.22Å; A241-A245 WeakPolarHBondContact O-CB 3.37Å; A241-A245 PolarHBondContact O-N 3.26Å; A245-R247 PolarHBondContact O-N 3.01Å
246	A	96.4	Very high	98.1	Very high	14 Å²	14	30.4 Å²	30.4	12%	0.116	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-3.2	174	0	0	0	0	0	114.3	A242 I244 K301	A242-A246 WeakPolarHBondContact O-CB 3.3Å; A242-A246 PolarHBondContact O-N 3.09Å; I244-A246 PolarHBondContact O-N 3.01Å; A246-K301 HydrophobicContact CB-CB 4.49Å; A246-K301 HydrophobicContact CB-CG 3.84Å
247	R	97.4	Very high	98.1	Very high	99 Å²	99	32.2 Å²	32.2	37%	0.374	18%	0.183	S	C	.	.	S	Bend	trans	-94.2	164.9	175	-55.7	-59	-176.7	-93.1	3	110.7	E243 I244 A245 V252	E243-R247 PolarHBondContact O-NH1 3.07Å; E243-R247 VanDerWaalsContact O-NH1 3.13Å; E243-R247 IonicContact OE2-NH1 3.5Å; I244-R247 WeakPolarHBondContact O-CB 3.4Å; I244-R247 PolarHBondContact O-N 2.93Å; A245-R247 PolarHBondContact O-N 3.01Å; R247-V252 HydrophobicContact CB-CG2 3.56Å; R247-V252 HydrophobicContact CG-CG2 4.39Å
248	S	98.3	Very high	98.2	Very high	11 Å²	11	32.6 Å²	32.6	8%	0.077	19%	0.185	C	C	.	.			trans	-55.3	124.4	172.9	163.4	0	0	0	0	110	V250 A251 V252 D286	S248-V250 PolarHBondContact O-N 2.75Å; S248-V250 PolarHBondContact OG-N 3.45Å; S248-A251 PolarHBondContact O-N 2.68Å; S248-A251 PolarHBondContact OG-N 2.69Å; S248-V252 WeakPolarHBondContact O-CG2 3.22Å; S248-V252 PolarHBondContact O-N 2.91Å; S248-D286 VanDerWaalsContact CB-OD2 3.3Å; S248-D286 WeakPolarHBondContact CB-OD2 3.32Å; S248-D286 WeakPolarHBondContact OG-CB 3.34Å; S248-D286 PolarHBondContact OG-OD2 3Å
249	P	98.4	Very high	98.2	Very high	5 Å²	5	36.9 Å²	36.9	3%	0.032	21%	0.207	C	C	.	.	H	α-helix	trans	-64.9	-31.9	177.5	26.2	-32.9	0	0	0	111.4	R83 Q253 S306 L308	R83-P249 HydrophobicContact CG-CB 4.42Å; P249-Q253 WeakPolarHBondContact O-CB 3.5Å; P249-Q253 VanDerWaalsContact O-CG 3.24Å; P249-Q253 WeakPolarHBondContact O-CG 3.34Å; P249-Q253 PolarHBondContact O-N 3Å; P249-S306 WeakPolarHBondContact CG-O 3.37Å; P249-L308 HydrophobicContact CB-CB 3.97Å; P249-L308 HydrophobicContact CB-CD2 4.23Å; P249-L308 HydrophobicContact CG-CB 3.96Å
250	V	98.6	Very high	98.2	Very high	25 Å²	25	35.1 Å²	35.1	15%	0.152	20%	0.198	C	C	.	.	H	α-helix	trans	-58.9	-49	172.6	178.2	0	0	0	0	110.3	S248 G254 M281 T284 L308	S248-V250 PolarHBondContact O-N 2.75Å; S248-V250 PolarHBondContact OG-N 3.45Å; V250-G254 PolarHBondContact O-N 3.44Å; V250-M281 HydrophobicContact CG1-CB 3.95Å; V250-M281 HydrophobicContact CG1-CG 4.36Å; V250-M281 HydrophobicContact CG1-SD 4.07Å; V250-T284 HydrophobicContact CG1-CG2 4.35Å; V250-L308 HydrophobicContact CB-CD2 4.36Å; V250-L308 HydrophobicContact CG2-CD1 4.42Å; V250-L308 HydrophobicContact CG2-CD2 3.9Å
251	A	98.6	Very high	98.3	Very high	54 Å²	54	36.6 Å²	36.6	45%	0.446	20%	0.202	S	C	.	.	H	α-helix	trans	-67.4	-45.2	-178.7	0	0	0	0	0	112.5	S248 T255	S248-A251 PolarHBondContact O-N 2.68Å; S248-A251 PolarHBondContact OG-N 2.69Å; A251-T255 VanDerWaalsContact O-CB 3.3Å; A251-T255 WeakPolarHBondContact O-CB 3.43Å; A251-T255 PolarHBondContact O-N 3.26Å; A251-T255 PolarHBondContact O-OG1 3Å
252	V	98.8	Very high	98.3	Very high	25 Å²	25	39.6 Å²	39.6	15%	0.152	22%	0.223	C	C	.	.	H	α-helix	trans	-67.5	-49.9	-177.7	171.2	0	0	0	0	111.5	P142 I244 R247 S248 T255 K256	P142-V252 HydrophobicContact CG-CG1 3.36Å; I244-V252 HydrophobicContact CG2-CG1 3.79Å; I244-V252 HydrophobicContact CG2-CG2 4.4Å; R247-V252 HydrophobicContact CB-CG2 3.56Å; R247-V252 HydrophobicContact CG-CG2 4.39Å; S248-V252 WeakPolarHBondContact O-CG2 3.22Å; S248-V252 PolarHBondContact O-N 2.91Å; V252-T255 WeakPolarHBondContact O-CB 3.46Å; V252-T255 PolarHBondContact O-N 3.47Å; V252-K256 PolarHBondContact O-N 3.28Å
253	Q	98.9	Very high	98.4	Very high	18 Å²	18	41.7 Å²	41.7	8%	0.084	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-43.5	179.8	-67.3	-174.5	32.2	0	0	111	P140 P249 T255 K256 I257	P140-Q253 HydrophobicContact CB-CB 4.08Å; P140-Q253 HydrophobicContact CB-CG 4.2Å; P140-Q253 WeakPolarHBondContact O-CA 3.45Å; P140-Q253 WeakPolarHBondContact O-CG 3.4Å; P249-Q253 WeakPolarHBondContact O-CB 3.5Å; P249-Q253 VanDerWaalsContact O-CG 3.24Å; P249-Q253 WeakPolarHBondContact O-CG 3.34Å; P249-Q253 PolarHBondContact O-N 3Å; Q253-T255 VanDerWaalsContact C-N 3.29Å; Q253-T255 PolarHBondContact O-N 3.45Å; Q253-K256 PolarHBondContact O-N 3.13Å; Q253-I257 WeakPolarHBondContact O-CG1 3.23Å; Q253-I257 PolarHBondContact O-N 2.81Å
254	G	98.8	Very high	98.5	Very high	6 Å²	6	41.4 Å²	41.4	6%	0.062	22%	0.224	C	C	.	.	H	α-helix	trans	-59.7	-37.8	173.4	0	0	0	0	0	112.9	V250 N258	V250-G254 PolarHBondContact O-N 3.44Å; G254-N258 WeakPolarHBondContact O-CB 3.46Å; G254-N258 PolarHBondContact O-N 2.96Å; G254-N258 PolarHBondContact O-ND2 3.04Å
255	T	98.9	Very high	98.5	Very high	80 Å²	80	43.4 Å²	43.4	49%	0.491	23%	0.232	S	C	.	.	H	α-helix	trans	-62.9	-48.4	175.3	-62.6	0	0	0	0	111.2	A251 V252 Q253 I257 N258 L259	A251-T255 VanDerWaalsContact O-CB 3.3Å; A251-T255 WeakPolarHBondContact O-CB 3.43Å; A251-T255 PolarHBondContact O-N 3.26Å; A251-T255 PolarHBondContact O-OG1 3Å; V252-T255 WeakPolarHBondContact O-CB 3.46Å; V252-T255 PolarHBondContact O-N 3.47Å; Q253-T255 VanDerWaalsContact C-N 3.29Å; Q253-T255 PolarHBondContact O-N 3.45Å; T255-I257 PolarHBondContact O-N 3.13Å; T255-N258 PolarHBondContact O-N 3.4Å; T255-L259 HydrophobicContact CG2-CD1 3.82Å; T255-L259 HydrophobicContact CG2-CG 4.2Å; T255-L259 WeakPolarHBondContact O-CB 3.29Å; T255-L259 VanDerWaalsContact O-CG 3.3Å; T255-L259 WeakPolarHBondContact O-CG 3.39Å; T255-L259 PolarHBondContact O-N 2.83Å
256	K	98.9	Very high	98.6	Very high	9 Å²	9	45.7 Å²	45.7	4%	0.039	25%	0.248	C	C	.	.	H	α-helix	trans	-58.2	-49	177.9	174.9	170.3	174.7	171.9	0	111.5	L136 C139 K141 D163 V252 Q253 N258 L259 I260	L136-K256 PolarHBondContact O-NZ 3.49Å; C139-K256 WeakPolarHBondContact O-CE 3.4Å; C139-K256 PolarHBondContact O-NZ 2.99Å; K141-K256 PolarHBondContact O-NZ 2.61Å; D163-K256 WeakPolarHBondContact OD1-CD 3.41Å; D163-K256 WeakPolarHBondContact OD1-CE 3.35Å; D163-K256 IonicContact OD1-NZ 2.82Å; D163-K256 VanDerWaalsContact OD2-CE 3.31Å; D163-K256 WeakPolarHBondContact OD2-CE 3.43Å; D163-K256 IonicContact OD2-NZ 2.97Å; D163-K256 PolarHBondContact OD2-NZ 3.16Å; V252-K256 PolarHBondContact O-N 3.28Å; Q253-K256 PolarHBondContact O-N 3.13Å; K256-N258 VanDerWaalsContact C-N 3.33Å; K256-N258 PolarHBondContact O-N 3.2Å; K256-L259 PolarHBondContact O-N 3.14Å; K256-I260 HydrophobicContact CG-CD1 3.8Å; K256-I260 WeakPolarHBondContact O-CG1 3.31Å; K256-I260 PolarHBondContact O-N 3.2Å
257	I	98.9	Very high	98.7	Very high	45 Å²	45	50.7 Å²	50.7	23%	0.231	28%	0.276	C	S	.	.	H	α-helix	trans	-56.4	-47.6	179.5	-68.6	167.3	0	0	0	110.9	P140 Q253 T255 I260 Y261 Y273 W277	P140-I257 HydrophobicContact CB-CD1 4.12Å; P140-I257 HydrophobicContact CB-CG1 4.45Å; Q253-I257 WeakPolarHBondContact O-CG1 3.23Å; Q253-I257 PolarHBondContact O-N 2.81Å; T255-I257 PolarHBondContact O-N 3.13Å; I257-I260 PolarHBondContact O-N 3.13Å; I257-Y261 PolarHBondContact O-N 3.36Å; I257-Y273 HydrophobicContact CG2-CE1 4.41Å; I257-W277 HydrophobicContact CD1-CH2 3.34Å; I257-W277 HydrophobicContact CD1-CZ2 3.69Å; I257-W277 HydrophobicContact CD1-CZ3 4.19Å; I257-W277 HydrophobicContact CG1-CH2 4.5Å; I257-W277 HydrophobicContact CG2-CE3 4.35Å; I257-W277 HydrophobicContact CG2-CH2 4.15Å; I257-W277 HydrophobicContact CG2-CZ3 4.01Å
258	N	98.9	Very high	98.7	Very high	8 Å²	8	49.4 Å²	49.4	4%	0.043	29%	0.287	C	S	.	.	H	α-helix	trans	-73.8	-30.4	-178.2	-77	-83.9	0	0	0	113.3	G254 T255 K256 S262 Y273 M274	G254-N258 WeakPolarHBondContact O-CB 3.46Å; G254-N258 PolarHBondContact O-N 2.96Å; G254-N258 PolarHBondContact O-ND2 3.04Å; T255-N258 PolarHBondContact O-N 3.4Å; K256-N258 VanDerWaalsContact C-N 3.33Å; K256-N258 PolarHBondContact O-N 3.2Å; N258-S262 VanDerWaalsContact O-CB 3.26Å; N258-S262 WeakPolarHBondContact O-CB 3.38Å; N258-S262 PolarHBondContact O-N 2.77Å; N258-S262 PolarHBondContact O-OG 3.28Å; N258-Y273 WeakPolarHBondContact OD1-CD1 3.4Å; N258-M274 HydrophobicContact CB-SD 3.72Å; N258-M274 PolarHBondContact OD1-SD 3.11Å
259	L	98.9	Very high	98.8	Very high	118 Å²	118	53.4 Å²	53.4	62%	0.618	31%	0.305	S	S	*	.	H	α-helix	trans	-64.2	-43.4	171.9	-77.2	173.2	0	0	0	111.5	T255 K256 S262 R263	T255-L259 HydrophobicContact CG2-CD1 3.82Å; T255-L259 HydrophobicContact CG2-CG 4.2Å; T255-L259 WeakPolarHBondContact O-CB 3.29Å; T255-L259 VanDerWaalsContact O-CG 3.3Å; T255-L259 WeakPolarHBondContact O-CG 3.39Å; T255-L259 PolarHBondContact O-N 2.83Å; K256-L259 PolarHBondContact O-N 3.14Å; L259-S262 PolarHBondContact O-N 2.82Å; L259-R263 PolarHBondContact O-N 3.37Å; L259-R263 VanDerWaalsContact O-N 3.08Å
260	I	98.8	Very high	98.8	Very high	35 Å²	35	53.5 Å²	53.5	18%	0.179	31%	0.306	C	S	.	.	H	α-helix	trans	-64.8	-46.6	176.4	-67.4	161.9	0	0	0	110.2	E137 K256 I257 S262 R263	E137-I260 HydrophobicContact CG-CD1 3.67Å; E137-I260 HydrophobicContact CG-CG1 4.09Å; E137-I260 HydrophobicContact CG-CG2 4.16Å; E137-I260 WeakPolarHBondContact O-CD1 3.25Å; K256-I260 HydrophobicContact CG-CD1 3.8Å; K256-I260 WeakPolarHBondContact O-CG1 3.31Å; K256-I260 PolarHBondContact O-N 3.2Å; I257-I260 PolarHBondContact O-N 3.13Å; I260-S262 VanDerWaalsContact C-N 3.35Å; I260-S262 PolarHBondContact O-N 3.34Å; I260-R263 WeakPolarHBondContact O-CB 3.35Å; I260-R263 PolarHBondContact O-N 2.7Å
261	Y	98.8	Very high	98.8	Very high	59 Å²	59	57.8 Å²	57.8	23%	0.231	33%	0.328	C	S	.	.	H	α-helix	trans	-58.3	-47.9	177.1	-170.4	-88.1	0	0	0	111.4	I257 R263 D264 H265 Y273	I257-Y261 PolarHBondContact O-N 3.36Å; Y261-R263 VanDerWaalsContact C-N 3.26Å; Y261-R263 PolarHBondContact O-N 3.24Å; Y261-D264 PolarHBondContact O-N 2.69Å; Y261-D264 VanDerWaalsContact O-N 3.11Å; Y261-H265 HydrophobicContact CD1-CB 4.32Å; Y261-H265 AromaticContact CD1-ND1 3.75Å; Y261-H265 AromaticContact CD2-CE1 3.62Å; Y261-H265 AromaticContact CD2-ND1 3.79Å; Y261-H265 HydrophobicContact CE1-CB 3.94Å; Y261-H265 AromaticContact CE1-CG 3.61Å; Y261-H265 AromaticContact CE1-ND1 3.68Å; Y261-H265 AromaticContact CE2-CE1 3.34Å; Y261-H265 WeakPolarHBondContact CE2-CE1 3.41Å; Y261-H265 AromaticContact CE2-ND1 3.71Å; Y261-H265 AromaticContact CE2-NE2 3.61Å; Y261-H265 AromaticContact CG-ND1 3.8Å; Y261-H265 AromaticContact CZ-CD2 3.64Å; Y261-H265 AromaticContact CZ-CE1 3.63Å; Y261-H265 AromaticContact CZ-CG 3.68Å; Y261-H265 AromaticContact CZ-ND1 3.66Å; Y261-H265 AromaticContact CZ-NE2 3.61Å; Y261-H265 PolarHBondContact O-N 2.94Å; Y261-H265 PolarHBondContact O-ND1 3.22Å; Y261-Y273 AromaticContact CD1-CD1 3.84Å; Y261-Y273 HydrophobicContact CD1-CD1 3.84Å; Y261-Y273 HydrophobicContact CD1-CD2 4.39Å; Y261-Y273 AromaticContact CD1-CG 3.74Å; Y261-Y273 HydrophobicContact CD1-CG 3.74Å; Y261-Y273 HydrophobicContact CD2-CD1 4.06Å; Y261-Y273 AromaticContact CD2-CD2 3.89Å; Y261-Y273 HydrophobicContact CD2-CD2 3.89Å; Y261-Y273 HydrophobicContact CD2-CE1 4.09Å; Y261-Y273 AromaticContact CD2-CE2 3.91Å; Y261-Y273 HydrophobicContact CD2-CE2 3.91Å; Y261-Y273 AromaticContact CD2-CG 3.97Å; Y261-Y273 HydrophobicContact CD2-CG 3.97Å; Y261-Y273 HydrophobicContact CE1-CD1 4.22Å; Y261-Y273 HydrophobicContact CE1-CD2 4.06Å; Y261-Y273 AromaticContact CE1-CG 3.63Å; Y261-Y273 HydrophobicContact CE1-CG 3.63Å; Y261-Y273 HydrophobicContact CE2-CD1 4.43Å; Y261-Y273 AromaticContact CE2-CD2 3.52Å; Y261-Y273 HydrophobicContact CE2-CD2 3.52Å; Y261-Y273 AromaticContact CE2-CE2 3.8Å; Y261-Y273 HydrophobicContact CE2-CE2 3.8Å; Y261-Y273 AromaticContact CE2-CG 3.87Å; Y261-Y273 HydrophobicContact CE2-CG 3.87Å; Y261-Y273 AromaticContact CG-CD1 3.75Å; Y261-Y273 HydrophobicContact CG-CD1 3.75Å; Y261-Y273 HydrophobicContact CG-CD2 4.32Å; Y261-Y273 HydrophobicContact CG-CE1 4.04Å; Y261-Y273 AromaticContact CG-CG 3.91Å; Y261-Y273 HydrophobicContact CG-CG 3.91Å; Y261-Y273 AromaticContact CZ-CD2 3.61Å; Y261-Y273 AromaticContact CZ-CG 3.7Å
262	S	98.8	Very high	98.8	Very high	63 Å²	63	61.1 Å²	61.1	44%	0.441	34%	0.338	S	S	.	.	H	α-helix	trans	-64.1	-27.6	-179.3	-58.8	0	0	0	0	113.6	N258 L259 I260 D264	N258-S262 VanDerWaalsContact O-CB 3.26Å; N258-S262 WeakPolarHBondContact O-CB 3.38Å; N258-S262 PolarHBondContact O-N 2.77Å; N258-S262 PolarHBondContact O-OG 3.28Å; L259-S262 PolarHBondContact O-N 2.82Å; I260-S262 VanDerWaalsContact C-N 3.35Å; I260-S262 PolarHBondContact O-N 3.34Å; S262-D264 PolarHBondContact O-N 3.03Å
263	R	98.6	Very high	98.8	Very high	83 Å²	83	63.5 Å²	63.5	31%	0.313	35%	0.345	S	S	.	.	H	α-helix	trans	-63.4	-32	175.5	-176	-167.1	69.8	-167	-7.9	112.2	E137 K194 L259 I260 Y261	E137-R263 VanDerWaalsContact CD-NH1 3.34Å; E137-R263 IonicContact OE1-CZ 3.42Å; E137-R263 IonicContact OE1-NH1 2.76Å; E137-R263 IonicContact OE1-NH2 2.67Å; E137-R263 PolarHBondContact OE1-NH2 3.47Å; E137-R263 IonicContact OE2-CZ 2.71Å; E137-R263 IonicContact OE2-NH1 3.29Å; E137-R263 PolarHBondContact OE2-NH1 3.29Å; E137-R263 IonicContact OE2-NH2 3.66Å; E137-R263 PolarHBondContact OE2-NH2 2.72Å; K194-R263 HydrophobicContact CB-CG 4.48Å; K194-R263 HydrophobicContact CD-CG 4.05Å; L259-R263 PolarHBondContact O-N 3.37Å; L259-R263 VanDerWaalsContact O-N 3.08Å; I260-R263 WeakPolarHBondContact O-CB 3.35Å; I260-R263 PolarHBondContact O-N 2.7Å; Y261-R263 VanDerWaalsContact C-N 3.26Å; Y261-R263 PolarHBondContact O-N 3.24Å
264	D	98.4	Very high	98.8	Very high	72 Å²	72	65.4 Å²	65.4	39%	0.385	35%	0.354	S	S	.	.	H	α-helix	trans	-111.5	2.5	-167.6	-63.5	-28.3	0	0	0	113.7	K194 Y261 S262	K194-D264 IonicContact NZ-OD1 3.19Å; K194-D264 PolarHBondContact NZ-OD1 3.04Å; Y261-D264 PolarHBondContact O-N 2.69Å; Y261-D264 VanDerWaalsContact O-N 3.11Å; S262-D264 PolarHBondContact O-N 3.03Å
265	H	98.8	Very high	98.8	Very high	74 Å²	74	68 Å²	68	34%	0.343	38%	0.376	S	S	.	.	S	Bend	trans	-131.3	166	180	-61.5	80.8	0	0	0	111	Y261 E269	Y261-H265 HydrophobicContact CD1-CB 4.32Å; Y261-H265 AromaticContact CD1-ND1 3.75Å; Y261-H265 AromaticContact CD2-CE1 3.62Å; Y261-H265 AromaticContact CD2-ND1 3.79Å; Y261-H265 HydrophobicContact CE1-CB 3.94Å; Y261-H265 AromaticContact CE1-CG 3.61Å; Y261-H265 AromaticContact CE1-ND1 3.68Å; Y261-H265 AromaticContact CE2-CE1 3.34Å; Y261-H265 WeakPolarHBondContact CE2-CE1 3.41Å; Y261-H265 AromaticContact CE2-ND1 3.71Å; Y261-H265 AromaticContact CE2-NE2 3.61Å; Y261-H265 AromaticContact CG-ND1 3.8Å; Y261-H265 AromaticContact CZ-CD2 3.64Å; Y261-H265 AromaticContact CZ-CE1 3.63Å; Y261-H265 AromaticContact CZ-CG 3.68Å; Y261-H265 AromaticContact CZ-ND1 3.66Å; Y261-H265 AromaticContact CZ-NE2 3.61Å; Y261-H265 PolarHBondContact O-N 2.94Å; Y261-H265 PolarHBondContact O-ND1 3.22Å; H265-E269 HydrophobicContact CB-CB 3.95Å
266	S	98.8	Very high	98.8	Very high	56 Å²	56	66.8 Å²	66.8	39%	0.392	37%	0.373	S	S	.	.			trans	-65.3	160.6	170.2	69.6	0	0	0	0	111.3	A268 E269 G270	S266-A268 PolarHBondContact O-N 3.3Å; S266-E269 VanDerWaalsContact CB-OE2 3.29Å; S266-E269 WeakPolarHBondContact CB-OE2 3.29Å; S266-E269 PolarHBondContact N-OE2 3.4Å; S266-E269 PolarHBondContact O-N 2.69Å; S266-E269 VanDerWaalsContact OG-CD 3.31Å; S266-E269 WeakPolarHBondContact OG-CG 3.49Å; S266-E269 PolarHBondContact OG-N 2.82Å; S266-E269 PolarHBondContact OG-OE2 3.37Å; S266-G270 PolarHBondContact O-N 2.97Å
267	V	98.8	Very high	98.8	Very high	119 Å²	119	69.1 Å²	69.1	72%	0.721	38%	0.382	S	S	*	.	H	α-helix	trans	-58.7	-37	176	176.4	0	0	0	0	111.6	G270 L271	V267-G270 PolarHBondContact O-N 2.97Å; V267-L271 HydrophobicContact CG1-CD1 4.02Å; V267-L271 HydrophobicContact CG1-CG 4.38Å; V267-L271 VanDerWaalsContact O-CG 3.29Å; V267-L271 WeakPolarHBondContact O-CG 3.35Å; V267-L271 PolarHBondContact O-N 3.17Å
268	A	98.8	Very high	98.8	Very high	72 Å²	72	69.7 Å²	69.7	60%	0.595	39%	0.385	S	S	*	.	H	α-helix	trans	-66.2	-46.5	179.6	0	0	0	0	0	112	S266 G270 L271 D272	S266-A268 PolarHBondContact O-N 3.3Å; A268-G270 VanDerWaalsContact C-N 3.35Å; A268-L271 PolarHBondContact O-N 3.13Å; A268-D272 PolarHBondContact O-N 2.99Å; A268-D272 VanDerWaalsContact O-N 3.14Å
269	E	98.8	Very high	98.7	Very high	96 Å²	96	75.5 Å²	75.5	45%	0.449	41%	0.414	S	S	.	.	H	α-helix	trans	-62.9	-41.3	175	-69.7	161.6	138.4	0	0	111.4	H265 S266 L271 D272 Y273	H265-E269 HydrophobicContact CB-CB 3.95Å; S266-E269 VanDerWaalsContact CB-OE2 3.29Å; S266-E269 WeakPolarHBondContact CB-OE2 3.29Å; S266-E269 PolarHBondContact N-OE2 3.4Å; S266-E269 PolarHBondContact O-N 2.69Å; S266-E269 VanDerWaalsContact OG-CD 3.31Å; S266-E269 WeakPolarHBondContact OG-CG 3.49Å; S266-E269 PolarHBondContact OG-N 2.82Å; S266-E269 PolarHBondContact OG-OE2 3.37Å; E269-L271 PolarHBondContact O-N 3.33Å; E269-D272 PolarHBondContact O-N 3.28Å; E269-Y273 WeakPolarHBondContact O-CB 3.36Å; E269-Y273 PolarHBondContact O-N 3.46Å
270	G	98.7	Very high	98.7	Very high	6 Å²	6	72.7 Å²	72.7	6%	0.062	40%	0.404	C	S	.	.	H	α-helix	trans	-62.1	-40.4	176.8	0	0	0	0	0	113.4	S266 V267 A268 M274	S266-G270 PolarHBondContact O-N 2.97Å; V267-G270 PolarHBondContact O-N 2.97Å; A268-G270 VanDerWaalsContact C-N 3.35Å; G270-M274 VanDerWaalsContact O-CB 3.27Å; G270-M274 WeakPolarHBondContact O-CB 3.42Å; G270-M274 PolarHBondContact O-N 3.08Å
271	L	98.9	Very high	98.7	Very high	116 Å²	116	74.2 Å²	74.2	61%	0.607	41%	0.411	S	S	*	.	H	α-helix	trans	-68	-40.3	177.1	-74	171.7	0	0	0	112.4	V267 A268 E269 M274 A275	V267-L271 HydrophobicContact CG1-CD1 4.02Å; V267-L271 HydrophobicContact CG1-CG 4.38Å; V267-L271 VanDerWaalsContact O-CG 3.29Å; V267-L271 WeakPolarHBondContact O-CG 3.35Å; V267-L271 PolarHBondContact O-N 3.17Å; A268-L271 PolarHBondContact O-N 3.13Å; E269-L271 PolarHBondContact O-N 3.33Å; L271-M274 PolarHBondContact O-N 3.23Å; L271-A275 PolarHBondContact O-N 2.82Å
272	D	98.8	Very high	98.6	Very high	124 Å²	124	76.6 Å²	76.6	66%	0.663	43%	0.427	S	S	*	.	H	α-helix	trans	-64.8	-46.7	176.2	-172	63.4	0	0	0	111.2	A268 E269 M274 A275 A276	A268-D272 PolarHBondContact O-N 2.99Å; A268-D272 VanDerWaalsContact O-N 3.14Å; E269-D272 PolarHBondContact O-N 3.28Å; D272-M274 VanDerWaalsContact C-N 3.33Å; D272-M274 PolarHBondContact O-N 3.08Å; D272-A275 PolarHBondContact O-N 3.08Å; D272-A276 PolarHBondContact O-N 3.48Å
273	Y	98.8	Very high	98.6	Very high	75 Å²	75	81 Å²	81	29%	0.294	44%	0.441	S	S	.	.	H	α-helix	trans	-58.2	-43.8	173.9	-174.2	-90.9	0	0	0	112.1	I257 N258 Y261 E269 A275 A276 W277	I257-Y273 HydrophobicContact CG2-CE1 4.41Å; N258-Y273 WeakPolarHBondContact OD1-CD1 3.4Å; Y261-Y273 AromaticContact CD1-CD1 3.84Å; Y261-Y273 HydrophobicContact CD1-CD1 3.84Å; Y261-Y273 HydrophobicContact CD1-CD2 4.39Å; Y261-Y273 AromaticContact CD1-CG 3.74Å; Y261-Y273 HydrophobicContact CD1-CG 3.74Å; Y261-Y273 HydrophobicContact CD2-CD1 4.06Å; Y261-Y273 AromaticContact CD2-CD2 3.89Å; Y261-Y273 HydrophobicContact CD2-CD2 3.89Å; Y261-Y273 HydrophobicContact CD2-CE1 4.09Å; Y261-Y273 AromaticContact CD2-CE2 3.91Å; Y261-Y273 HydrophobicContact CD2-CE2 3.91Å; Y261-Y273 AromaticContact CD2-CG 3.97Å; Y261-Y273 HydrophobicContact CD2-CG 3.97Å; Y261-Y273 HydrophobicContact CE1-CD1 4.22Å; Y261-Y273 HydrophobicContact CE1-CD2 4.06Å; Y261-Y273 AromaticContact CE1-CG 3.63Å; Y261-Y273 HydrophobicContact CE1-CG 3.63Å; Y261-Y273 HydrophobicContact CE2-CD1 4.43Å; Y261-Y273 AromaticContact CE2-CD2 3.52Å; Y261-Y273 HydrophobicContact CE2-CD2 3.52Å; Y261-Y273 AromaticContact CE2-CE2 3.8Å; Y261-Y273 HydrophobicContact CE2-CE2 3.8Å; Y261-Y273 AromaticContact CE2-CG 3.87Å; Y261-Y273 HydrophobicContact CE2-CG 3.87Å; Y261-Y273 AromaticContact CG-CD1 3.75Å; Y261-Y273 HydrophobicContact CG-CD1 3.75Å; Y261-Y273 HydrophobicContact CG-CD2 4.32Å; Y261-Y273 HydrophobicContact CG-CE1 4.04Å; Y261-Y273 AromaticContact CG-CG 3.91Å; Y261-Y273 HydrophobicContact CG-CG 3.91Å; Y261-Y273 AromaticContact CZ-CD2 3.61Å; Y261-Y273 AromaticContact CZ-CG 3.7Å; E269-Y273 WeakPolarHBondContact O-CB 3.36Å; E269-Y273 PolarHBondContact O-N 3.46Å; Y273-A275 VanDerWaalsContact C-N 3.34Å; Y273-A275 PolarHBondContact O-N 3.14Å; Y273-A276 PolarHBondContact O-N 3.05Å; Y273-W277 HydrophobicContact CE1-CE3 4.37Å; Y273-W277 WeakPolarHBondContact O-CB 3.42Å; Y273-W277 PolarHBondContact O-N 3.33Å
274	M	98.8	Very high	98.5	Very high	57 Å²	57	78.9 Å²	78.9	28%	0.281	44%	0.437	S	S	.	.	H	α-helix	trans	-62.5	-39	177.7	-174.1	73.9	-113.7	0	0	112.1	N258 G270 L271 D272 W277 N278	N258-M274 HydrophobicContact CB-SD 3.72Å; N258-M274 PolarHBondContact OD1-SD 3.11Å; G270-M274 VanDerWaalsContact O-CB 3.27Å; G270-M274 WeakPolarHBondContact O-CB 3.42Å; G270-M274 PolarHBondContact O-N 3.08Å; L271-M274 PolarHBondContact O-N 3.23Å; D272-M274 VanDerWaalsContact C-N 3.33Å; D272-M274 PolarHBondContact O-N 3.08Å; M274-W277 HydrophobicContact CE-CB 4.48Å; M274-W277 HydrophobicContact CE-CG 4.43Å; M274-W277 PolarHBondContact O-N 2.83Å; M274-N278 HydrophobicContact CE-CB 4Å; M274-N278 WeakPolarHBondContact CE-ND2 3.04Å; M274-N278 WeakPolarHBondContact CE-OD1 3.34Å; M274-N278 WeakPolarHBondContact O-CB 3.09Å; M274-N278 PolarHBondContact O-N 3.13Å
275	A	98.8	Very high	98.5	Very high	62 Å²	62	81.6 Å²	81.6	51%	0.512	45%	0.448	S	S	.	.	H	α-helix	trans	-65.3	-46.9	176.1	0	0	0	0	0	111.4	L271 D272 Y273 W277 N278 M279	L271-A275 PolarHBondContact O-N 2.82Å; D272-A275 PolarHBondContact O-N 3.08Å; Y273-A275 VanDerWaalsContact C-N 3.34Å; Y273-A275 PolarHBondContact O-N 3.14Å; A275-W277 VanDerWaalsContact C-N 3.28Å; A275-W277 PolarHBondContact O-N 3.43Å; A275-N278 PolarHBondContact O-N 3.46Å; A275-M279 PolarHBondContact O-N 3.17Å; A275-M279 VanDerWaalsContact O-N 3.1Å
276	A	98.7	Very high	98.4	Very high	53 Å²	53	78.5 Å²	78.5	44%	0.438	43%	0.434	S	S	.	.	H	α-helix	trans	-63.2	-32.8	175.6	0	0	0	0	0	112.7	D272 Y273 M279	D272-A276 PolarHBondContact O-N 3.48Å; Y273-A276 PolarHBondContact O-N 3.05Å; A276-M279 WeakPolarHBondContact O-CE 3.02Å; A276-M279 WeakPolarHBondContact O-CG 3.23Å
277	W	98.6	Very high	98.3	Very high	59 Å²	59	79.3 Å²	79.3	22%	0.223	44%	0.436	C	S	.	.	H	α-helix	trans	-69.9	-53.1	174.2	-178.9	-88.7	0	0	0	111.8	I257 Y273 M274 A275 M279 S280 M281	I257-W277 HydrophobicContact CD1-CH2 3.34Å; I257-W277 HydrophobicContact CD1-CZ2 3.69Å; I257-W277 HydrophobicContact CD1-CZ3 4.19Å; I257-W277 HydrophobicContact CG1-CH2 4.5Å; I257-W277 HydrophobicContact CG2-CE3 4.35Å; I257-W277 HydrophobicContact CG2-CH2 4.15Å; I257-W277 HydrophobicContact CG2-CZ3 4.01Å; Y273-W277 HydrophobicContact CE1-CE3 4.37Å; Y273-W277 WeakPolarHBondContact O-CB 3.42Å; Y273-W277 PolarHBondContact O-N 3.33Å; M274-W277 HydrophobicContact CE-CB 4.48Å; M274-W277 HydrophobicContact CE-CG 4.43Å; M274-W277 PolarHBondContact O-N 2.83Å; A275-W277 VanDerWaalsContact C-N 3.28Å; A275-W277 PolarHBondContact O-N 3.43Å; W277-M279 PolarHBondContact O-N 3.03Å; W277-S280 PolarHBondContact O-N 3.39Å; W277-M281 HydrophobicContact CG-CG 4.45Å; W277-M281 HydrophobicContact CH2-CE 4.31Å; W277-M281 HydrophobicContact CZ2-CE 4.01Å; W277-M281 HydrophobicContact CZ2-CG 4.33Å; W277-M281 PolarHBondContact O-N 3.38Å
278	N	98.6	Very high	98.1	Very high	56 Å²	56	78.6 Å²	78.6	30%	0.299	43%	0.426	S	S	.	.	H	α-helix	trans	-74.4	-19.9	-171.7	-98.8	9	0	0	0	114.4	M274 A275 S280 M281 L282	M274-N278 HydrophobicContact CE-CB 4Å; M274-N278 WeakPolarHBondContact CE-ND2 3.04Å; M274-N278 WeakPolarHBondContact CE-OD1 3.34Å; M274-N278 WeakPolarHBondContact O-CB 3.09Å; M274-N278 PolarHBondContact O-N 3.13Å; A275-N278 PolarHBondContact O-N 3.46Å; N278-S280 PolarHBondContact O-N 2.67Å; N278-S280 VanDerWaalsContact O-N 3.13Å; N278-M281 PolarHBondContact O-N 3.02Å; N278-L282 HydrophobicContact CB-CD1 4.14Å; N278-L282 HydrophobicContact CB-CG 4.17Å; N278-L282 VanDerWaalsContact O-CB 3.31Å; N278-L282 WeakPolarHBondContact O-CB 3.33Å; N278-L282 VanDerWaalsContact O-CG 3.26Å; N278-L282 WeakPolarHBondContact O-CG 3.14Å; N278-L282 PolarHBondContact O-N 2.85Å
279	M	98.3	Very high	97.9	Very high	130 Å²	130	78.4 Å²	78.4	64%	0.64	41%	0.412	S	S	*	.	H	α-helix	trans	-55.6	-31.4	174.4	76.3	-177	178.5	0	0	112.3	A275 A276 W277 Q283	A275-M279 PolarHBondContact O-N 3.17Å; A275-M279 VanDerWaalsContact O-N 3.1Å; A276-M279 WeakPolarHBondContact O-CE 3.02Å; A276-M279 WeakPolarHBondContact O-CG 3.23Å; W277-M279 PolarHBondContact O-N 3.03Å; M279-Q283 PolarHBondContact O-NE2 3.34Å
280	S	98.3	Very high	97.7	Very high	60 Å²	60	76.3 Å²	76.3	42%	0.42	41%	0.408	S	S	.	.	H	α-helix	trans	-88.8	-48.8	173.9	-61.3	0	0	0	0	111.5	W277 N278 L282 Q283	W277-S280 PolarHBondContact O-N 3.39Å; N278-S280 PolarHBondContact O-N 2.67Å; N278-S280 VanDerWaalsContact O-N 3.13Å; S280-L282 VanDerWaalsContact C-N 3.28Å; S280-L282 PolarHBondContact O-N 3.02Å; S280-Q283 WeakPolarHBondContact O-CB 3.19Å; S280-Q283 WeakPolarHBondContact O-CG 3.45Å; S280-Q283 PolarHBondContact O-N 3.04Å; S280-Q283 VanDerWaalsContact O-N 3.09Å
281	M	98.1	Very high	97.4	Very high	66 Å²	66	78.3 Å²	78.3	33%	0.325	42%	0.424	S	S	.	.	H	α-helix	trans	-68.6	-23.5	-170.4	-60.5	-54.9	155	0	0	114.1	V250 W277 N278 Q283 T284	V250-M281 HydrophobicContact CG1-CB 3.95Å; V250-M281 HydrophobicContact CG1-CG 4.36Å; V250-M281 HydrophobicContact CG1-SD 4.07Å; W277-M281 HydrophobicContact CG-CG 4.45Å; W277-M281 HydrophobicContact CH2-CE 4.31Å; W277-M281 HydrophobicContact CZ2-CE 4.01Å; W277-M281 HydrophobicContact CZ2-CG 4.33Å; W277-M281 PolarHBondContact O-N 3.38Å; N278-M281 PolarHBondContact O-N 3.02Å; M281-Q283 PolarHBondContact O-N 2.88Å; M281-T284 WeakPolarHBondContact O-CG2 3.39Å; M281-T284 PolarHBondContact O-N 3.08Å
282	L	97.6	Very high	97.1	Very high	109 Å²	109	77.8 Å²	77.8	57%	0.571	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-12	174.8	-72.1	172.1	0	0	0	113.8	N278 S280 T284 V287	N278-L282 HydrophobicContact CB-CD1 4.14Å; N278-L282 HydrophobicContact CB-CG 4.17Å; N278-L282 VanDerWaalsContact O-CB 3.31Å; N278-L282 WeakPolarHBondContact O-CB 3.33Å; N278-L282 VanDerWaalsContact O-CG 3.26Å; N278-L282 WeakPolarHBondContact O-CG 3.14Å; N278-L282 PolarHBondContact O-N 2.85Å; S280-L282 VanDerWaalsContact C-N 3.28Å; S280-L282 PolarHBondContact O-N 3.02Å; L282-T284 PolarHBondContact O-N 3.04Å; L282-V287 HydrophobicContact CD2-CG2 4.46Å
283	Q	97.6	Very high	96.8	Very high	156 Å²	156	72.3 Å²	72.3	73%	0.729	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	2.1	178.7	-56.2	-179.5	44.7	0	0	113.1	M279 S280 M281	M279-Q283 PolarHBondContact O-NE2 3.34Å; S280-Q283 WeakPolarHBondContact O-CB 3.19Å; S280-Q283 WeakPolarHBondContact O-CG 3.45Å; S280-Q283 PolarHBondContact O-N 3.04Å; S280-Q283 VanDerWaalsContact O-N 3.09Å; M281-Q283 PolarHBondContact O-N 2.88Å
284	T	98	Very high	96.5	Very high	38 Å²	38	72.1 Å²	72.1	23%	0.233	40%	0.404	C	S	.	.	S	Bend	trans	-72	150.2	177.3	-176.3	0	0	0	0	113.3	V250 M281 L282 D286 V287	V250-T284 HydrophobicContact CG1-CG2 4.35Å; M281-T284 WeakPolarHBondContact O-CG2 3.39Å; M281-T284 PolarHBondContact O-N 3.08Å; L282-T284 PolarHBondContact O-N 3.04Å; T284-D286 HydrophobicContact CG2-CB 3.84Å; T284-D286 PolarHBondContact O-N 3.22Å; T284-D286 PolarHBondContact OG1-N 3.34Å; T284-D286 VanDerWaalsContact OG1-N 3.16Å; T284-V287 HydrophobicContact CG2-CG2 3.94Å
285	Q	97.6	Very high	96.3	Very high	130 Å²	130	77.2 Å²	77.2	61%	0.607	43%	0.429	S	S	*	.	H	α-helix	trans	-69.4	-16.4	170.1	-62.5	-58.8	-30.6	0	0	113	V287 M288 K289	Q285-V287 PolarHBondContact O-N 2.88Å; Q285-M288 PolarHBondContact O-N 3.41Å; Q285-K289 WeakPolarHBondContact O-CG 3.33Å; Q285-K289 PolarHBondContact O-N 2.83Å
286	D	97.9	Very high	96.1	Very high	9 Å²	9	79.6 Å²	79.6	5%	0.048	43%	0.43	C	S	.	.	H	α-helix	trans	-62.2	-32.2	-177.6	-69.2	4.7	0	0	0	112.4	S248 T284 S290 F305	S248-D286 VanDerWaalsContact CB-OD2 3.3Å; S248-D286 WeakPolarHBondContact CB-OD2 3.32Å; S248-D286 WeakPolarHBondContact OG-CB 3.34Å; S248-D286 PolarHBondContact OG-OD2 3Å; T284-D286 HydrophobicContact CG2-CB 3.84Å; T284-D286 PolarHBondContact O-N 3.22Å; T284-D286 PolarHBondContact OG1-N 3.34Å; T284-D286 VanDerWaalsContact OG1-N 3.16Å; D286-S290 VanDerWaalsContact O-CB 3.29Å; D286-S290 WeakPolarHBondContact O-CB 3.38Å; D286-S290 PolarHBondContact O-N 3.37Å; D286-S290 PolarHBondContact O-OG 3.42Å; D286-F305 HydrophobicContact CB-CD1 3.72Å; D286-F305 HydrophobicContact CB-CE1 3.92Å; D286-F305 WeakPolarHBondContact OD1-CD1 3.28Å
287	V	96	Very high	95.7	Very high	72 Å²	72	86.2 Å²	86.2	44%	0.436	45%	0.449	S	S	.	.	H	α-helix	trans	-63.7	-50.3	175.5	176.5	0	0	0	0	110.2	L282 T284 Q285 S290 A291	L282-V287 HydrophobicContact CD2-CG2 4.46Å; T284-V287 HydrophobicContact CG2-CG2 3.94Å; Q285-V287 PolarHBondContact O-N 2.88Å; V287-S290 PolarHBondContact O-N 3Å; V287-A291 PolarHBondContact O-N 3.16Å
288	M	94.6	Very high	95.3	Very high	105 Å²	105	88.2 Å²	88.2	52%	0.517	46%	0.459	S	S	.	.	H	α-helix	trans	-63.4	-44.3	179.8	-70.5	-56.4	-60.8	0	0	111.9	Q285 S290 A291 Q292	Q285-M288 PolarHBondContact O-N 3.41Å; M288-S290 VanDerWaalsContact C-N 3.33Å; M288-S290 PolarHBondContact O-N 2.88Å; M288-A291 PolarHBondContact O-N 2.96Å; M288-Q292 WeakPolarHBondContact O-CG 3.46Å; M288-Q292 PolarHBondContact O-N 3.37Å
289	K	94.8	Very high	94.7	Very high	67 Å²	67	88.1 Å²	88.1	29%	0.291	46%	0.463	S	S	.	.	H	α-helix	trans	-59.1	-43.6	175.1	-72.5	177.5	176.1	-176.7	0	111.9	Q285 Q292 A293 T303 L304 F305	Q285-K289 WeakPolarHBondContact O-CG 3.33Å; Q285-K289 PolarHBondContact O-N 2.83Å; K289-Q292 PolarHBondContact O-N 3.15Å; K289-A293 WeakPolarHBondContact O-CB 3.2Å; K289-A293 PolarHBondContact O-N 2.79Å; K289-T303 HydrophobicContact CB-CG2 4.1Å; K289-L304 PolarHBondContact NZ-O 3.38Å; K289-F305 HydrophobicContact CB-CE1 4.14Å; K289-F305 HydrophobicContact CD-CD1 4.3Å
290	S	94.3	Very high	93.8	Very high	53 Å²	53	84.6 Å²	84.6	37%	0.371	45%	0.449	S	S	.	.	H	α-helix	trans	-66.6	-40.4	179.4	-58.7	0	0	0	0	111.9	D286 V287 M288 A293 A294 F305	D286-S290 VanDerWaalsContact O-CB 3.29Å; D286-S290 WeakPolarHBondContact O-CB 3.38Å; D286-S290 PolarHBondContact O-N 3.37Å; D286-S290 PolarHBondContact O-OG 3.42Å; V287-S290 PolarHBondContact O-N 3Å; M288-S290 VanDerWaalsContact C-N 3.33Å; M288-S290 PolarHBondContact O-N 2.88Å; S290-A293 PolarHBondContact O-N 3.43Å; S290-A294 WeakPolarHBondContact O-CB 3.47Å; S290-A294 PolarHBondContact O-N 3.17Å; S290-F305 WeakPolarHBondContact OG-CZ 3.36Å
291	A	93	Very high	93.2	Very high	47 Å²	47	87 Å²	87	39%	0.388	45%	0.453	S	S	.	.	H	α-helix	trans	-63	-45.2	175.9	0	0	0	0	0	111.8	V287 M288 A294 M295	V287-A291 PolarHBondContact O-N 3.16Å; M288-A291 PolarHBondContact O-N 2.96Å; A291-A294 PolarHBondContact O-N 3.12Å; A291-M295 WeakPolarHBondContact O-CG 3.47Å; A291-M295 PolarHBondContact O-N 3.39Å
292	Q	92.9	Very high	92.7	Very high	105 Å²	105	90 Å²	90	49%	0.491	47%	0.466	S	S	.	.	H	α-helix	trans	-61.2	-47.5	175.5	-72.6	172.6	-6.9	0	0	111.7	M288 K289 A294 M295 E296	M288-Q292 WeakPolarHBondContact O-CG 3.46Å; M288-Q292 PolarHBondContact O-N 3.37Å; K289-Q292 PolarHBondContact O-N 3.15Å; Q292-A294 VanDerWaalsContact C-N 3.29Å; Q292-A294 PolarHBondContact O-N 2.7Å; Q292-M295 PolarHBondContact O-N 2.94Å; Q292-E296 WeakPolarHBondContact O-CG 3.45Å; Q292-E296 PolarHBondContact O-N 3.49Å
293	A	92.4	Very high	92.3	Very high	9 Å²	9	85.7 Å²	85.7	7%	0.074	44%	0.444	C	S	.	.	H	α-helix	trans	-58.7	-40.4	177.3	0	0	0	0	0	112.2	K289 S290 E296 K297 K298 T303	K289-A293 WeakPolarHBondContact O-CB 3.2Å; K289-A293 PolarHBondContact O-N 2.79Å; S290-A293 PolarHBondContact O-N 3.43Å; A293-E296 CarbonylContact O-C 3.54Å; A293-E296 PolarHBondContact O-N 3.13Å; A293-K297 PolarHBondContact O-N 3.31Å; A293-K298 HydrophobicContact CB-CB 4.18Å; A293-K298 PolarHBondContact O-N 3.41Å; A293-T303 HydrophobicContact CB-CG2 4.5Å; A293-T303 VanDerWaalsContact CB-OG1 3.28Å; A293-T303 WeakPolarHBondContact CB-OG1 3.38Å
294	A	92.4	Very high	92.1	Very high	72 Å²	72	85 Å²	85	60%	0.595	44%	0.444	S	S	*	.	H	α-helix	trans	-65.3	-42.5	176.2	0	0	0	0	0	112.5	S290 A291 Q292 E296 K297	S290-A294 WeakPolarHBondContact O-CB 3.47Å; S290-A294 PolarHBondContact O-N 3.17Å; A291-A294 PolarHBondContact O-N 3.12Å; Q292-A294 VanDerWaalsContact C-N 3.29Å; Q292-A294 PolarHBondContact O-N 2.7Å; A294-E296 VanDerWaalsContact C-N 3.3Å; A294-E296 PolarHBondContact O-N 3.27Å; A294-K297 PolarHBondContact O-N 2.87Å; A294-K297 VanDerWaalsContact O-N 3.14Å
295	M	93.9	Very high	92.1	Very high	163 Å²	163	84.1 Å²	84.1	80%	0.803	44%	0.437	S	S	*	.	H	α-helix	trans	-62	-38.9	175.2	-71.1	176.2	65.2	0	0	112.1	A291 Q292 K297	A291-M295 WeakPolarHBondContact O-CG 3.47Å; A291-M295 PolarHBondContact O-N 3.39Å; Q292-M295 PolarHBondContact O-N 2.94Å; M295-K297 VanDerWaalsContact C-N 3.25Å; M295-K297 PolarHBondContact O-N 3.09Å
296	E	94.1	Very high	92	Very high	112 Å²	112	81.8 Å²	81.8	52%	0.523	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-2.5	177.4	-65.9	175.6	177.5	0	0	113.4	Q292 A293 A294 K298	Q292-E296 WeakPolarHBondContact O-CG 3.45Å; Q292-E296 PolarHBondContact O-N 3.49Å; A293-E296 CarbonylContact O-C 3.54Å; A293-E296 PolarHBondContact O-N 3.13Å; A294-E296 VanDerWaalsContact C-N 3.3Å; A294-E296 PolarHBondContact O-N 3.27Å; E296-K298 HydrophobicContact CB-CD 4.31Å; E296-K298 HydrophobicContact CB-CG 4.11Å; E296-K298 PolarHBondContact O-N 3.04Å; E296-K298 WeakPolarHBondContact OE2-CD 3.08Å; E296-K298 WeakPolarHBondContact OE2-CE 3.43Å; E296-K298 IonicContact OE2-NZ 3.51Å; E296-K298 PolarHBondContact OE2-NZ 3.04Å
297	K	91.4	Very high	92	Very high	193 Å²	193	87.8 Å²	87.8	84%	0.839	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	31.1	-174.9	-55.9	179.3	-178.6	175.4	0	113.7	A293 A294 M295	A293-K297 PolarHBondContact O-N 3.31Å; A294-K297 PolarHBondContact O-N 2.87Å; A294-K297 VanDerWaalsContact O-N 3.14Å; M295-K297 VanDerWaalsContact C-N 3.25Å; M295-K297 PolarHBondContact O-N 3.09Å
298	K	89.6	Confident	92	Very high	101 Å²	101	88 Å²	88	44%	0.439	46%	0.459	S	S	.	.			trans	-72.8	145.3	172.9	-73.9	178	174.8	163.5	0	110.6	A293 E296	A293-K298 HydrophobicContact CB-CB 4.18Å; A293-K298 PolarHBondContact O-N 3.41Å; E296-K298 HydrophobicContact CB-CD 4.31Å; E296-K298 HydrophobicContact CB-CG 4.11Å; E296-K298 PolarHBondContact O-N 3.04Å; E296-K298 WeakPolarHBondContact OE2-CD 3.08Å; E296-K298 WeakPolarHBondContact OE2-CE 3.43Å; E296-K298 IonicContact OE2-NZ 3.51Å; E296-K298 PolarHBondContact OE2-NZ 3.04Å
299	S	86.6	Confident	91.8	Very high	54 Å²	54	87.2 Å²	87.2	38%	0.378	46%	0.457	S	S	.	.			trans	-64.6	145.4	169.8	175.8	0	0	0	0	109.8	K301 E302	S299-K301 PolarHBondContact O-N 3.33Å; S299-K301 VanDerWaalsContact O-N 3.1Å; S299-K301 PolarHBondContact OG-N 2.81Å; S299-E302 WeakPolarHBondContact CB-OE2 3.23Å; S299-E302 PolarHBondContact N-OE2 2.94Å; S299-E302 WeakPolarHBondContact O-CB 3.36Å; S299-E302 PolarHBondContact O-N 3.22Å
300	P	79.9	Confident	91.7	Very high	55 Å²	55	88.3 Å²	88.3	36%	0.357	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-52.7	-31.7	172.1	-29.3	36.3	0	0	0	113.9	E302 T303	P300-E302 PolarHBondContact O-N 2.86Å; P300-T303 PolarHBondContact O-N 3.2Å; P300-T303 VanDerWaalsContact O-N 3.15Å
301	K	85.4	Confident	91.5	Very high	112 Å²	112	90.2 Å²	90.2	49%	0.487	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-66.1	-17.9	178	-64.6	-172	179.5	179.2	0	114	E243 A246 S299	E243-K301 WeakPolarHBondContact OE1-CE 3.14Å; E243-K301 IonicContact OE1-NZ 2.75Å; E243-K301 PolarHBondContact OE1-NZ 3.39Å; E243-K301 WeakPolarHBondContact OE2-CE 3.45Å; E243-K301 IonicContact OE2-NZ 2.65Å; A246-K301 HydrophobicContact CB-CB 4.49Å; A246-K301 HydrophobicContact CB-CG 3.84Å; S299-K301 PolarHBondContact O-N 3.33Å; S299-K301 VanDerWaalsContact O-N 3.1Å; S299-K301 PolarHBondContact OG-N 2.81Å
302	E	86.9	Confident	91.4	Very high	128 Å²	128	92.8 Å²	92.8	60%	0.598	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-90.3	-7	179.2	-61.1	173.5	111.2	0	0	111.9	S299 P300	S299-E302 WeakPolarHBondContact CB-OE2 3.23Å; S299-E302 PolarHBondContact N-OE2 2.94Å; S299-E302 WeakPolarHBondContact O-CB 3.36Å; S299-E302 PolarHBondContact O-N 3.22Å; P300-E302 PolarHBondContact O-N 2.86Å
303	T	89.9	Confident	91.3	Very high	19 Å²	19	92 Å²	92	12%	0.117	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-97.9	118.5	-177.8	-52.4	0	0	0	0	110.6	K289 A293 P300 F305	K289-T303 HydrophobicContact CB-CG2 4.1Å; A293-T303 HydrophobicContact CB-CG2 4.5Å; A293-T303 VanDerWaalsContact CB-OG1 3.28Å; A293-T303 WeakPolarHBondContact CB-OG1 3.38Å; P300-T303 PolarHBondContact O-N 3.2Å; P300-T303 VanDerWaalsContact O-N 3.15Å; T303-F305 HydrophobicContact CG2-CD1 4.42Å; T303-F305 HydrophobicContact CG2-CE1 3.7Å; T303-F305 HydrophobicContact CG2-CE2 4Å; T303-F305 HydrophobicContact CG2-CZ 3.46Å; T303-F305 VanDerWaalsContact CG2-CZ 3.46Å
304	L	93.4	Very high	91.3	Very high	141 Å²	141	97.5 Å²	97.5	74%	0.738	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-91.9	117.4	179.3	-61.5	177.2	0	0	0	111.5	K289	K289-L304 PolarHBondContact NZ-O 3.38Å
305	F	96.4	Very high	91.2	Very high	20 Å²	20	99.4 Å²	99.4	9%	0.088	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-99.9	148.8	172.5	-55.3	-69.3	0	0	0	110.5	R83 D286 K289 S290 T303	R83-F305 PolarHBondContact NH2-O 2.71Å; D286-F305 HydrophobicContact CB-CD1 3.72Å; D286-F305 HydrophobicContact CB-CE1 3.92Å; D286-F305 WeakPolarHBondContact OD1-CD1 3.28Å; K289-F305 HydrophobicContact CB-CE1 4.14Å; K289-F305 HydrophobicContact CD-CD1 4.3Å; S290-F305 WeakPolarHBondContact OG-CZ 3.36Å; T303-F305 HydrophobicContact CG2-CD1 4.42Å; T303-F305 HydrophobicContact CG2-CE1 3.7Å; T303-F305 HydrophobicContact CG2-CE2 4Å; T303-F305 HydrophobicContact CG2-CZ 3.46Å; T303-F305 VanDerWaalsContact CG2-CZ 3.46Å
306	S	97	Very high	91	Very high	80 Å²	80	94.5 Å²	94.5	56%	0.559	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-66	159.7	176.1	-60.5	0	0	0	0	111	R83 P249	R83-S306 PolarHBondContact NH2-O 3.29Å; P249-S306 WeakPolarHBondContact CG-O 3.37Å
307	K	96.6	Very high	90.7	Very high	136 Å²	136	93 Å²	93	59%	0.591	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-62.9	150.9	169	63.7	174.7	-174.6	150.2	0	111.1	Q80	Q80-K307 HydrophobicContact CB-CB 4.02Å; Q80-K307 HydrophobicContact CB-CD 4Å; Q80-K307 HydrophobicContact CB-CG 4.24Å; Q80-K307 VanDerWaalsContact O-CB 3.32Å; Q80-K307 WeakPolarHBondContact O-CB 3.45Å; Q80-K307 VanDerWaalsContact OE1-CE 3.32Å
308	L	95.6	Very high	90.7	Very high	77 Å²	77	83.9 Å²	83.9	40%	0.403	43%	0.432	S	S	.	.			trans	-135.4	0	177.9	176.1	67.7	0	0	0	108.9	Q80 P249 V250	Q80-L308 VanDerWaalsContact CA-OXT 3.3Å; Q80-L308 WeakPolarHBondContact CA-OXT 3.4Å; Q80-L308 VanDerWaalsContact CG-O 3.28Å; Q80-L308 WeakPolarHBondContact CG-O 3.28Å; Q80-L308 PolarHBondContact NE2-O 3.48Å; Q80-L308 PolarHBondContact O-N 3.11Å; P249-L308 HydrophobicContact CB-CB 3.97Å; P249-L308 HydrophobicContact CB-CD2 4.23Å; P249-L308 HydrophobicContact CG-CB 3.96Å; V250-L308 HydrophobicContact CB-CD2 4.36Å; V250-L308 HydrophobicContact CG2-CD1 4.42Å; V250-L308 HydrophobicContact CG2-CD2 3.9Å

Retrieved 308 of 308 residues in 244.9 ms (Link to these results)

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