A0A087Y7C2_POEFO Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A087Y7C2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 427 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.3	Very low	34.9	Very low	223 Å²	223	138.8 Å²	138.8	100%	1.099	83%	0.825	S	S	*	*				0	70.4	0	-60.2	173	-173.3	0	0	106.7
2	D	31	Very low	34.5	Very low	136 Å²	136	134.2 Å²	134.2	73%	0.727	83%	0.827	S	S	*	*				68.9	100.2	62	-53.9	-54.9	0	0	0	109.6
3	F	31.3	Very low	34.2	Very low	185 Å²	185	130.6 Å²	130.6	81%	0.811	83%	0.833	S	S	*	*				95.3	118.2	80.8	-107.5	-78.3	0	0	0	111.3
4	D	39.8	Very low	34	Very low	118 Å²	118	127.1 Å²	127.1	63%	0.631	83%	0.833	S	S	*	*				-150.3	158.7	110.3	-152.7	-30.6	0	0	0	108.6	R6	D4-R6 IonicContact OD1-CZ 3.94Å; D4-R6 IonicContact OD1-NE 3.22Å; D4-R6 PolarHBondContact OD1-NE 2.95Å; D4-R6 IonicContact OD1-NH2 3.71Å; D4-R6 IonicContact OD2-CZ 3.68Å; D4-R6 IonicContact OD2-NE 3.54Å; D4-R6 IonicContact OD2-NH2 2.95Å; D4-R6 PolarHBondContact OD2-NH2 3.22Å
5	K	41.3	Very low	33.8	Very low	183 Å²	183	124.5 Å²	124.5	80%	0.796	84%	0.838	S	S	*	*			trans	-158.7	103.2	-168.7	-150.8	-170.1	-168.3	-173.1	0	110.5
6	R	36.9	Very low	33.5	Very low	211 Å²	211	121.7 Å²	121.7	80%	0.796	84%	0.837	S	S	*	*			trans	-145.2	142.3	173.7	-50.2	-178.1	-158.5	-158.6	7.5	107.6	D4	D4-R6 IonicContact OD1-CZ 3.94Å; D4-R6 IonicContact OD1-NE 3.22Å; D4-R6 PolarHBondContact OD1-NE 2.95Å; D4-R6 IonicContact OD1-NH2 3.71Å; D4-R6 IonicContact OD2-CZ 3.68Å; D4-R6 IonicContact OD2-NE 3.54Å; D4-R6 IonicContact OD2-NH2 2.95Å; D4-R6 PolarHBondContact OD2-NH2 3.22Å
7	G	34.1	Very low	33.3	Very low	71 Å²	71	119.7 Å²	119.7	73%	0.732	84%	0.842	S	S	*	*			cis	92.7	131.3	19.4	0	0	0	0	0	110.2
8	V	37.9	Very low	33.1	Very low	152 Å²	152	117.7 Å²	117.7	92%	0.921	84%	0.843	S	S	*	*			cis	-157	159.8	10.9	176.4	0	0	0	0	107.2
9	G	32.4	Very low	32.9	Very low	71 Å²	71	116.2 Å²	116.2	73%	0.732	85%	0.846	S	S	*	*			cis	144.7	138.7	-3.5	0	0	0	0	0	112.9
10	G	31.8	Very low	32.8	Very low	92 Å²	92	114.8 Å²	114.8	95%	0.948	85%	0.849	S	S	*	*			trans	93.1	160.7	-174.1	0	0	0	0	0	113.8
11	G	30.8	Very low	32.7	Very low	85 Å²	85	113.2 Å²	113.2	88%	0.876	85%	0.85	S	S	*	*			cis	160.3	158	-3.7	0	0	0	0	0	109.9
12	G	30.6	Very low	32.7	Very low	83 Å²	83	113 Å²	113	86%	0.856	84%	0.843	S	S	*	*			cis	168	133.3	-8.1	0	0	0	0	0	112.8
13	G	30.9	Very low	32.7	Very low	88 Å²	88	110 Å²	110	91%	0.907	84%	0.843	S	S	*	*			trans	96.1	162.1	-179.4	0	0	0	0	0	115.2
14	G	30.7	Very low	32.7	Very low	81 Å²	81	110.8 Å²	110.8	84%	0.835	85%	0.85	S	S	*	*			cis	168.1	142	-10	0	0	0	0	0	114.1
15	G	30.6	Very low	32.3	Very low	88 Å²	88	109.9 Å²	109.9	91%	0.907	86%	0.859	S	S	*	*			trans	79.1	161.6	172.7	0	0	0	0	0	116.9
16	G	29.6	Very low	31.9	Very low	80 Å²	80	110.5 Å²	110.5	83%	0.825	86%	0.864	S	S	*	*			cis	167	141.5	-10.6	0	0	0	0	0	114
17	G	30	Very low	31.6	Very low	88 Å²	88	108.6 Å²	108.6	91%	0.907	87%	0.87	S	S	*	*			trans	79.7	164.4	173.9	0	0	0	0	0	116.4
18	G	29.1	Very low	31.4	Very low	84 Å²	84	108.1 Å²	108.1	87%	0.866	87%	0.865	S	S	*	*			cis	164.6	135	-9.6	0	0	0	0	0	113.8
19	G	30.7	Very low	31.2	Very low	88 Å²	88	110.9 Å²	110.9	91%	0.907	87%	0.865	S	S	*	*			trans	96.8	155.2	174.2	0	0	0	0	0	115.5
20	G	29.3	Very low	31.2	Very low	88 Å²	88	118.9 Å²	118.9	91%	0.907	87%	0.873	S	S	*	*			cis	133.8	97.4	-7.2	0	0	0	0	0	113.6
21	G	31.8	Very low	31.2	Very low	83 Å²	83	123.8 Å²	123.8	86%	0.856	87%	0.874	S	S	*	*			trans	-159.5	142.9	176.7	0	0	0	0	0	113
22	K	35.1	Very low	31.3	Very low	219 Å²	219	125.4 Å²	125.4	95%	0.952	87%	0.871	S	S	*	*			trans	-134.1	156.8	176.5	-84.7	-174.7	173.9	-177.6	0	109.3
23	G	31.4	Very low	31.3	Very low	72 Å²	72	125.3 Å²	125.3	74%	0.742	87%	0.87	S	S	*	*			trans	126.6	144.1	170.5	0	0	0	0	0	112.1
24	E	32.2	Very low	31.4	Very low	202 Å²	202	131.4 Å²	131.4	94%	0.944	87%	0.872	S	S	*	*			cis	-144.7	-177.5	-7.1	-68	-170.3	116.7	0	0	109.4
25	A	31.6	Very low	31.5	Very low	99 Å²	99	132.6 Å²	132.6	82%	0.818	87%	0.874	S	S	*	*			trans	-149.8	130.7	179	0	0	0	0	0	113.3
26	E	32.3	Very low	31.4	Very low	196 Å²	196	132.3 Å²	132.3	92%	0.916	87%	0.871	S	S	*	*			trans	-151.4	137	154.4	-79.4	-169.9	146.7	0	0	105.2
27	D	31.5	Very low	31.4	Very low	170 Å²	170	132 Å²	132	91%	0.909	87%	0.868	S	S	*	*			cis	96.9	144.4	27.7	-160.4	29.6	0	0	0	114.6
28	G	29.9	Very low	31.5	Very low	62 Å²	62	139.1 Å²	139.1	64%	0.639	87%	0.867	S	S	*	*			trans	94.4	138.6	-169.5	0	0	0	0	0	113.8
29	K	33.3	Very low	31.9	Very low	209 Å²	209	140.9 Å²	140.9	91%	0.909	87%	0.866	S	S	*	*			cis	-156.8	147.1	-4.7	-156.5	166.3	-172.1	167.2	0	110.5
30	R	31.6	Very low	31.8	Very low	239 Å²	239	140 Å²	140	90%	0.902	86%	0.858	S	S	*	*			trans	-62.8	149.4	174	-65	171.4	172.2	166.7	-4.1	111.7
31	M	32.9	Very low	32.2	Very low	196 Å²	196	145.4 Å²	145.4	97%	0.966	86%	0.858	S	S	*	*				-154.2	152.9	126.9	-116.4	178.5	-170.6	0	0	113.1
32	S	32.2	Very low	32.3	Very low	118 Å²	118	146.8 Å²	146.8	83%	0.825	86%	0.855	S	S	*	*			trans	-113.2	133.7	-175.2	54	0	0	0	0	111.4
33	G	31.3	Very low	32.1	Very low	81 Å²	81	139 Å²	139	84%	0.835	84%	0.837	S	S	*	*			trans	-127.9	130.3	169.2	0	0	0	0	0	110.7
34	K	32.5	Very low	32.1	Very low	216 Å²	216	147.1 Å²	147.1	94%	0.939	85%	0.845	S	S	*	*			trans	-137	89.3	-174.1	-168.4	-175.5	-177	-176.2	0	112.3
35	A	32.3	Very low	32.3	Very low	106 Å²	106	144 Å²	144	88%	0.876	84%	0.839	S	S	*	*			trans	-156.4	151.5	162.8	0	0	0	0	0	108.1
36	G	29.5	Very low	32.6	Very low	82 Å²	82	143.7 Å²	143.7	85%	0.845	84%	0.837	S	S	*	*			cis	140.3	81.5	-2.9	0	0	0	0	0	112
37	G	28.7	Very low	32.6	Very low	74 Å²	74	137.3 Å²	137.3	76%	0.763	82%	0.824	S	S	*	*			trans	170.8	127	174.9	0	0	0	0	0	117.2
38	R	31.6	Very low	33.1	Very low	238 Å²	238	134.5 Å²	134.5	90%	0.898	82%	0.818	S	S	*	*			trans	49.9	97.7	149	-70.8	179.8	166.9	158.7	-3.4	120.1	G40	R38-G40 PolarHBondContact O-N 2.54Å
39	S	37.5	Very low	33.6	Very low	121 Å²	121	135 Å²	135	85%	0.846	82%	0.822	S	S	*	*				13.9	105.1	119.5	58.3	0	0	0	0	117.9
40	G	30.3	Very low	34.4	Very low	70 Å²	70	129.9 Å²	129.9	72%	0.722	81%	0.813	S	S	*	*			trans	-130.2	104.8	162.2	0	0	0	0	0	109.9	R38 S42	R38-G40 PolarHBondContact O-N 2.54Å; G40-S42 PolarHBondContact O-N 3.16Å
41	H	37	Very low	35.9	Very low	200 Å²	200	121.7 Å²	121.7	93%	0.926	80%	0.803	S	S	*	*			trans	-81.6	65.8	-175.6	-159.3	79.2	0	0	0	111.1	G43	H41-G43 PolarHBondContact O-N 3.04Å; H41-G43 VanDerWaalsContact O-N 3.08Å
42	S	33	Very low	38.1	Very low	113 Å²	113	116.5 Å²	116.5	79%	0.79	78%	0.782	S	S	*	*			trans	-70.3	103.5	172	-170.6	0	0	0	0	108.7	G40 R44	G40-S42 PolarHBondContact O-N 3.16Å; S42-R44 PolarHBondContact O-N 3.17Å; S42-R44 VanDerWaalsContact O-N 3.09Å
43	G	31.3	Very low	40.9	Very low	54 Å²	54	114.4 Å²	114.4	56%	0.557	76%	0.761	S	S	*	*			trans	-59.5	114.1	179.4	0	0	0	0	0	110.2	H41 V45	H41-G43 PolarHBondContact O-N 3.04Å; H41-G43 VanDerWaalsContact O-N 3.08Å; G43-V45 VanDerWaalsContact C-N 3.27Å; G43-V45 PolarHBondContact O-N 2.87Å
44	R	32.3	Very low	43.9	Very low	244 Å²	244	113.5 Å²	113.5	92%	0.921	74%	0.736	S	S	*	*			trans	-62.6	95.1	166	-77.3	-176.9	173.3	174.7	-1.7	107.6	S42 A46	S42-R44 PolarHBondContact O-N 3.17Å; S42-R44 VanDerWaalsContact O-N 3.09Å; R44-A46 VanDerWaalsContact C-N 3.28Å; R44-A46 PolarHBondContact O-N 2.82Å
45	V	36	Very low	46.9	Very low	136 Å²	136	103.2 Å²	103.2	82%	0.824	69%	0.691	S	S	*	*			trans	-57.8	101.3	161.2	176.7	0	0	0	0	105.6	G43 G47	G43-V45 VanDerWaalsContact C-N 3.27Å; G43-V45 PolarHBondContact O-N 2.87Å; V45-G47 PolarHBondContact O-N 3.27Å
46	A	36.7	Very low	49.8	Very low	92 Å²	92	99.5 Å²	99.5	76%	0.76	66%	0.663	S	S	*	*			trans	-69	79.1	170.5	0	0	0	0	0	106.9	R44 S48	R44-A46 VanDerWaalsContact C-N 3.28Å; R44-A46 PolarHBondContact O-N 2.82Å; A46-S48 PolarHBondContact O-N 3.48Å
47	G	32.7	Very low	52.8	Low	63 Å²	63	100 Å²	100	65%	0.649	65%	0.652	S	S	*	*			trans	-56.5	105.3	174.1	0	0	0	0	0	107.4	V45 G49	V45-G47 PolarHBondContact O-N 3.27Å; G47-G49 PolarHBondContact O-N 3.2Å
48	S	43.3	Very low	56	Low	111 Å²	111	97.2 Å²	97.2	78%	0.776	62%	0.619	S	S	*	*			trans	-71.2	73.4	173.7	-169.5	0	0	0	0	107.8	A46 S50	A46-S48 PolarHBondContact O-N 3.48Å; S48-S50 PolarHBondContact O-N 2.82Å
49	G	38.8	Very low	59.1	Low	72 Å²	72	86.3 Å²	86.3	74%	0.742	58%	0.579	S	S	*	*			trans	-69	76.6	172.9	0	0	0	0	0	108.3	G47 G51	G47-G49 PolarHBondContact O-N 3.2Å; G49-G51 PolarHBondContact O-N 2.97Å
50	S	50.5	Low	62	Low	102 Å²	102	86.1 Å²	86.1	71%	0.713	56%	0.559	S	S	*	*			trans	-67.6	66.7	163.6	49.4	0	0	0	0	108.4	S48 V52	S48-S50 PolarHBondContact O-N 2.82Å; S50-V52 PolarHBondContact O-N 2.68Å
51	G	63.7	Low	65.1	Low	67 Å²	67	83.4 Å²	83.4	69%	0.691	53%	0.529	S	S	*	.			trans	-50	113.3	-176.4	0	0	0	0	0	108.9	G49 L53	G49-G51 PolarHBondContact O-N 2.97Å; G51-L53 PolarHBondContact O-N 3.35Å
52	V	79.7	Confident	67.9	Low	87 Å²	87	75.5 Å²	75.5	53%	0.527	50%	0.501	S	S	.	.			trans	-57.9	115.3	-175.7	175.5	0	0	0	0	107.4	S50 M54 R60	S50-V52 PolarHBondContact O-N 2.68Å; V52-M54 WeakPolarHBondContact O-CG 3.17Å; V52-M54 PolarHBondContact O-N 3.49Å; V52-R60 HydrophobicContact CG1-CG 3.58Å
53	L	90.4	Very high	70.7	Confident	74 Å²	74	75.9 Å²	75.9	39%	0.387	49%	0.488	S	S	.	.			trans	-63.9	127.7	-173.8	-177	64.8	0	0	0	109.4	G51 V61	G51-L53 PolarHBondContact O-N 3.35Å; L53-V61 HydrophobicContact CB-CB 4.05Å; L53-V61 HydrophobicContact CB-CG2 4.39Å; L53-V61 HydrophobicContact CD2-CB 4.22Å; L53-V61 HydrophobicContact CD2-CG1 4.12Å; L53-V61 HydrophobicContact CD2-CG2 4.28Å; L53-V61 HydrophobicContact CG-CB 4.1Å; L53-V61 HydrophobicContact CG-CG2 3.99Å; L53-V61 VanDerWaalsContact O-CB 3.28Å; L53-V61 WeakPolarHBondContact O-CB 3.29Å; L53-V61 WeakPolarHBondContact O-CG2 3.42Å; L53-V61 PolarHBondContact O-N 3.15Å
54	M	95.1	Very high	73.7	Confident	62 Å²	62	78.3 Å²	78.3	31%	0.305	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	147.6	-178	-64.7	-61.3	-63.8	0	0	110.5	V52 F59 R60 L79	V52-M54 WeakPolarHBondContact O-CG 3.17Å; V52-M54 PolarHBondContact O-N 3.49Å; M54-F59 CarbonylContact C-O 3.44Å; M54-F59 WeakPolarHBondContact CA-O 3.4Å; M54-R60 VanDerWaalsContact SD-CA 3.58Å; M54-R60 HydrophobicContact SD-CB 3.97Å; M54-R60 HydrophobicContact SD-CG 4.46Å; M54-L79 HydrophobicContact CE-CD1 3.75Å; M54-L79 HydrophobicContact CE-CG 4.45Å; M54-L79 HydrophobicContact SD-CD1 4.27Å
55	V	95.4	Very high	76.4	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.2	165.8	178.2	0	0	0	0	107.9	F59 V61 I87 Y120 C124 A129 V131	V55-F59 HydrophobicContact CB-CB 4.24Å; V55-F59 PolarHBondContact N-O 3.01Å; V55-F59 WeakPolarHBondContact O-CB 3.21Å; V55-F59 WeakPolarHBondContact O-CD2 3.31Å; V55-F59 PolarHBondContact O-N 2.66Å; V55-F59 VanDerWaalsContact O-N 3.12Å; V55-V61 HydrophobicContact CG2-CG2 3.64Å; V55-I87 HydrophobicContact CG2-CD1 4.33Å; V55-I87 HydrophobicContact CG2-CG2 4.01Å; V55-Y120 HydrophobicContact CG1-CD1 3.41Å; V55-Y120 VanDerWaalsContact CG1-CD1 3.41Å; V55-Y120 HydrophobicContact CG1-CE1 3.5Å; V55-Y120 VanDerWaalsContact CG1-CE1 3.5Å; V55-Y120 HydrophobicContact CG1-CG 4.49Å; V55-C124 HydrophobicContact CG2-CB 3.9Å; V55-A129 HydrophobicContact CB-CB 4.43Å; V55-A129 HydrophobicContact CG1-CB 3.71Å; V55-A129 HydrophobicContact CG2-CB 3.76Å; V55-V131 HydrophobicContact CB-CG2 4.14Å; V55-V131 HydrophobicContact CG1-CG2 3.54Å
56	G	92.9	Very high	78.7	Confident	28 Å²	28	64.1 Å²	64.1	29%	0.289	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	-156	-172.9	0	0	0	0	0	112.6
57	P	91.2	Very high	80.4	Confident	93 Å²	93	63.7 Å²	63.7	60%	0.604	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-19.3	-178	31.2	-33.6	0	0	0	113.8
58	N	96.1	Very high	82	Confident	14 Å²	14	61.9 Å²	61.9	8%	0.075	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-140.4	-7.4	-159.5	66.5	-53.2	0	0	0	116.1	N78 L79 Y80	N58-N78 PolarHBondContact ND2-OD1 3.3Å; N58-L79 WeakPolarHBondContact O-CB 3.4Å; N58-L79 WeakPolarHBondContact O-CG 3.44Å; N58-L79 PolarHBondContact O-N 3.25Å; N58-Y80 HydrophobicContact CB-CD1 4.02Å; N58-Y80 HydrophobicContact CB-CD2 3.63Å; N58-Y80 HydrophobicContact CB-CE1 3.92Å; N58-Y80 HydrophobicContact CB-CE2 3.54Å; N58-Y80 HydrophobicContact CB-CG 3.88Å
59	F	97.8	Very high	82.8	Confident	10 Å²	10	61.6 Å²	61.6	4%	0.044	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	106.3	-177.9	-55.9	-75.8	0	0	0	111.7	M54 V55 K77 N78 V85 I87 F119 Y120 V131	M54-F59 CarbonylContact C-O 3.44Å; M54-F59 WeakPolarHBondContact CA-O 3.4Å; V55-F59 HydrophobicContact CB-CB 4.24Å; V55-F59 PolarHBondContact N-O 3.01Å; V55-F59 WeakPolarHBondContact O-CB 3.21Å; V55-F59 WeakPolarHBondContact O-CD2 3.31Å; V55-F59 PolarHBondContact O-N 2.66Å; V55-F59 VanDerWaalsContact O-N 3.12Å; F59-K77 WeakPolarHBondContact CA-O 3.44Å; F59-N78 HydrophobicContact CD1-CB 3.9Å; F59-N78 HydrophobicContact CE1-CB 3.79Å; F59-V85 HydrophobicContact CD1-CG1 4.43Å; F59-V85 HydrophobicContact CD1-CG2 4.05Å; F59-V85 HydrophobicContact CE1-CG1 4.34Å; F59-I87 HydrophobicContact CB-CD1 4.33Å; F59-F119 HydrophobicContact CE1-CB 4.26Å; F59-F119 HydrophobicContact CE2-CB 4.46Å; F59-F119 HydrophobicContact CZ-CB 3.73Å; F59-F119 HydrophobicContact CZ-CG 4.48Å; F59-Y120 HydrophobicContact CE2-CG 4.49Å; F59-V131 HydrophobicContact CB-CG1 4.45Å; F59-V131 HydrophobicContact CB-CG2 4.36Å; F59-V131 HydrophobicContact CD1-CG1 3.71Å; F59-V131 HydrophobicContact CD2-CB 4.46Å; F59-V131 HydrophobicContact CD2-CG1 4.25Å; F59-V131 HydrophobicContact CD2-CG2 4.04Å; F59-V131 HydrophobicContact CE1-CG1 3.93Å; F59-V131 HydrophobicContact CE2-CG1 4.45Å; F59-V131 HydrophobicContact CG-CG1 3.87Å; F59-V131 HydrophobicContact CG-CG2 4.16Å; F59-V131 HydrophobicContact CZ-CG1 4.3Å
60	R	97.1	Very high	84.1	Confident	117 Å²	117	60.5 Å²	60.5	44%	0.442	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	125.5	173.5	178.9	173.2	-61.7	174.2	4.1	110.3	V52 M54 G76 K77 L79	V52-R60 HydrophobicContact CG1-CG 3.58Å; M54-R60 VanDerWaalsContact SD-CA 3.58Å; M54-R60 HydrophobicContact SD-CB 3.97Å; M54-R60 HydrophobicContact SD-CG 4.46Å; R60-G76 CarbonylContact O-C 3.54Å; R60-G76 WeakPolarHBondContact O-CA 3.32Å; R60-K77 PolarHBondContact N-O 3.39Å; R60-K77 PolarHBondContact O-N 2.76Å; R60-L79 HydrophobicContact CB-CD1 4.31Å; R60-L79 HydrophobicContact CB-CD2 3.97Å; R60-L79 HydrophobicContact CB-CG 4.17Å
61	V	96.4	Very high	85.5	Confident	13 Å²	13	56.7 Å²	56.7	8%	0.079	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	130.8	172.8	-175.5	0	0	0	0	109.9	L53 V55 R74 I87	L53-V61 HydrophobicContact CB-CB 4.05Å; L53-V61 HydrophobicContact CB-CG2 4.39Å; L53-V61 HydrophobicContact CD2-CB 4.22Å; L53-V61 HydrophobicContact CD2-CG1 4.12Å; L53-V61 HydrophobicContact CD2-CG2 4.28Å; L53-V61 HydrophobicContact CG-CB 4.1Å; L53-V61 HydrophobicContact CG-CG2 3.99Å; L53-V61 VanDerWaalsContact O-CB 3.28Å; L53-V61 WeakPolarHBondContact O-CB 3.29Å; L53-V61 WeakPolarHBondContact O-CG2 3.42Å; L53-V61 PolarHBondContact O-N 3.15Å; V55-V61 HydrophobicContact CG2-CG2 3.64Å; V61-R74 HydrophobicContact CG1-CB 4.19Å; V61-R74 HydrophobicContact CG1-CG 4.33Å; V61-I87 HydrophobicContact CG2-CD1 3.91Å
62	G	94.6	Very high	86.8	Confident	34 Å²	34	55 Å²	55	35%	0.351	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	-144.9	179.5	0	0	0	0	0	113.5	R74 L75	G62-R74 PolarHBondContact O-NH1 2.94Å; G62-L75 CarbonylContact C-O 3.59Å; G62-L75 WeakPolarHBondContact CA-O 3.24Å; G62-L75 PolarHBondContact N-O 3.24Å
63	K	93.6	Very high	87.4	Confident	120 Å²	120	53.4 Å²	53.4	52%	0.522	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	151.6	-178.7	67.9	-179.6	-177.8	-177	0	112.4	I65 R74 L75 P350	K63-I65 HydrophobicContact CG-CG2 4.32Å; K63-R74 WeakPolarHBondContact O-CA 3.19Å; K63-L75 HydrophobicContact CG-CB 4.33Å; K63-L75 PolarHBondContact O-N 3.22Å; K63-P350 WeakPolarHBondContact CE-O 3.19Å; K63-P350 PolarHBondContact NZ-O 3.28Å
64	K	93.3	Very high	87.6	Confident	106 Å²	106	53 Å²	53	46%	0.461	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	139.2	165.4	-169.8	173.6	-170.9	155.5	0	110.1	G66 C67 E72	K64-G66 WeakPolarHBondContact CE-O 3.25Å; K64-C67 WeakPolarHBondContact CE-SG 3.46Å; K64-C67 PolarHBondContact NZ-SG 2.85Å; K64-E72 WeakPolarHBondContact CB-OE1 3.43Å; K64-E72 HydrophobicContact CD-CG 4.11Å; K64-E72 VanDerWaalsContact CD-OE1 3.22Å; K64-E72 WeakPolarHBondContact CD-OE1 3.41Å; K64-E72 HydrophobicContact CG-CG 3.98Å; K64-E72 VanDerWaalsContact CG-OE1 3.3Å; K64-E72 WeakPolarHBondContact CG-OE1 3.45Å
65	I	90.3	Very high	87.7	Confident	59 Å²	59	50.8 Å²	50.8	30%	0.303	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	-14.6	173.8	62	176.3	0	0	0	113	K63 L73 L75 L134 P350	K63-I65 HydrophobicContact CG-CG2 4.32Å; I65-L73 HydrophobicContact CD1-CD2 4.28Å; I65-L73 HydrophobicContact CD1-CG 4.24Å; I65-L73 HydrophobicContact CG1-CB 4.44Å; I65-L73 HydrophobicContact CG1-CD2 4.15Å; I65-L73 HydrophobicContact CG1-CG 3.97Å; I65-L73 PolarHBondContact N-O 3.06Å; I65-L75 HydrophobicContact CD1-CB 4.38Å; I65-L75 HydrophobicContact CG2-CB 3.74Å; I65-L134 HydrophobicContact CD1-CD1 4.2Å; I65-P350 HydrophobicContact CB-CB 4.29Å; I65-P350 HydrophobicContact CD1-CB 4.44Å; I65-P350 HydrophobicContact CG2-CB 3.69Å
66	G	82.6	Confident	87.8	Confident	23 Å²	23	50.9 Å²	50.9	24%	0.237	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	172.3	173.4	0	0	0	0	0	113.5	K64 L73	K64-G66 WeakPolarHBondContact CE-O 3.25Å; G66-L73 PolarHBondContact N-O 3.5Å; G66-L73 PolarHBondContact O-N 2.95Å
67	C	73.4	Confident	88	Confident	83 Å²	83	51.9 Å²	51.9	56%	0.561	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.8	139.1	161.4	-61.2	0	0	0	0	107.3	K64	K64-C67 WeakPolarHBondContact CE-SG 3.46Å; K64-C67 PolarHBondContact NZ-SG 2.85Å
68	G	65.2	Low	88.3	Confident	25 Å²	25	48.2 Å²	48.2	26%	0.258	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	163.8	159.7	0	0	0	0	0	109.3	F70 G71	G68-F70 PolarHBondContact O-N 3.44Å; G68-G71 PolarHBondContact N-O 3.48Å; G68-G71 PolarHBondContact O-N 2.84Å; G68-G71 VanDerWaalsContact O-O 3.06Å
69	N	61	Low	88.3	Confident	104 Å²	104	51 Å²	51	56%	0.556	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-23.8	179.7	-67.6	8.1	0	0	0	113.3
70	F	66.4	Low	88.3	Confident	49 Å²	49	58.8 Å²	58.8	22%	0.215	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	9.2	-172.7	-44.4	-66.2	0	0	0	113.5	G68 Q98 L204	G68-F70 PolarHBondContact O-N 3.44Å; F70-Q98 VanDerWaalsContact CE1-NE2 3.33Å; F70-Q98 VanDerWaalsContact CZ-NE2 3.29Å; F70-L204 HydrophobicContact CE2-CD2 4.27Å; F70-L204 HydrophobicContact CZ-CD2 4.06Å
71	G	79.5	Confident	88.2	Confident	23 Å²	23	56.7 Å²	56.7	24%	0.237	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.8	-170	-175.4	0	0	0	0	0	117.1	G68 L89	G68-G71 PolarHBondContact N-O 3.48Å; G68-G71 PolarHBondContact O-N 2.84Å; G68-G71 VanDerWaalsContact O-O 3.06Å; G71-L89 CarbonylContact C-O 3.55Å; G71-L89 WeakPolarHBondContact CA-O 3.47Å
72	E	90.1	Very high	88.1	Confident	31 Å²	31	61.4 Å²	61.4	15%	0.145	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	138.2	177.8	-174.4	177.4	-154.7	0	0	111.4	K64 R74 L89	K64-E72 WeakPolarHBondContact CB-OE1 3.43Å; K64-E72 HydrophobicContact CD-CG 4.11Å; K64-E72 VanDerWaalsContact CD-OE1 3.22Å; K64-E72 WeakPolarHBondContact CD-OE1 3.41Å; K64-E72 HydrophobicContact CG-CG 3.98Å; K64-E72 VanDerWaalsContact CG-OE1 3.3Å; K64-E72 WeakPolarHBondContact CG-OE1 3.45Å; E72-R74 VanDerWaalsContact CD-NH2 3.27Å; E72-R74 HydrophobicContact CG-CG 3.99Å; E72-R74 IonicContact OE1-CZ 3.38Å; E72-R74 IonicContact OE1-NE 3.33Å; E72-R74 PolarHBondContact OE1-NE 2.65Å; E72-R74 IonicContact OE1-NH2 2.99Å; E72-R74 PolarHBondContact OE1-NH2 2.79Å; E72-R74 IonicContact OE2-CZ 3.21Å; E72-R74 IonicContact OE2-NE 2.76Å; E72-R74 PolarHBondContact OE2-NE 3.46Å; E72-R74 IonicContact OE2-NH2 2.8Å; E72-R74 PolarHBondContact OE2-NH2 2.76Å; E72-L89 HydrophobicContact CB-CB 4.47Å; E72-L89 PolarHBondContact N-O 2.83Å; E72-L89 PolarHBondContact O-N 2.86Å
73	L	93.6	Very high	88.2	Confident	54 Å²	54	64 Å²	64	28%	0.283	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	124.5	169.3	-168.5	70.3	0	0	0	110.1	I65 G66 A86 K88	I65-L73 HydrophobicContact CD1-CD2 4.28Å; I65-L73 HydrophobicContact CD1-CG 4.24Å; I65-L73 HydrophobicContact CG1-CB 4.44Å; I65-L73 HydrophobicContact CG1-CD2 4.15Å; I65-L73 HydrophobicContact CG1-CG 3.97Å; I65-L73 PolarHBondContact N-O 3.06Å; G66-L73 PolarHBondContact N-O 3.5Å; G66-L73 PolarHBondContact O-N 2.95Å; L73-A86 HydrophobicContact CD1-CB 4.37Å; L73-K88 HydrophobicContact CD1-CB 4.11Å; L73-K88 HydrophobicContact CD1-CG 4.46Å
74	R	95.1	Very high	88.3	Confident	66 Å²	66	62.4 Å²	62.4	25%	0.249	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	149.1	180	-64.2	-170.6	171.6	-113.9	-5.6	112.1	V61 G62 K63 E72 I87 L89	V61-R74 HydrophobicContact CG1-CB 4.19Å; V61-R74 HydrophobicContact CG1-CG 4.33Å; G62-R74 PolarHBondContact O-NH1 2.94Å; K63-R74 WeakPolarHBondContact O-CA 3.19Å; E72-R74 VanDerWaalsContact CD-NH2 3.27Å; E72-R74 HydrophobicContact CG-CG 3.99Å; E72-R74 IonicContact OE1-CZ 3.38Å; E72-R74 IonicContact OE1-NE 3.33Å; E72-R74 PolarHBondContact OE1-NE 2.65Å; E72-R74 IonicContact OE1-NH2 2.99Å; E72-R74 PolarHBondContact OE1-NH2 2.79Å; E72-R74 IonicContact OE2-CZ 3.21Å; E72-R74 IonicContact OE2-NE 2.76Å; E72-R74 PolarHBondContact OE2-NE 3.46Å; E72-R74 IonicContact OE2-NH2 2.8Å; E72-R74 PolarHBondContact OE2-NH2 2.76Å; R74-I87 PolarHBondContact N-O 2.86Å; R74-I87 PolarHBondContact O-N 3.11Å; R74-L89 HydrophobicContact CG-CD1 4.37Å
75	L	96.4	Very high	88.5	Confident	14 Å²	14	57.5 Å²	57.5	7%	0.073	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	128.4	162.6	-178.9	63.3	0	0	0	108.1	G62 K63 I65 Y84 L134 I351	G62-L75 CarbonylContact C-O 3.59Å; G62-L75 WeakPolarHBondContact CA-O 3.24Å; G62-L75 PolarHBondContact N-O 3.24Å; K63-L75 HydrophobicContact CG-CB 4.33Å; K63-L75 PolarHBondContact O-N 3.22Å; I65-L75 HydrophobicContact CD1-CB 4.38Å; I65-L75 HydrophobicContact CG2-CB 3.74Å; L75-Y84 HydrophobicContact CD1-CD1 3.88Å; L75-Y84 HydrophobicContact CD1-CG 4.3Å; L75-Y84 HydrophobicContact CD2-CD1 4.21Å; L75-Y84 HydrophobicContact CD2-CE1 4.31Å; L75-Y84 HydrophobicContact CG-CD1 4.12Å; L75-L134 HydrophobicContact CD1-CD1 4.42Å; L75-L134 HydrophobicContact CD1-CD2 3.56Å; L75-I351 HydrophobicContact CD1-CG1 4.38Å; L75-I351 HydrophobicContact CD2-CG1 4.43Å
76	G	96.9	Very high	88.8	Confident	2 Å²	2	55.2 Å²	55.2	2%	0.021	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	170.5	171.1	0	0	0	0	0	112.4	R60 Y84 V85	R60-G76 CarbonylContact O-C 3.54Å; R60-G76 WeakPolarHBondContact O-CA 3.32Å; G76-Y84 WeakPolarHBondContact O-CA 3.09Å; G76-V85 PolarHBondContact N-O 3.14Å; G76-V85 PolarHBondContact O-N 3.49Å
77	K	97.4	Very high	89.5	Confident	50 Å²	50	54.1 Å²	54.1	22%	0.217	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	126.8	172.5	-151.5	-178.9	-160.8	-163.1	0	111.2	F59 R60 L79 N82 E83 Y84	F59-K77 WeakPolarHBondContact CA-O 3.44Å; R60-K77 PolarHBondContact N-O 3.39Å; R60-K77 PolarHBondContact O-N 2.76Å; K77-L79 PolarHBondContact O-N 3.5Å; K77-N82 WeakPolarHBondContact CE-O 3.41Å; K77-N82 WeakPolarHBondContact CE-OD1 3.42Å; K77-N82 PolarHBondContact NZ-OD1 3.37Å; K77-E83 CarbonylContact C-O 3.54Å; K77-E83 WeakPolarHBondContact CA-O 3.37Å; K77-E83 VanDerWaalsContact CG-O 3.31Å; K77-E83 WeakPolarHBondContact CG-O 3.25Å; K77-Y84 HydrophobicContact CB-CD1 4.36Å; K77-Y84 HydrophobicContact CD-CD1 4.44Å; K77-Y84 HydrophobicContact CD-CE1 4.04Å; K77-Y84 HydrophobicContact CG-CD1 4.04Å; K77-Y84 HydrophobicContact CG-CE1 4.15Å
78	N	97.5	Very high	90.6	Very high	15 Å²	15	51.3 Å²	51.3	8%	0.08	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	117.2	167.8	-175.6	-11.8	0	0	0	108.4	N58 F59 Y80 T81 N82 E83	N58-N78 PolarHBondContact ND2-OD1 3.3Å; F59-N78 HydrophobicContact CD1-CB 3.9Å; F59-N78 HydrophobicContact CE1-CB 3.79Å; N78-Y80 VanDerWaalsContact C-N 3.31Å; N78-Y80 PolarHBondContact OD1-N 2.94Å; N78-T81 VanDerWaalsContact CG-OG1 3.31Å; N78-T81 PolarHBondContact ND2-OG1 3.35Å; N78-T81 PolarHBondContact OD1-N 2.99Å; N78-N82 CarbonylContact O-C 3.48Å; N78-N82 WeakPolarHBondContact O-CA 3.41Å; N78-N82 PolarHBondContact O-N 3.5Å; N78-E83 PolarHBondContact N-O 3.31Å
79	L	96.5	Very high	92	Very high	72 Å²	72	50.2 Å²	50.2	38%	0.377	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-13.2	-178.6	-60.3	-174.9	0	0	0	113.5	M54 N58 R60 K77	M54-L79 HydrophobicContact CE-CD1 3.75Å; M54-L79 HydrophobicContact CE-CG 4.45Å; M54-L79 HydrophobicContact SD-CD1 4.27Å; N58-L79 WeakPolarHBondContact O-CB 3.4Å; N58-L79 WeakPolarHBondContact O-CG 3.44Å; N58-L79 PolarHBondContact O-N 3.25Å; R60-L79 HydrophobicContact CB-CD1 4.31Å; R60-L79 HydrophobicContact CB-CD2 3.97Å; R60-L79 HydrophobicContact CB-CG 4.17Å; K77-L79 PolarHBondContact O-N 3.5Å
80	Y	96.8	Very high	93.6	Very high	174 Å²	174	45.5 Å²	45.5	68%	0.682	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-41.1	175.9	-61.3	-18.5	0	0	0	112.4	N58 N78	N58-Y80 HydrophobicContact CB-CD1 4.02Å; N58-Y80 HydrophobicContact CB-CD2 3.63Å; N58-Y80 HydrophobicContact CB-CE1 3.92Å; N58-Y80 HydrophobicContact CB-CE2 3.54Å; N58-Y80 HydrophobicContact CB-CG 3.88Å; N78-Y80 VanDerWaalsContact C-N 3.31Å; N78-Y80 PolarHBondContact OD1-N 2.94Å
81	T	96.1	Very high	94.9	Very high	73 Å²	73	45.8 Å²	45.8	45%	0.448	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-5.6	177.8	66.4	0	0	0	0	113.8	N78 E83	N78-T81 VanDerWaalsContact CG-OG1 3.31Å; N78-T81 PolarHBondContact ND2-OG1 3.35Å; N78-T81 PolarHBondContact OD1-N 2.99Å; T81-E83 WeakPolarHBondContact CB-OE2 3.42Å; T81-E83 PolarHBondContact O-N 2.79Å; T81-E83 WeakPolarHBondContact OG1-CB 3.34Å; T81-E83 WeakPolarHBondContact OG1-CG 3.25Å; T81-E83 PolarHBondContact OG1-OE2 2.91Å
82	N	94.6	Very high	95.6	Very high	113 Å²	113	49.1 Å²	49.1	60%	0.604	24%	0.239	S	C	*	.			trans	60.9	13.5	-173.3	-161.7	33.4	0	0	0	114.4	K77 N78	K77-N82 WeakPolarHBondContact CE-O 3.41Å; K77-N82 WeakPolarHBondContact CE-OD1 3.42Å; K77-N82 PolarHBondContact NZ-OD1 3.37Å; N78-N82 CarbonylContact O-C 3.48Å; N78-N82 WeakPolarHBondContact O-CA 3.41Å; N78-N82 PolarHBondContact O-N 3.5Å
83	E	94.9	Very high	95.7	Very high	89 Å²	89	57.3 Å²	57.3	42%	0.416	27%	0.274	S	S	.	.			trans	-87.4	152.3	-177.7	-65.9	175.2	99.4	0	0	113.6	K77 N78 T81	K77-E83 CarbonylContact C-O 3.54Å; K77-E83 WeakPolarHBondContact CA-O 3.37Å; K77-E83 VanDerWaalsContact CG-O 3.31Å; K77-E83 WeakPolarHBondContact CG-O 3.25Å; N78-E83 PolarHBondContact N-O 3.31Å; T81-E83 WeakPolarHBondContact CB-OE2 3.42Å; T81-E83 PolarHBondContact O-N 2.79Å; T81-E83 WeakPolarHBondContact OG1-CB 3.34Å; T81-E83 WeakPolarHBondContact OG1-CG 3.25Å; T81-E83 PolarHBondContact OG1-OE2 2.91Å
84	Y	96.4	Very high	95.6	Very high	85 Å²	85	56.5 Å²	56.5	33%	0.333	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	138.3	170.1	-67.7	-73.7	0	0	0	112.2	L75 G76 K77 R188 I351	L75-Y84 HydrophobicContact CD1-CD1 3.88Å; L75-Y84 HydrophobicContact CD1-CG 4.3Å; L75-Y84 HydrophobicContact CD2-CD1 4.21Å; L75-Y84 HydrophobicContact CD2-CE1 4.31Å; L75-Y84 HydrophobicContact CG-CD1 4.12Å; G76-Y84 WeakPolarHBondContact O-CA 3.09Å; K77-Y84 HydrophobicContact CB-CD1 4.36Å; K77-Y84 HydrophobicContact CD-CD1 4.44Å; K77-Y84 HydrophobicContact CD-CE1 4.04Å; K77-Y84 HydrophobicContact CG-CD1 4.04Å; K77-Y84 HydrophobicContact CG-CE1 4.15Å; Y84-R188 PolarHBondContact O-NH1 3.12Å; Y84-I351 HydrophobicContact CD1-CG1 4.42Å; Y84-I351 HydrophobicContact CD2-CD1 3.45Å; Y84-I351 VanDerWaalsContact CD2-CD1 3.45Å; Y84-I351 HydrophobicContact CD2-CG1 3.85Å; Y84-I351 HydrophobicContact CD2-CG2 4.41Å; Y84-I351 HydrophobicContact CE2-CD1 4.06Å; Y84-I351 HydrophobicContact CE2-CG1 4.1Å; Y84-I351 HydrophobicContact CE2-CG2 3.89Å; Y84-I351 HydrophobicContact CG-CD1 3.81Å; Y84-I351 HydrophobicContact CG-CG1 4.01Å
85	V	97.4	Very high	95.3	Very high	4 Å²	4	64.4 Å²	64.4	2%	0.024	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	161.2	-178.9	-64.8	0	0	0	0	110.4	F59 G76 I87 F119 V131 L132	F59-V85 HydrophobicContact CD1-CG1 4.43Å; F59-V85 HydrophobicContact CD1-CG2 4.05Å; F59-V85 HydrophobicContact CE1-CG1 4.34Å; G76-V85 PolarHBondContact N-O 3.14Å; G76-V85 PolarHBondContact O-N 3.49Å; V85-I87 HydrophobicContact CG2-CD1 4.41Å; V85-I87 HydrophobicContact CG2-CG1 4.2Å; V85-F119 HydrophobicContact CG1-CD2 3.95Å; V85-F119 HydrophobicContact CG1-CE2 3.77Å; V85-V131 HydrophobicContact CB-CG1 3.87Å; V85-V131 HydrophobicContact CG1-CG1 4.3Å; V85-V131 HydrophobicContact CG2-CG1 3.69Å; V85-L132 WeakPolarHBondContact CB-O 3.47Å
86	A	97.2	Very high	94.8	Very high	10 Å²	10	65.9 Å²	65.9	8%	0.083	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	140.2	167.9	0	0	0	0	0	109.7	L73 V131 L132 L134	L73-A86 HydrophobicContact CD1-CB 4.37Å; A86-V131 WeakPolarHBondContact O-CA 3.13Å; A86-L132 HydrophobicContact CB-CB 4.28Å; A86-L132 PolarHBondContact N-O 3.38Å; A86-L132 PolarHBondContact O-N 3.3Å; A86-L134 HydrophobicContact CB-CD1 4.07Å
87	I	97.1	Very high	94.5	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	112.6	179	-59.1	-178.7	0	0	0	108.8	V55 F59 V61 R74 V85 L89 M130 V131	V55-I87 HydrophobicContact CG2-CD1 4.33Å; V55-I87 HydrophobicContact CG2-CG2 4.01Å; F59-I87 HydrophobicContact CB-CD1 4.33Å; V61-I87 HydrophobicContact CG2-CD1 3.91Å; R74-I87 PolarHBondContact N-O 2.86Å; R74-I87 PolarHBondContact O-N 3.11Å; V85-I87 HydrophobicContact CG2-CD1 4.41Å; V85-I87 HydrophobicContact CG2-CG1 4.2Å; I87-L89 HydrophobicContact CG2-CD2 3.72Å; I87-L89 HydrophobicContact CG2-CG 4.03Å; I87-M130 WeakPolarHBondContact CA-O 3.42Å; I87-V131 HydrophobicContact CG1-CG1 4.19Å; I87-V131 HydrophobicContact CG1-CG2 4.24Å
88	K	96.1	Very high	94.2	Very high	24 Å²	24	69.2 Å²	69.2	10%	0.104	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.3	175.3	-161.3	176.1	-173	-169.3	0	108.1	L73 L99 E102 A129 M130 D201	L73-K88 HydrophobicContact CD1-CB 4.11Å; L73-K88 HydrophobicContact CD1-CG 4.46Å; K88-L99 HydrophobicContact CB-CD1 3.98Å; K88-L99 HydrophobicContact CD-CD1 3.61Å; K88-L99 HydrophobicContact CG-CD1 3.75Å; K88-E102 IonicContact NZ-OE1 2.72Å; K88-E102 PolarHBondContact NZ-OE1 3.33Å; K88-E102 IonicContact NZ-OE2 3.38Å; K88-E102 PolarHBondContact NZ-OE2 3.3Å; K88-A129 WeakPolarHBondContact O-CA 3.45Å; K88-M130 PolarHBondContact N-O 3.43Å; K88-M130 PolarHBondContact O-N 3.29Å; K88-D201 IonicContact NZ-OD1 3.82Å; K88-D201 PolarHBondContact NZ-OD1 3.23Å; K88-D201 IonicContact NZ-OD2 3.64Å
89	L	95.1	Very high	94.1	Very high	2 Å²	2	68.7 Å²	68.7	1%	0.01	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	121	-174.9	-63.8	179.5	0	0	0	111	G71 E72 R74 I87 C124 Y127 N128 A129	G71-L89 CarbonylContact C-O 3.55Å; G71-L89 WeakPolarHBondContact CA-O 3.47Å; E72-L89 HydrophobicContact CB-CB 4.47Å; E72-L89 PolarHBondContact N-O 2.83Å; E72-L89 PolarHBondContact O-N 2.86Å; R74-L89 HydrophobicContact CG-CD1 4.37Å; I87-L89 HydrophobicContact CG2-CD2 3.72Å; I87-L89 HydrophobicContact CG2-CG 4.03Å; L89-C124 HydrophobicContact CD2-CB 4.31Å; L89-Y127 HydrophobicContact CB-CD1 4.06Å; L89-Y127 HydrophobicContact CB-CG 4.28Å; L89-N128 WeakPolarHBondContact CA-O 3.45Å; L89-A129 HydrophobicContact CD2-CB 3.5Å; L89-A129 VanDerWaalsContact CD2-CB 3.5Å
90	E	95.1	Very high	94	Very high	5 Å²	5	70.9 Å²	70.9	2%	0.023	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.5	177.4	172.6	-169.5	-98.8	0	0	109.2	I92 P97 Q98 L99 Y127 N128	E90-I92 PolarHBondContact O-N 2.79Å; E90-P97 WeakPolarHBondContact OE1-CA 3.3Å; E90-Q98 PolarHBondContact OE1-N 2.73Å; E90-L99 HydrophobicContact CB-CB 3.88Å; E90-L99 HydrophobicContact CB-CD2 3.8Å; E90-L99 HydrophobicContact CB-CG 4.4Å; E90-L99 HydrophobicContact CG-CB 4.34Å; E90-L99 WeakPolarHBondContact OE1-CB 3.48Å; E90-L99 PolarHBondContact OE1-N 3.36Å; E90-Y127 CarbonylContact O-C 3.6Å; E90-Y127 WeakPolarHBondContact O-CA 3.48Å; E90-Y127 WeakPolarHBondContact O-CB 3.45Å; E90-N128 HydrophobicContact CB-CB 4.36Å; E90-N128 PolarHBondContact N-O 2.67Å; E90-N128 PolarHBondContact O-N 2.97Å; E90-N128 PolarHBondContact OE2-ND2 3.05Å
91	P	94.1	Very high	93.9	Very high	56 Å²	56	66.4 Å²	66.4	36%	0.364	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	134	176.1	-20.9	32.6	0	0	0	111.6	K93 S94 Y127	P91-K93 PolarHBondContact O-N 3.35Å; P91-S94 WeakPolarHBondContact O-CB 3.41Å; P91-S94 PolarHBondContact O-N 2.96Å; P91-Y127 HydrophobicContact CB-CD1 4.49Å; P91-Y127 HydrophobicContact CG-CD1 4.29Å; P91-Y127 HydrophobicContact CG-CE1 4.15Å
92	I	92.9	Very high	94	Very high	92 Å²	92	63.1 Å²	63.1	47%	0.472	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-24.8	179.4	-64.4	170.2	0	0	0	111.9	E90 K126	E90-I92 PolarHBondContact O-N 2.79Å; I92-K126 PolarHBondContact N-O 2.64Å; I92-K126 VanDerWaalsContact N-O 3.15Å
93	K	93	Very high	94.1	Very high	203 Å²	203	60.4 Å²	60.4	88%	0.883	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	27.1	175.1	-58.4	-169.4	177.2	-170.6	0	113.7	P91	P91-K93 PolarHBondContact O-N 3.35Å
94	S	91.3	Very high	94.2	Very high	37 Å²	37	62.2 Å²	62.2	26%	0.259	30%	0.297	S	S	.	.			trans	-60.2	138.1	173.5	-176.3	0	0	0	0	110.7	P91 A96	P91-S94 WeakPolarHBondContact O-CB 3.41Å; P91-S94 PolarHBondContact O-N 2.96Å; S94-A96 VanDerWaalsContact C-N 3.26Å; S94-A96 PolarHBondContact O-N 3.11Å; S94-A96 PolarHBondContact OG-N 3.46Å; S94-A96 PolarHBondContact OG-O 2.72Å
95	R	87.9	Confident	94.3	Very high	232 Å²	232	58.4 Å²	58.4	88%	0.875	28%	0.283	S	S	*	.	S	Bend	trans	-69.8	-24.7	172.6	-68.1	-177.2	178.7	175.7	-1.2	112.4	E404	R95-E404 IonicContact NH1-OE2 2.74Å
96	A	86.7	Confident	94.3	Very high	46 Å²	46	58.6 Å²	58.6	38%	0.38	28%	0.283	S	S	.	.	S	Bend	trans	-136.9	80.1	179.5	0	0	0	0	0	109.1	S94	S94-A96 VanDerWaalsContact C-N 3.26Å; S94-A96 PolarHBondContact O-N 3.11Å; S94-A96 PolarHBondContact OG-N 3.46Å; S94-A96 PolarHBondContact OG-O 2.72Å
97	P	90.3	Very high	94.4	Very high	91 Å²	91	63.9 Å²	63.9	59%	0.591	30%	0.304	S	S	*	.			trans	-72.1	134.8	178.3	29.8	-33.8	0	0	0	111	E90	E90-P97 WeakPolarHBondContact OE1-CA 3.3Å
98	Q	91.5	Very high	94.4	Very high	31 Å²	31	66.5 Å²	66.5	15%	0.145	32%	0.317	C	S	.	.			trans	-133.2	-24.6	-179.6	-64.3	-174.9	10.7	0	0	113.2	F70 E90 H100 L101 E102 G203	F70-Q98 VanDerWaalsContact CE1-NE2 3.33Å; F70-Q98 VanDerWaalsContact CZ-NE2 3.29Å; E90-Q98 PolarHBondContact OE1-N 2.73Å; Q98-H100 PolarHBondContact O-N 3.07Å; Q98-H100 VanDerWaalsContact O-N 3.12Å; Q98-L101 WeakPolarHBondContact O-CA 3.39Å; Q98-L101 WeakPolarHBondContact O-CB 3.43Å; Q98-L101 PolarHBondContact O-N 2.8Å; Q98-E102 PolarHBondContact O-N 2.72Å; Q98-G203 VanDerWaalsContact OE1-C 3.25Å; Q98-G203 PolarHBondContact OE1-O 2.93Å; Q98-G203 VanDerWaalsContact OE1-O 3.12Å
99	L	94.4	Very high	94.5	Very high	4 Å²	4	65.4 Å²	65.4	2%	0.021	31%	0.312	C	S	.	.	H	α-helix	trans	-60.5	-31	-169.3	-167.4	72.5	0	0	0	113.2	K88 E90 Y103 F121 N128 M130	K88-L99 HydrophobicContact CB-CD1 3.98Å; K88-L99 HydrophobicContact CD-CD1 3.61Å; K88-L99 HydrophobicContact CG-CD1 3.75Å; E90-L99 HydrophobicContact CB-CB 3.88Å; E90-L99 HydrophobicContact CB-CD2 3.8Å; E90-L99 HydrophobicContact CB-CG 4.4Å; E90-L99 HydrophobicContact CG-CB 4.34Å; E90-L99 WeakPolarHBondContact OE1-CB 3.48Å; E90-L99 PolarHBondContact OE1-N 3.36Å; L99-Y103 WeakPolarHBondContact O-CB 3.3Å; L99-Y103 PolarHBondContact O-N 3.02Å; L99-F121 HydrophobicContact CB-CE2 4.45Å; L99-F121 HydrophobicContact CD2-CE2 4.25Å; L99-F121 HydrophobicContact CG-CE2 4.06Å; L99-N128 HydrophobicContact CD2-CB 3.94Å; L99-N128 WeakPolarHBondContact CD2-O 3.46Å; L99-M130 HydrophobicContact CD1-CB 3.99Å; L99-M130 HydrophobicContact CD1-CE 3.84Å; L99-M130 HydrophobicContact CD2-CB 4.23Å; L99-M130 HydrophobicContact CG-CB 4.14Å
100	H	95.4	Very high	94.5	Very high	118 Å²	118	66.7 Å²	66.7	55%	0.546	33%	0.326	S	S	.	.	H	α-helix	trans	-72.6	-35.5	174.4	-172.3	63.3	0	0	0	113.3	Q98 Y103 R104 F121	Q98-H100 PolarHBondContact O-N 3.07Å; Q98-H100 VanDerWaalsContact O-N 3.12Å; H100-Y103 WeakPolarHBondContact O-CB 3.35Å; H100-Y103 PolarHBondContact O-N 2.8Å; H100-R104 PolarHBondContact O-N 3.19Å; H100-R104 VanDerWaalsContact O-N 3.07Å; H100-F121 HydrophobicContact CB-CE1 4.45Å; H100-F121 HydrophobicContact CB-CE2 4.27Å; H100-F121 HydrophobicContact CB-CZ 3.73Å; H100-F121 AromaticContact CG-CZ 3.97Å; H100-F121 AromaticContact ND1-CE1 3.26Å; H100-F121 VanDerWaalsContact ND1-CE1 3.26Å; H100-F121 WeakPolarHBondContact ND1-CE1 3.22Å; H100-F121 AromaticContact ND1-CZ 3.44Å; H100-F121 WeakPolarHBondContact ND1-CZ 3.21Å
101	L	95.1	Very high	94.4	Very high	80 Å²	80	72.2 Å²	72.2	42%	0.419	37%	0.365	S	S	.	.	H	α-helix	trans	-73	-42.3	176.7	-178.4	61.6	0	0	0	110.7	Q98 Y103 R104 F105	Q98-L101 WeakPolarHBondContact O-CA 3.39Å; Q98-L101 WeakPolarHBondContact O-CB 3.43Å; Q98-L101 PolarHBondContact O-N 2.8Å; L101-Y103 VanDerWaalsContact C-N 3.3Å; L101-Y103 PolarHBondContact O-N 3.28Å; L101-R104 WeakPolarHBondContact O-CB 3.32Å; L101-R104 PolarHBondContact O-N 2.94Å; L101-R104 VanDerWaalsContact O-N 3.12Å; L101-F105 HydrophobicContact CD1-CE1 4.04Å; L101-F105 HydrophobicContact CD1-CE2 3.91Å; L101-F105 HydrophobicContact CD1-CZ 3.61Å; L101-F105 HydrophobicContact CD2-CE2 3.99Å; L101-F105 HydrophobicContact CD2-CZ 4.18Å; L101-F105 HydrophobicContact CG-CD2 4.17Å; L101-F105 HydrophobicContact CG-CE2 3.56Å; L101-F105 HydrophobicContact CG-CZ 3.8Å; L101-F105 WeakPolarHBondContact O-CD2 3.44Å; L101-F105 WeakPolarHBondContact O-CG 3.2Å; L101-F105 PolarHBondContact O-N 2.77Å
102	E	96.7	Very high	94.5	Very high	3 Å²	3	71.4 Å²	71.4	1%	0.014	36%	0.36	C	S	.	.	H	α-helix	trans	-56	-44.3	170.9	-172.1	-171.4	178.7	0	0	111.3	K88 Q98 F105 Y106 M130 F202	K88-E102 IonicContact NZ-OE1 2.72Å; K88-E102 PolarHBondContact NZ-OE1 3.33Å; K88-E102 IonicContact NZ-OE2 3.38Å; K88-E102 PolarHBondContact NZ-OE2 3.3Å; Q98-E102 PolarHBondContact O-N 2.72Å; E102-F105 PolarHBondContact O-N 3.13Å; E102-Y106 HydrophobicContact CG-CD2 4.04Å; E102-Y106 HydrophobicContact CG-CE2 3.69Å; E102-Y106 VanDerWaalsContact O-CD2 3.27Å; E102-Y106 WeakPolarHBondContact O-CD2 3.29Å; E102-Y106 PolarHBondContact O-N 3.48Å; E102-M130 HydrophobicContact CB-CE 4.34Å; E102-M130 VanDerWaalsContact CD-CE 3.46Å; E102-M130 HydrophobicContact CG-CE 3.85Å; E102-F202 HydrophobicContact CG-CB 4.01Å
103	Y	97.3	Very high	94.7	Very high	57 Å²	57	72 Å²	72	22%	0.224	36%	0.361	C	S	.	.	H	α-helix	trans	-59.6	-43.9	173.6	172.1	-109.5	0	0	0	113	L99 H100 L101 F105 Y106 K107 V118 F121 M130	L99-Y103 WeakPolarHBondContact O-CB 3.3Å; L99-Y103 PolarHBondContact O-N 3.02Å; H100-Y103 WeakPolarHBondContact O-CB 3.35Å; H100-Y103 PolarHBondContact O-N 2.8Å; L101-Y103 VanDerWaalsContact C-N 3.3Å; L101-Y103 PolarHBondContact O-N 3.28Å; Y103-F105 VanDerWaalsContact C-N 3.34Å; Y103-F105 PolarHBondContact O-N 3.2Å; Y103-Y106 PolarHBondContact O-N 2.96Å; Y103-K107 HydrophobicContact CE1-CG 4.37Å; Y103-K107 HydrophobicContact CE2-CD 4.4Å; Y103-K107 HydrophobicContact CE2-CG 4.12Å; Y103-K107 VanDerWaalsContact CZ-CE 3.47Å; Y103-K107 PolarHBondContact O-N 3.22Å; Y103-K107 WeakPolarHBondContact OH-CE 3.38Å; Y103-V118 HydrophobicContact CD2-CG1 3.98Å; Y103-V118 HydrophobicContact CE2-CG1 4.01Å; Y103-F121 HydrophobicContact CD1-CB 3.95Å; Y103-F121 HydrophobicContact CD1-CD1 4.02Å; Y103-F121 HydrophobicContact CD1-CD2 4.33Å; Y103-F121 AromaticContact CD1-CG 3.83Å; Y103-F121 HydrophobicContact CD1-CG 3.83Å; Y103-F121 HydrophobicContact CD2-CB 3.39Å; Y103-F121 HydrophobicContact CD2-CD2 4.28Å; Y103-F121 AromaticContact CD2-CG 3.97Å; Y103-F121 HydrophobicContact CD2-CG 3.97Å; Y103-F121 HydrophobicContact CE1-CB 3.99Å; Y103-F121 HydrophobicContact CE1-CD1 4.26Å; Y103-F121 HydrophobicContact CE1-CG 4.22Å; Y103-F121 HydrophobicContact CE2-CB 3.43Å; Y103-F121 VanDerWaalsContact CE2-CB 3.43Å; Y103-F121 HydrophobicContact CE2-CG 4.35Å; Y103-F121 HydrophobicContact CG-CB 3.65Å; Y103-F121 HydrophobicContact CG-CD1 4.33Å; Y103-F121 AromaticContact CG-CD2 3.86Å; Y103-F121 HydrophobicContact CG-CD2 3.86Å; Y103-F121 AromaticContact CG-CG 3.67Å; Y103-F121 HydrophobicContact CG-CG 3.67Å; Y103-M130 HydrophobicContact CD2-SD 3.99Å; Y103-M130 HydrophobicContact CG-SD 4.38Å
104	R	97.8	Very high	94.9	Very high	126 Å²	126	62.3 Å²	62.3	48%	0.475	32%	0.319	S	S	.	.	H	α-helix	trans	-58.6	-45.4	173.4	168.5	176.7	163	155.4	-8.5	111	H100 L101 K107 Q108 E207	H100-R104 PolarHBondContact O-N 3.19Å; H100-R104 VanDerWaalsContact O-N 3.07Å; L101-R104 WeakPolarHBondContact O-CB 3.32Å; L101-R104 PolarHBondContact O-N 2.94Å; L101-R104 VanDerWaalsContact O-N 3.12Å; R104-K107 WeakPolarHBondContact O-CB 3.33Å; R104-K107 PolarHBondContact O-N 2.74Å; R104-K107 VanDerWaalsContact O-N 3.12Å; R104-Q108 PolarHBondContact O-N 3.44Å; R104-E207 IonicContact CZ-OE1 3.25Å; R104-E207 IonicContact NE-OE1 2.75Å; R104-E207 IonicContact NH2-OE1 3.84Å; R104-E207 PolarHBondContact NH2-OE1 3.46Å; R104-E207 IonicContact NH2-OE2 3.74Å; R104-E207 PolarHBondContact NH2-OE2 3.31Å
105	F	98	Very high	95.2	Very high	6 Å²	6	60.9 Å²	60.9	3%	0.026	31%	0.309	C	S	.	.	H	α-helix	trans	-64.7	-40.5	178.7	-64.6	-33.8	0	0	0	112.5	L101 E102 Y103 K107 Q108 L109 L174 F202 A205 E207	L101-F105 HydrophobicContact CD1-CE1 4.04Å; L101-F105 HydrophobicContact CD1-CE2 3.91Å; L101-F105 HydrophobicContact CD1-CZ 3.61Å; L101-F105 HydrophobicContact CD2-CE2 3.99Å; L101-F105 HydrophobicContact CD2-CZ 4.18Å; L101-F105 HydrophobicContact CG-CD2 4.17Å; L101-F105 HydrophobicContact CG-CE2 3.56Å; L101-F105 HydrophobicContact CG-CZ 3.8Å; L101-F105 WeakPolarHBondContact O-CD2 3.44Å; L101-F105 WeakPolarHBondContact O-CG 3.2Å; L101-F105 PolarHBondContact O-N 2.77Å; E102-F105 PolarHBondContact O-N 3.13Å; Y103-F105 VanDerWaalsContact C-N 3.34Å; Y103-F105 PolarHBondContact O-N 3.2Å; F105-K107 VanDerWaalsContact C-N 3.29Å; F105-K107 PolarHBondContact O-N 3.36Å; F105-Q108 WeakPolarHBondContact O-CB 3.3Å; F105-Q108 PolarHBondContact O-N 2.87Å; F105-Q108 VanDerWaalsContact O-N 3.13Å; F105-L109 VanDerWaalsContact O-CG 3.27Å; F105-L109 WeakPolarHBondContact O-CG 3.15Å; F105-L109 PolarHBondContact O-N 3.25Å; F105-L174 HydrophobicContact CB-CD1 3.9Å; F105-L174 HydrophobicContact CD1-CD1 3.97Å; F105-L174 HydrophobicContact CD1-CD2 3.5Å; F105-L174 VanDerWaalsContact CD1-CD2 3.5Å; F105-L174 HydrophobicContact CD1-CG 4.4Å; F105-L174 HydrophobicContact CE1-CD2 3.56Å; F105-L174 HydrophobicContact CG-CD1 4.06Å; F105-L174 HydrophobicContact CG-CD2 4.22Å; F105-L174 HydrophobicContact CZ-CD2 4.29Å; F105-F202 HydrophobicContact CB-CB 4.19Å; F105-F202 HydrophobicContact CD2-CB 4.42Å; F105-A205 HydrophobicContact CD2-CB 3.79Å; F105-A205 HydrophobicContact CE2-CB 3.93Å; F105-A205 WeakPolarHBondContact CE2-O 3.24Å; F105-E207 HydrophobicContact CE1-CG 4.06Å
106	Y	98.3	Very high	95.7	Very high	8 Å²	8	50.1 Å²	50.1	3%	0.031	27%	0.269	C	S	.	.	H	α-helix	trans	-60.1	-36.4	170.7	-78.9	-64.1	0	0	0	113.2	E102 Y103 L109 G110 V115 P116 V118 M130 L132 D201 F202	E102-Y106 HydrophobicContact CG-CD2 4.04Å; E102-Y106 HydrophobicContact CG-CE2 3.69Å; E102-Y106 VanDerWaalsContact O-CD2 3.27Å; E102-Y106 WeakPolarHBondContact O-CD2 3.29Å; E102-Y106 PolarHBondContact O-N 3.48Å; Y103-Y106 PolarHBondContact O-N 2.96Å; Y106-L109 HydrophobicContact CD1-CD1 4.38Å; Y106-G110 PolarHBondContact O-N 3.07Å; Y106-V115 HydrophobicContact CD1-CG1 3.99Å; Y106-V115 HydrophobicContact CE1-CG1 4.23Å; Y106-P116 HydrophobicContact CE1-CG 3.65Å; Y106-V118 VanDerWaalsContact CB-CG2 3.46Å; Y106-V118 HydrophobicContact CD1-CG2 4.07Å; Y106-V118 HydrophobicContact CD2-CG2 3.98Å; Y106-V118 HydrophobicContact CG-CG2 3.6Å; Y106-M130 HydrophobicContact CD2-CE 3.91Å; Y106-M130 HydrophobicContact CD2-SD 4.01Å; Y106-M130 HydrophobicContact CE2-CE 3.72Å; Y106-M130 HydrophobicContact CE2-SD 4.38Å; Y106-L132 HydrophobicContact CE2-CD2 4.32Å; Y106-D201 PolarHBondContact OH-N 3.44Å; Y106-F202 HydrophobicContact CD1-CD2 4.21Å; Y106-F202 HydrophobicContact CD1-CE2 4.44Å; Y106-F202 AromaticContact CE1-CD2 3.62Å; Y106-F202 HydrophobicContact CE1-CD2 3.62Å; Y106-F202 AromaticContact CE1-CE2 3.8Å; Y106-F202 HydrophobicContact CE1-CE2 3.8Å; Y106-F202 HydrophobicContact CE2-CD2 4.3Å; Y106-F202 AromaticContact CZ-CD2 3.68Å
107	K	97.8	Very high	96.1	Very high	120 Å²	120	53 Å²	53	52%	0.522	27%	0.274	S	S	.	.	H	α-helix	trans	-68.7	-33.3	173.9	-70.2	-61.4	-172	-175	0	113.1	Y103 R104 F105	Y103-K107 HydrophobicContact CE1-CG 4.37Å; Y103-K107 HydrophobicContact CE2-CD 4.4Å; Y103-K107 HydrophobicContact CE2-CG 4.12Å; Y103-K107 VanDerWaalsContact CZ-CE 3.47Å; Y103-K107 PolarHBondContact O-N 3.22Å; Y103-K107 WeakPolarHBondContact OH-CE 3.38Å; R104-K107 WeakPolarHBondContact O-CB 3.33Å; R104-K107 PolarHBondContact O-N 2.74Å; R104-K107 VanDerWaalsContact O-N 3.12Å; F105-K107 VanDerWaalsContact C-N 3.29Å; F105-K107 PolarHBondContact O-N 3.36Å
108	Q	97.3	Very high	96.5	Very high	56 Å²	56	49.7 Å²	49.7	26%	0.262	25%	0.253	S	S	.	.	H	α-helix	trans	-73.4	-35.5	175.5	175.9	174.2	-11.2	0	0	113.1	R104 F105 R172 E207	R104-Q108 PolarHBondContact O-N 3.44Å; F105-Q108 WeakPolarHBondContact O-CB 3.3Å; F105-Q108 PolarHBondContact O-N 2.87Å; F105-Q108 VanDerWaalsContact O-N 3.13Å; Q108-R172 PolarHBondContact NE2-O 3.47Å; Q108-R172 WeakPolarHBondContact O-CD 3.31Å; Q108-E207 PolarHBondContact OE1-OE1 3.03Å
109	L	97.9	Very high	96.8	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66.1	-44.6	170.5	-67.5	166.1	0	0	0	110.8	F105 Y106 V115 F168 V169 R172 L174 F202	F105-L109 VanDerWaalsContact O-CG 3.27Å; F105-L109 WeakPolarHBondContact O-CG 3.15Å; F105-L109 PolarHBondContact O-N 3.25Å; Y106-L109 HydrophobicContact CD1-CD1 4.38Å; L109-V115 HydrophobicContact CD1-CG1 4.47Å; L109-F168 HydrophobicContact CB-CE1 4.21Å; L109-F168 HydrophobicContact CD2-CD1 4.25Å; L109-F168 HydrophobicContact CD2-CE1 3.89Å; L109-F168 WeakPolarHBondContact O-CZ 3.41Å; L109-V169 HydrophobicContact CD2-CB 4.48Å; L109-V169 HydrophobicContact CD2-CG2 4.05Å; L109-R172 HydrophobicContact CD2-CB 3.97Å; L109-R172 HydrophobicContact CD2-CG 4.03Å; L109-R172 PolarHBondContact O-NE 2.97Å; L109-R172 VanDerWaalsContact O-NE 3.1Å; L109-R172 PolarHBondContact O-NH2 2.87Å; L109-L174 HydrophobicContact CD2-CD1 4.18Å; L109-L174 HydrophobicContact CG-CD1 4.19Å; L109-F202 HydrophobicContact CD1-CD1 4Å; L109-F202 HydrophobicContact CD1-CD2 4.09Å; L109-F202 HydrophobicContact CD1-CE1 3.62Å; L109-F202 HydrophobicContact CD1-CE2 3.71Å; L109-F202 HydrophobicContact CD1-CG 4.23Å; L109-F202 HydrophobicContact CD1-CZ 3.46Å; L109-F202 VanDerWaalsContact CD1-CZ 3.46Å
110	G	95.5	Very high	96.9	Very high	30 Å²	30	54.7 Å²	54.7	31%	0.309	27%	0.273	S	S	.	.			trans	71.9	-169.7	-176.6	0	0	0	0	0	113	Y106 S112	Y106-G110 PolarHBondContact O-N 3.07Å; G110-S112 PolarHBondContact O-N 2.97Å
111	S	93.8	Very high	97	Very high	120 Å²	120	51.1 Å²	51.1	84%	0.839	26%	0.255	S	S	*	.	S	Bend	trans	-69.3	118.8	174	-58	0	0	0	0	110.2
112	S	95.9	Very high	97.1	Very high	39 Å²	39	47.7 Å²	47.7	27%	0.273	24%	0.24	S	C	.	.			trans	-153.6	158.3	178.2	-167	0	0	0	0	111.5	G110 G114 V115 F168	G110-S112 PolarHBondContact O-N 2.97Å; S112-G114 PolarHBondContact O-N 2.72Å; S112-V115 PolarHBondContact O-N 3.38Å; S112-V115 VanDerWaalsContact O-N 3.16Å; S112-F168 WeakPolarHBondContact OG-CE2 3.44Å; S112-F168 WeakPolarHBondContact OG-CZ 3.5Å
113	E	96.6	Very high	97	Very high	105 Å²	105	51.9 Å²	51.9	49%	0.491	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	129.9	179.5	-161.7	-119.1	142.4	0	0	110.4	V115 R165 T196	E113-V115 VanDerWaalsContact C-N 3.31Å; E113-R165 VanDerWaalsContact CD-NH2 3.34Å; E113-R165 PolarHBondContact O-NH1 3.01Å; E113-R165 IonicContact OE1-CZ 3.55Å; E113-R165 IonicContact OE1-NH1 3.19Å; E113-R165 PolarHBondContact OE1-NH1 2.76Å; E113-R165 IonicContact OE1-NH2 3.34Å; E113-R165 PolarHBondContact OE1-NH2 3.16Å; E113-R165 IonicContact OE2-CZ 2.75Å; E113-R165 IonicContact OE2-NH1 2.71Å; E113-R165 PolarHBondContact OE2-NH1 2.8Å; E113-R165 IonicContact OE2-NH2 3.94Å; E113-R165 PolarHBondContact OE2-NH2 3.45Å; E113-T196 HydrophobicContact CG-CG2 4.31Å; E113-T196 WeakPolarHBondContact OE1-CG2 3.43Å; E113-T196 PolarHBondContact OE1-OG1 3.21Å
114	G	97.4	Very high	96.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	5.1	-171.9	0	0	0	0	0	115.4	S112 H198 I199	S112-G114 PolarHBondContact O-N 2.72Å; G114-H198 CarbonylContact O-C 3.59Å; G114-H198 WeakPolarHBondContact O-CA 3.47Å; G114-H198 WeakPolarHBondContact O-CB 3.27Å; G114-I199 PolarHBondContact O-N 2.93Å
115	V	98.3	Very high	96.5	Very high	6 Å²	6	46.8 Å²	46.8	4%	0.036	27%	0.271	C	S	.	.	S	Bend	trans	-104.4	134.5	165.2	-176.8	0	0	0	0	108.5	Y106 L109 S112 E113 F168 R193	Y106-V115 HydrophobicContact CD1-CG1 3.99Å; Y106-V115 HydrophobicContact CE1-CG1 4.23Å; L109-V115 HydrophobicContact CD1-CG1 4.47Å; S112-V115 PolarHBondContact O-N 3.38Å; S112-V115 VanDerWaalsContact O-N 3.16Å; E113-V115 VanDerWaalsContact C-N 3.31Å; V115-F168 HydrophobicContact CG2-CD1 4.17Å; V115-F168 HydrophobicContact CG2-CE1 3.86Å; V115-R193 PolarHBondContact O-NH2 2.83Å
116	P	97.3	Very high	96.3	Very high	6 Å²	6	54.2 Å²	54.2	4%	0.039	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-70.5	140.6	173.4	29.7	-36.3	0	0	0	111.1	Y106 E133 L135 I199 I200	Y106-P116 HydrophobicContact CE1-CG 3.65Å; P116-E133 WeakPolarHBondContact CA-OE2 3.45Å; P116-E133 HydrophobicContact CB-CB 4.01Å; P116-L135 HydrophobicContact CB-CD1 4.31Å; P116-I199 VanDerWaalsContact CD-O 3.32Å; P116-I199 WeakPolarHBondContact CD-O 3.32Å; P116-I200 HydrophobicContact CG-CG2 4.13Å
117	Q	96.6	Very high	96.1	Very high	107 Å²	107	57 Å²	57	50%	0.5	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-66.8	135.2	173.6	-173.5	173.7	3.5	0	0	111.4	F119 L132 E133	Q117-F119 HydrophobicContact CB-CE1 4.27Å; Q117-F119 HydrophobicContact CB-CZ 4.29Å; Q117-F119 VanDerWaalsContact CD-CE1 3.42Å; Q117-F119 HydrophobicContact CG-CD1 4.12Å; Q117-F119 HydrophobicContact CG-CE1 3.82Å; Q117-F119 HydrophobicContact CG-CZ 4.34Å; Q117-L132 CarbonylContact O-C 3.57Å; Q117-L132 WeakPolarHBondContact O-CA 3.36Å; Q117-E133 HydrophobicContact CB-CB 4.29Å; Q117-E133 PolarHBondContact N-OE2 2.93Å; Q117-E133 PolarHBondContact O-N 2.95Å
118	V	97.4	Very high	96	Very high	22 Å²	22	53.2 Å²	53.2	13%	0.133	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119.9	169.8	-170.5	0	0	0	0	110.1	Y103 Y106 M130 L132	Y103-V118 HydrophobicContact CD2-CG1 3.98Å; Y103-V118 HydrophobicContact CE2-CG1 4.01Å; Y106-V118 VanDerWaalsContact CB-CG2 3.46Å; Y106-V118 HydrophobicContact CD1-CG2 4.07Å; Y106-V118 HydrophobicContact CD2-CG2 3.98Å; Y106-V118 HydrophobicContact CG-CG2 3.6Å; V118-M130 HydrophobicContact CG1-CG 3.97Å; V118-M130 HydrophobicContact CG1-SD 4.13Å; V118-L132 HydrophobicContact CB-CD2 4.2Å; V118-L132 HydrophobicContact CG1-CD2 4.11Å; V118-L132 HydrophobicContact CG2-CD2 3.64Å
119	F	97.3	Very high	96	Very high	74 Å²	74	50.6 Å²	50.6	33%	0.325	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-36.5	-178.8	-56.6	-66.6	0	0	0	113.1	F59 V85 Q117 V131 E133	F59-F119 HydrophobicContact CE1-CB 4.26Å; F59-F119 HydrophobicContact CE2-CB 4.46Å; F59-F119 HydrophobicContact CZ-CB 3.73Å; F59-F119 HydrophobicContact CZ-CG 4.48Å; V85-F119 HydrophobicContact CG1-CD2 3.95Å; V85-F119 HydrophobicContact CG1-CE2 3.77Å; Q117-F119 HydrophobicContact CB-CE1 4.27Å; Q117-F119 HydrophobicContact CB-CZ 4.29Å; Q117-F119 VanDerWaalsContact CD-CE1 3.42Å; Q117-F119 HydrophobicContact CG-CD1 4.12Å; Q117-F119 HydrophobicContact CG-CE1 3.82Å; Q117-F119 HydrophobicContact CG-CZ 4.34Å; F119-V131 HydrophobicContact CB-CB 4.47Å; F119-V131 HydrophobicContact CB-CG1 4.39Å; F119-V131 HydrophobicContact CD2-CG1 4.25Å; F119-V131 PolarHBondContact N-O 2.73Å; F119-E133 HydrophobicContact CE2-CB 4.4Å
120	Y	97.7	Very high	96	Very high	66 Å²	66	50.6 Å²	50.6	26%	0.259	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	148.6	-174.7	-179	-92.4	0	0	0	111.9	V55 F59 M130 V131	V55-Y120 HydrophobicContact CG1-CD1 3.41Å; V55-Y120 VanDerWaalsContact CG1-CD1 3.41Å; V55-Y120 HydrophobicContact CG1-CE1 3.5Å; V55-Y120 VanDerWaalsContact CG1-CE1 3.5Å; V55-Y120 HydrophobicContact CG1-CG 4.49Å; F59-Y120 HydrophobicContact CE2-CG 4.49Å; Y120-M130 WeakPolarHBondContact O-CA 3.41Å; Y120-V131 HydrophobicContact CD1-CG2 4.19Å; Y120-V131 PolarHBondContact N-O 3.03Å; Y120-V131 PolarHBondContact O-N 2.85Å
121	F	97.5	Very high	96.1	Very high	42 Å²	42	49.1 Å²	49.1	18%	0.184	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	135.9	162.6	174.3	-86.3	0	0	0	108.9	L99 H100 Y103 A129 M130	L99-F121 HydrophobicContact CB-CE2 4.45Å; L99-F121 HydrophobicContact CD2-CE2 4.25Å; L99-F121 HydrophobicContact CG-CE2 4.06Å; H100-F121 HydrophobicContact CB-CE1 4.45Å; H100-F121 HydrophobicContact CB-CE2 4.27Å; H100-F121 HydrophobicContact CB-CZ 3.73Å; H100-F121 AromaticContact CG-CZ 3.97Å; H100-F121 AromaticContact ND1-CE1 3.26Å; H100-F121 VanDerWaalsContact ND1-CE1 3.26Å; H100-F121 WeakPolarHBondContact ND1-CE1 3.22Å; H100-F121 AromaticContact ND1-CZ 3.44Å; H100-F121 WeakPolarHBondContact ND1-CZ 3.21Å; Y103-F121 HydrophobicContact CD1-CB 3.95Å; Y103-F121 HydrophobicContact CD1-CD1 4.02Å; Y103-F121 HydrophobicContact CD1-CD2 4.33Å; Y103-F121 AromaticContact CD1-CG 3.83Å; Y103-F121 HydrophobicContact CD1-CG 3.83Å; Y103-F121 HydrophobicContact CD2-CB 3.39Å; Y103-F121 HydrophobicContact CD2-CD2 4.28Å; Y103-F121 AromaticContact CD2-CG 3.97Å; Y103-F121 HydrophobicContact CD2-CG 3.97Å; Y103-F121 HydrophobicContact CE1-CB 3.99Å; Y103-F121 HydrophobicContact CE1-CD1 4.26Å; Y103-F121 HydrophobicContact CE1-CG 4.22Å; Y103-F121 HydrophobicContact CE2-CB 3.43Å; Y103-F121 VanDerWaalsContact CE2-CB 3.43Å; Y103-F121 HydrophobicContact CE2-CG 4.35Å; Y103-F121 HydrophobicContact CG-CB 3.65Å; Y103-F121 HydrophobicContact CG-CD1 4.33Å; Y103-F121 AromaticContact CG-CD2 3.86Å; Y103-F121 HydrophobicContact CG-CD2 3.86Å; Y103-F121 AromaticContact CG-CG 3.67Å; Y103-F121 HydrophobicContact CG-CG 3.67Å; F121-A129 WeakPolarHBondContact CA-O 3.48Å; F121-M130 HydrophobicContact CD2-CB 4.16Å
122	G	96.3	Very high	96.3	Very high	9 Å²	9	44.1 Å²	44.1	9%	0.093	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.8	-174	179.5	0	0	0	0	0	113.6	A129	G122-A129 PolarHBondContact N-O 2.54Å; G122-A129 PolarHBondContact O-N 3.22Å
123	P	95	Very high	96.3	Very high	90 Å²	90	44 Å²	44	58%	0.584	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	149.3	-177.1	30.3	-35.2	0	0	0	113.2
124	C	93.9	Very high	96.3	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.02	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	78.9	174.6	-179.9	0	0	0	0	109.5	V55 L89 K126 Y127 A129	V55-C124 HydrophobicContact CG2-CB 3.9Å; L89-C124 HydrophobicContact CD2-CB 4.31Å; C124-K126 PolarHBondContact O-N 2.93Å; C124-Y127 PolarHBondContact N-O 3.25Å; C124-Y127 PolarHBondContact O-N 3.2Å; C124-Y127 VanDerWaalsContact O-N 3.12Å; C124-A129 HydrophobicContact CB-CB 3.65Å
125	G	91.2	Very high	96.2	Very high	74 Å²	74	40.2 Å²	40.2	76%	0.763	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	63	-101.7	-174.9	0	0	0	0	0	112
126	K	93.1	Very high	96.1	Very high	161 Å²	161	40.5 Å²	40.5	70%	0.7	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.6	13.4	179.9	56.3	-174.4	172.6	-178.7	0	114.3	I92 C124	I92-K126 PolarHBondContact N-O 2.64Å; I92-K126 VanDerWaalsContact N-O 3.15Å; C124-K126 PolarHBondContact O-N 2.93Å
127	Y	95.3	Very high	96	Very high	68 Å²	68	40.6 Å²	40.6	27%	0.267	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	148.6	178.8	-57.5	-91.8	0	0	0	111.6	L89 E90 P91 C124	L89-Y127 HydrophobicContact CB-CD1 4.06Å; L89-Y127 HydrophobicContact CB-CG 4.28Å; E90-Y127 CarbonylContact O-C 3.6Å; E90-Y127 WeakPolarHBondContact O-CA 3.48Å; E90-Y127 WeakPolarHBondContact O-CB 3.45Å; P91-Y127 HydrophobicContact CB-CD1 4.49Å; P91-Y127 HydrophobicContact CG-CD1 4.29Å; P91-Y127 HydrophobicContact CG-CE1 4.15Å; C124-Y127 PolarHBondContact N-O 3.25Å; C124-Y127 PolarHBondContact O-N 3.2Å; C124-Y127 VanDerWaalsContact O-N 3.12Å
128	N	95.6	Very high	96.1	Very high	40 Å²	40	36 Å²	36	21%	0.214	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	141.2	150.5	-63.5	-34	0	0	0	107.8	L89 E90 L99	L89-N128 WeakPolarHBondContact CA-O 3.45Å; E90-N128 HydrophobicContact CB-CB 4.36Å; E90-N128 PolarHBondContact N-O 2.67Å; E90-N128 PolarHBondContact O-N 2.97Å; E90-N128 PolarHBondContact OE2-ND2 3.05Å; L99-N128 HydrophobicContact CD2-CB 3.94Å; L99-N128 WeakPolarHBondContact CD2-O 3.46Å
129	A	96.9	Very high	96.1	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	133.6	-178.9	0	0	0	0	0	111.4	V55 K88 L89 F121 G122 C124	V55-A129 HydrophobicContact CB-CB 4.43Å; V55-A129 HydrophobicContact CG1-CB 3.71Å; V55-A129 HydrophobicContact CG2-CB 3.76Å; K88-A129 WeakPolarHBondContact O-CA 3.45Å; L89-A129 HydrophobicContact CD2-CB 3.5Å; L89-A129 VanDerWaalsContact CD2-CB 3.5Å; F121-A129 WeakPolarHBondContact CA-O 3.48Å; G122-A129 PolarHBondContact N-O 2.54Å; G122-A129 PolarHBondContact O-N 3.22Å; C124-A129 HydrophobicContact CB-CB 3.65Å
130	M	97.5	Very high	96.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	130.1	169.4	-171.8	162	55.8	0	0	109.7	I87 K88 L99 E102 Y103 Y106 V118 Y120 F121 L132	I87-M130 WeakPolarHBondContact CA-O 3.42Å; K88-M130 PolarHBondContact N-O 3.43Å; K88-M130 PolarHBondContact O-N 3.29Å; L99-M130 HydrophobicContact CD1-CB 3.99Å; L99-M130 HydrophobicContact CD1-CE 3.84Å; L99-M130 HydrophobicContact CD2-CB 4.23Å; L99-M130 HydrophobicContact CG-CB 4.14Å; E102-M130 HydrophobicContact CB-CE 4.34Å; E102-M130 VanDerWaalsContact CD-CE 3.46Å; E102-M130 HydrophobicContact CG-CE 3.85Å; Y103-M130 HydrophobicContact CD2-SD 3.99Å; Y103-M130 HydrophobicContact CG-SD 4.38Å; Y106-M130 HydrophobicContact CD2-CE 3.91Å; Y106-M130 HydrophobicContact CD2-SD 4.01Å; Y106-M130 HydrophobicContact CE2-CE 3.72Å; Y106-M130 HydrophobicContact CE2-SD 4.38Å; V118-M130 HydrophobicContact CG1-CG 3.97Å; V118-M130 HydrophobicContact CG1-SD 4.13Å; Y120-M130 WeakPolarHBondContact O-CA 3.41Å; F121-M130 HydrophobicContact CD2-CB 4.16Å; M130-L132 HydrophobicContact CE-CD1 4.36Å; M130-L132 HydrophobicContact CE-CD2 4.21Å; M130-L132 HydrophobicContact CG-CD2 3.86Å; M130-L132 HydrophobicContact CG-CG 4.21Å; M130-L132 HydrophobicContact SD-CD2 4.1Å
131	V	97.9	Very high	96.1	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	123.9	-179	-170.1	0	0	0	0	109.5	V55 F59 V85 A86 I87 F119 Y120	V55-V131 HydrophobicContact CB-CG2 4.14Å; V55-V131 HydrophobicContact CG1-CG2 3.54Å; F59-V131 HydrophobicContact CB-CG1 4.45Å; F59-V131 HydrophobicContact CB-CG2 4.36Å; F59-V131 HydrophobicContact CD1-CG1 3.71Å; F59-V131 HydrophobicContact CD2-CB 4.46Å; F59-V131 HydrophobicContact CD2-CG1 4.25Å; F59-V131 HydrophobicContact CD2-CG2 4.04Å; F59-V131 HydrophobicContact CE1-CG1 3.93Å; F59-V131 HydrophobicContact CE2-CG1 4.45Å; F59-V131 HydrophobicContact CG-CG1 3.87Å; F59-V131 HydrophobicContact CG-CG2 4.16Å; F59-V131 HydrophobicContact CZ-CG1 4.3Å; V85-V131 HydrophobicContact CB-CG1 3.87Å; V85-V131 HydrophobicContact CG1-CG1 4.3Å; V85-V131 HydrophobicContact CG2-CG1 3.69Å; A86-V131 WeakPolarHBondContact O-CA 3.13Å; I87-V131 HydrophobicContact CG1-CG1 4.19Å; I87-V131 HydrophobicContact CG1-CG2 4.24Å; F119-V131 HydrophobicContact CB-CB 4.47Å; F119-V131 HydrophobicContact CB-CG1 4.39Å; F119-V131 HydrophobicContact CD2-CG1 4.25Å; F119-V131 PolarHBondContact N-O 2.73Å; Y120-V131 HydrophobicContact CD1-CG2 4.19Å; Y120-V131 PolarHBondContact N-O 3.03Å; Y120-V131 PolarHBondContact O-N 2.85Å
132	L	97.1	Very high	96.1	Very high	15 Å²	15	30 Å²	30	8%	0.079	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	158.6	-167.6	-59.3	174	0	0	0	111.4	V85 A86 Y106 Q117 V118 M130 L134	V85-L132 WeakPolarHBondContact CB-O 3.47Å; A86-L132 HydrophobicContact CB-CB 4.28Å; A86-L132 PolarHBondContact N-O 3.38Å; A86-L132 PolarHBondContact O-N 3.3Å; Y106-L132 HydrophobicContact CE2-CD2 4.32Å; Q117-L132 CarbonylContact O-C 3.57Å; Q117-L132 WeakPolarHBondContact O-CA 3.36Å; V118-L132 HydrophobicContact CB-CD2 4.2Å; V118-L132 HydrophobicContact CG1-CD2 4.11Å; V118-L132 HydrophobicContact CG2-CD2 3.64Å; M130-L132 HydrophobicContact CE-CD1 4.36Å; M130-L132 HydrophobicContact CE-CD2 4.21Å; M130-L132 HydrophobicContact CG-CD2 3.86Å; M130-L132 HydrophobicContact CG-CG 4.21Å; M130-L132 HydrophobicContact SD-CD2 4.1Å; L132-L134 PolarHBondContact O-N 3.28Å
133	E	96.6	Very high	96.2	Very high	37 Å²	37	29.6 Å²	29.6	17%	0.173	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.5	126.3	162.4	-174.4	172.7	-172.8	0	0	110.6	P116 Q117 F119 L135 R193	P116-E133 WeakPolarHBondContact CA-OE2 3.45Å; P116-E133 HydrophobicContact CB-CB 4.01Å; Q117-E133 HydrophobicContact CB-CB 4.29Å; Q117-E133 PolarHBondContact N-OE2 2.93Å; Q117-E133 PolarHBondContact O-N 2.95Å; F119-E133 HydrophobicContact CE2-CB 4.4Å; E133-L135 HydrophobicContact CG-CD2 4.13Å; E133-L135 PolarHBondContact O-N 3.27Å; E133-R193 IonicContact OE1-CZ 2.71Å; E133-R193 IonicContact OE1-NE 3.84Å; E133-R193 IonicContact OE1-NH1 3.46Å; E133-R193 PolarHBondContact OE1-NH1 3.18Å; E133-R193 IonicContact OE2-CZ 3.4Å; E133-R193 IonicContact OE2-NH1 3.6Å; E133-R193 PolarHBondContact OE2-NH1 3.36Å; E133-R193 IonicContact OE2-NH2 3.17Å
134	L	96.6	Very high	96.4	Very high	10 Å²	10	29.6 Å²	29.6	5%	0.052	17%	0.166	C	C	.	.			trans	-79.5	117.2	172.5	-178.6	68	0	0	0	108.9	I65 L75 A86 L132 R188 P350 I351	I65-L134 HydrophobicContact CD1-CD1 4.2Å; L75-L134 HydrophobicContact CD1-CD1 4.42Å; L75-L134 HydrophobicContact CD1-CD2 3.56Å; A86-L134 HydrophobicContact CB-CD1 4.07Å; L132-L134 PolarHBondContact O-N 3.28Å; L134-R188 WeakPolarHBondContact O-CD 3.25Å; L134-R188 WeakPolarHBondContact O-CG 3.22Å; L134-R188 PolarHBondContact O-NE 2.75Å; L134-P350 HydrophobicContact CD1-CG 4.21Å; L134-P350 HydrophobicContact CD2-CG 4.35Å; L134-I351 HydrophobicContact CD2-CD1 3.93Å; L134-I351 HydrophobicContact CD2-CG1 4.37Å
135	L	96.1	Very high	96.6	Very high	14 Å²	14	31.7 Å²	31.7	7%	0.073	18%	0.177	C	C	.	.			trans	-91.6	-176.2	177.8	-61.3	178.2	0	0	0	112	P116 E133 L185 H198 I200	P116-L135 HydrophobicContact CB-CD1 4.31Å; E133-L135 HydrophobicContact CG-CD2 4.13Å; E133-L135 PolarHBondContact O-N 3.27Å; L135-L185 HydrophobicContact CB-CB 4.07Å; L135-L185 HydrophobicContact CB-CD2 3.93Å; L135-L185 HydrophobicContact CD1-CB 3.85Å; L135-L185 HydrophobicContact CD1-CD2 4.17Å; L135-H198 HydrophobicContact CD1-CB 3.64Å; L135-I200 HydrophobicContact CD1-CG2 3.77Å
136	G	95.8	Very high	96.9	Very high	13 Å²	13	28.6 Å²	28.6	13%	0.134	14%	0.143	C	C	.	.			trans	-84.3	-160.4	170.1	0	0	0	0	0	112.7	V186	G136-V186 WeakPolarHBondContact CA-O 3.39Å; G136-V186 PolarHBondContact N-O 3.11Å
137	P	95.6	Very high	97.1	Very high	8 Å²	8	28 Å²	28	5%	0.052	15%	0.147	C	C	.	.			trans	-65.4	159.7	176.8	26.7	-35.4	0	0	0	113.8	D141 L142 L185 V186 P348	P137-D141 HydrophobicContact CB-CB 3.87Å; P137-L142 HydrophobicContact CB-CD2 4.26Å; P137-L142 HydrophobicContact CB-CG 4.16Å; P137-L142 HydrophobicContact CG-CD1 4.26Å; P137-L142 HydrophobicContact CG-CD2 3.64Å; P137-L142 HydrophobicContact CG-CG 3.92Å; P137-L185 WeakPolarHBondContact O-CA 3.49Å; P137-V186 HydrophobicContact CG-CG2 3.86Å; P137-V186 PolarHBondContact O-N 2.86Å; P137-V186 VanDerWaalsContact O-N 3.08Å; P137-P348 HydrophobicContact CB-CG 4.13Å
138	S	97.1	Very high	97.2	Very high	10 Å²	10	28.3 Å²	28.3	7%	0.07	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-77.9	165	171.6	71.8	0	0	0	0	112.2	E140 D141 L142 F184	S138-E140 PolarHBondContact O-N 3.2Å; S138-E140 PolarHBondContact OG-N 3.39Å; S138-D141 VanDerWaalsContact CB-OD2 3.32Å; S138-D141 WeakPolarHBondContact CB-OD2 3.48Å; S138-D141 PolarHBondContact N-OD2 3.21Å; S138-D141 PolarHBondContact O-N 3.44Å; S138-D141 VanDerWaalsContact OG-CG 3.27Å; S138-D141 PolarHBondContact OG-N 2.95Å; S138-D141 PolarHBondContact OG-OD2 3.24Å; S138-L142 VanDerWaalsContact O-CG 3.28Å; S138-L142 WeakPolarHBondContact O-CG 3.29Å; S138-L142 PolarHBondContact O-N 3.45Å; S138-F184 CarbonylContact C-O 3.58Å; S138-F184 VanDerWaalsContact CA-O 3.27Å; S138-F184 WeakPolarHBondContact CA-O 3.21Å
139	L	98.6	Very high	97.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.5	-27.4	173.5	-67.4	-176.1	0	0	0	112	L142 F143 I158 L162 P181 F184 I197 F258 W342	L139-L142 HydrophobicContact CD2-CD1 4.24Å; L139-F143 WeakPolarHBondContact O-CB 3.37Å; L139-F143 PolarHBondContact O-N 2.98Å; L139-I158 HydrophobicContact CD1-CG2 3.78Å; L139-I158 HydrophobicContact CD2-CD1 4.24Å; L139-I158 HydrophobicContact CD2-CG1 4.46Å; L139-L162 HydrophobicContact CD1-CD1 4.11Å; L139-P181 HydrophobicContact CB-CB 4.08Å; L139-P181 PolarHBondContact N-O 3.41Å; L139-F184 HydrophobicContact CD1-CB 3.68Å; L139-F184 HydrophobicContact CD1-CG 4.47Å; L139-F184 HydrophobicContact CG-CB 3.9Å; L139-F184 PolarHBondContact N-O 2.85Å; L139-I197 HydrophobicContact CD1-CG2 4.44Å; L139-F258 HydrophobicContact CB-CE1 4.29Å; L139-F258 HydrophobicContact CB-CZ 3.78Å; L139-F258 HydrophobicContact CD1-CE2 4.07Å; L139-F258 HydrophobicContact CD1-CZ 3.88Å; L139-F258 HydrophobicContact CG-CZ 4.46Å; L139-W342 HydrophobicContact CD2-CH2 4.06Å
140	E	97.9	Very high	97.5	Very high	26 Å²	26	30.5 Å²	30.5	12%	0.121	16%	0.162	C	C	.	.	H	α-helix	trans	-70.7	-42.6	172.7	-167.5	66.2	-167	0	0	111.7	S138 L142 F143 D144 R148 P181 E182 Y257	S138-E140 PolarHBondContact O-N 3.2Å; S138-E140 PolarHBondContact OG-N 3.39Å; E140-L142 VanDerWaalsContact C-N 3.26Å; E140-L142 PolarHBondContact O-N 3.48Å; E140-F143 WeakPolarHBondContact O-CB 3.46Å; E140-F143 PolarHBondContact O-N 2.79Å; E140-F143 VanDerWaalsContact O-N 3.13Å; E140-D144 PolarHBondContact O-N 2.82Å; E140-R148 IonicContact OE1-CZ 2.71Å; E140-R148 IonicContact OE1-NH1 3.57Å; E140-R148 PolarHBondContact OE1-NH1 2.85Å; E140-R148 IonicContact OE1-NH2 2.76Å; E140-R148 PolarHBondContact OE1-NH2 3.23Å; E140-P181 HydrophobicContact CB-CB 3.97Å; E140-E182 HydrophobicContact CB-CG 3.98Å; E140-E182 HydrophobicContact CG-CG 4.31Å; E140-Y257 PolarHBondContact OE1-OH 3.1Å; E140-Y257 WeakPolarHBondContact OE2-CE1 3.32Å; E140-Y257 PolarHBondContact OE2-OH 3.01Å
141	D	96.8	Very high	97.5	Very high	53 Å²	53	32.9 Å²	32.9	28%	0.283	18%	0.179	S	C	.	.	H	α-helix	trans	-61.2	-38.8	176	-60.3	-66.4	0	0	0	111.2	P137 S138 L145 P348	P137-D141 HydrophobicContact CB-CB 3.87Å; S138-D141 VanDerWaalsContact CB-OD2 3.32Å; S138-D141 WeakPolarHBondContact CB-OD2 3.48Å; S138-D141 PolarHBondContact N-OD2 3.21Å; S138-D141 PolarHBondContact O-N 3.44Å; S138-D141 VanDerWaalsContact OG-CG 3.27Å; S138-D141 PolarHBondContact OG-N 2.95Å; S138-D141 PolarHBondContact OG-OD2 3.24Å; D141-L145 WeakPolarHBondContact O-CB 3.21Å; D141-L145 PolarHBondContact O-N 2.95Å; D141-L145 VanDerWaalsContact O-N 3.14Å; D141-P348 HydrophobicContact CB-CG 4.34Å
142	L	98.2	Very high	97.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-72	-30.4	176.5	-67.5	171.8	0	0	0	112.4	P137 S138 L139 E140 L145 C146 F150 V186 W342 L347	P137-L142 HydrophobicContact CB-CD2 4.26Å; P137-L142 HydrophobicContact CB-CG 4.16Å; P137-L142 HydrophobicContact CG-CD1 4.26Å; P137-L142 HydrophobicContact CG-CD2 3.64Å; P137-L142 HydrophobicContact CG-CG 3.92Å; S138-L142 VanDerWaalsContact O-CG 3.28Å; S138-L142 WeakPolarHBondContact O-CG 3.29Å; S138-L142 PolarHBondContact O-N 3.45Å; L139-L142 HydrophobicContact CD2-CD1 4.24Å; E140-L142 VanDerWaalsContact C-N 3.26Å; E140-L142 PolarHBondContact O-N 3.48Å; L142-L145 HydrophobicContact CD2-CD2 4.49Å; L142-L145 PolarHBondContact O-N 3.4Å; L142-C146 PolarHBondContact O-N 3.24Å; L142-C146 VanDerWaalsContact O-N 3.17Å; L142-C146 PolarHBondContact O-SG 2.75Å; L142-C146 VanDerWaalsContact O-SG 3.36Å; L142-F150 HydrophobicContact CB-CZ 4.15Å; L142-V186 HydrophobicContact CD1-CG1 3.7Å; L142-V186 HydrophobicContact CD1-CG2 4.04Å; L142-W342 HydrophobicContact CB-CD2 4.13Å; L142-W342 HydrophobicContact CB-CE3 3.91Å; L142-W342 HydrophobicContact CB-CZ3 4.35Å; L142-W342 HydrophobicContact CD1-CD2 3.93Å; L142-W342 HydrophobicContact CD1-CE3 4.24Å; L142-W342 HydrophobicContact CD1-CG 4.47Å; L142-W342 HydrophobicContact CD1-CH2 4.18Å; L142-W342 HydrophobicContact CD1-CZ2 3.86Å; L142-W342 HydrophobicContact CD1-CZ3 4.36Å; L142-W342 HydrophobicContact CD2-CB 3.96Å; L142-W342 HydrophobicContact CD2-CD2 3.95Å; L142-W342 HydrophobicContact CD2-CG 3.65Å; L142-W342 HydrophobicContact CG-CD2 4.22Å; L142-W342 HydrophobicContact CG-CE3 4.47Å; L142-W342 HydrophobicContact CG-CG 4.44Å; L142-L347 HydrophobicContact CD2-CD2 3.59Å
143	F	98.5	Very high	97.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-73	-44	176.9	-171	-128.2	0	0	0	111.7	L139 E140 L145 C146 D147 R148 F150 Y257 F258	L139-F143 WeakPolarHBondContact O-CB 3.37Å; L139-F143 PolarHBondContact O-N 2.98Å; E140-F143 WeakPolarHBondContact O-CB 3.46Å; E140-F143 PolarHBondContact O-N 2.79Å; E140-F143 VanDerWaalsContact O-N 3.13Å; F143-L145 PolarHBondContact O-N 3.49Å; F143-C146 CarbonylContact O-C 3.5Å; F143-C146 WeakPolarHBondContact O-CA 3.27Å; F143-C146 PolarHBondContact O-N 2.81Å; F143-D147 PolarHBondContact O-N 3.14Å; F143-R148 HydrophobicContact CD1-CB 4.23Å; F143-R148 HydrophobicContact CD1-CG 4.39Å; F143-R148 HydrophobicContact CE1-CB 4.03Å; F143-R148 VanDerWaalsContact CE2-C 3.42Å; F143-R148 HydrophobicContact CZ-CB 4.36Å; F143-R148 WeakPolarHBondContact CZ-O 3.45Å; F143-R148 VanDerWaalsContact O-CA 3.31Å; F143-R148 WeakPolarHBondContact O-CA 3.42Å; F143-R148 PolarHBondContact O-N 3.24Å; F143-F150 HydrophobicContact CB-CE1 4.3Å; F143-F150 HydrophobicContact CB-CE2 4.17Å; F143-F150 HydrophobicContact CB-CZ 3.78Å; F143-F150 HydrophobicContact CD2-CD1 4.07Å; F143-F150 AromaticContact CD2-CD2 3.93Å; F143-F150 HydrophobicContact CD2-CD2 3.93Å; F143-F150 HydrophobicContact CD2-CE1 4.04Å; F143-F150 AromaticContact CD2-CE2 3.89Å; F143-F150 HydrophobicContact CD2-CE2 3.89Å; F143-F150 HydrophobicContact CD2-CG 4.01Å; F143-F150 AromaticContact CD2-CZ 3.95Å; F143-F150 HydrophobicContact CD2-CZ 3.95Å; F143-F150 HydrophobicContact CE2-CD2 4.42Å; F143-F150 HydrophobicContact CE2-CG 4.4Å; F143-F150 HydrophobicContact CG-CE2 4.47Å; F143-F150 HydrophobicContact CG-CZ 4.38Å; F143-Y257 AromaticContact CD1-CE1 3.78Å; F143-Y257 HydrophobicContact CD1-CE1 3.78Å; F143-Y257 HydrophobicContact CE1-CD1 4.07Å; F143-Y257 AromaticContact CE1-CE1 3.44Å; F143-Y257 HydrophobicContact CE1-CE1 3.44Å; F143-Y257 VanDerWaalsContact CE1-CE1 3.44Å; F143-Y257 HydrophobicContact CE1-CE2 4.22Å; F143-Y257 AromaticContact CE1-CZ 3.58Å; F143-Y257 HydrophobicContact CZ-CD1 4.34Å; F143-Y257 HydrophobicContact CZ-CE1 4.15Å; F143-F258 HydrophobicContact CD1-CD1 4.49Å; F143-F258 AromaticContact CD2-CD1 3.81Å; F143-F258 HydrophobicContact CD2-CD1 3.81Å; F143-F258 HydrophobicContact CD2-CE1 4.49Å; F143-F258 HydrophobicContact CE2-CB 4.26Å; F143-F258 AromaticContact CE2-CD1 3.86Å; F143-F258 HydrophobicContact CE2-CD1 3.86Å; F143-F258 WeakPolarHBondContact CE2-O 3.07Å; F143-F258 HydrophobicContact CG-CD1 4.12Å; F143-F258 HydrophobicContact CG-CE1 4.42Å; F143-F258 HydrophobicContact CZ-CD1 4.2Å
144	D	98	Very high	97.8	Very high	89 Å²	89	33.5 Å²	33.5	48%	0.476	18%	0.181	S	C	.	.	H	α-helix	trans	-61.3	-33.1	169.8	-90.8	-5.6	0	0	0	112	E140 C146 D147 R148	E140-D144 PolarHBondContact O-N 2.82Å; D144-C146 PolarHBondContact O-N 3.02Å; D144-D147 PolarHBondContact O-N 2.89Å; D144-R148 WeakPolarHBondContact OD1-CD 3.46Å; D144-R148 WeakPolarHBondContact OD1-CG 3.49Å; D144-R148 IonicContact OD1-CZ 3.6Å; D144-R148 IonicContact OD1-NE 3.49Å; D144-R148 IonicContact OD1-NH1 2.7Å; D144-R148 PolarHBondContact OD1-NH1 2.94Å
145	L	97.4	Very high	97.9	Very high	48 Å²	48	33 Å²	33	25%	0.251	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-11.4	172.8	-172.9	60.7	0	0	0	113.7	D141 L142 F143 K345 L347	D141-L145 WeakPolarHBondContact O-CB 3.21Å; D141-L145 PolarHBondContact O-N 2.95Å; D141-L145 VanDerWaalsContact O-N 3.14Å; L142-L145 HydrophobicContact CD2-CD2 4.49Å; L142-L145 PolarHBondContact O-N 3.4Å; F143-L145 PolarHBondContact O-N 3.49Å; L145-K345 HydrophobicContact CD1-CB 4.35Å; L145-K345 HydrophobicContact CD1-CD 4.36Å; L145-K345 HydrophobicContact CD2-CB 3.96Å; L145-K345 HydrophobicContact CG-CB 4.14Å; L145-K345 HydrophobicContact CG-CD 3.92Å; L145-K345 WeakPolarHBondContact O-CD 3.09Å; L145-K345 PolarHBondContact O-NZ 2.88Å; L145-L347 HydrophobicContact CD2-CD2 3.63Å
146	C	98	Very high	98	Very high	8 Å²	8	32.3 Å²	32.3	5%	0.054	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113	32.4	174.9	-65.9	0	0	0	0	112.4	L142 F143 D144 R148 T149 F150 D341 K345	L142-C146 PolarHBondContact O-N 3.24Å; L142-C146 VanDerWaalsContact O-N 3.17Å; L142-C146 PolarHBondContact O-SG 2.75Å; L142-C146 VanDerWaalsContact O-SG 3.36Å; F143-C146 CarbonylContact O-C 3.5Å; F143-C146 WeakPolarHBondContact O-CA 3.27Å; F143-C146 PolarHBondContact O-N 2.81Å; D144-C146 PolarHBondContact O-N 3.02Å; C146-R148 PolarHBondContact O-N 3.41Å; C146-T149 WeakPolarHBondContact CB-O 3.5Å; C146-T149 PolarHBondContact O-N 3.06Å; C146-T149 VanDerWaalsContact O-N 3.16Å; C146-T149 VanDerWaalsContact O-O 3.06Å; C146-F150 HydrophobicContact CB-CD1 3.85Å; C146-F150 HydrophobicContact CB-CE1 3.73Å; C146-D341 VanDerWaalsContact SG-C 3.58Å; C146-D341 PolarHBondContact SG-O 3.28Å; C146-K345 PolarHBondContact SG-NZ 2.71Å
147	D	97.7	Very high	98.2	Very high	148 Å²	148	31.7 Å²	31.7	79%	0.791	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.7	24.3	176.6	-62.1	-76.4	0	0	0	113.3	F143 D144	F143-D147 PolarHBondContact O-N 3.14Å; D144-D147 PolarHBondContact O-N 2.89Å
148	R	98.3	Very high	98.3	Very high	76 Å²	76	31.3 Å²	31.3	29%	0.287	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	64	37.8	-179.4	-54.8	-176.6	59.5	76.8	13.5	115.2	E140 F143 D144 C146 Y257 G261	E140-R148 IonicContact OE1-CZ 2.71Å; E140-R148 IonicContact OE1-NH1 3.57Å; E140-R148 PolarHBondContact OE1-NH1 2.85Å; E140-R148 IonicContact OE1-NH2 2.76Å; E140-R148 PolarHBondContact OE1-NH2 3.23Å; F143-R148 HydrophobicContact CD1-CB 4.23Å; F143-R148 HydrophobicContact CD1-CG 4.39Å; F143-R148 HydrophobicContact CE1-CB 4.03Å; F143-R148 VanDerWaalsContact CE2-C 3.42Å; F143-R148 HydrophobicContact CZ-CB 4.36Å; F143-R148 WeakPolarHBondContact CZ-O 3.45Å; F143-R148 VanDerWaalsContact O-CA 3.31Å; F143-R148 WeakPolarHBondContact O-CA 3.42Å; F143-R148 PolarHBondContact O-N 3.24Å; D144-R148 WeakPolarHBondContact OD1-CD 3.46Å; D144-R148 WeakPolarHBondContact OD1-CG 3.49Å; D144-R148 IonicContact OD1-CZ 3.6Å; D144-R148 IonicContact OD1-NE 3.49Å; D144-R148 IonicContact OD1-NH1 2.7Å; D144-R148 PolarHBondContact OD1-NH1 2.94Å; C146-R148 PolarHBondContact O-N 3.41Å; R148-Y257 PolarHBondContact NH2-OH 3.28Å; R148-G261 WeakPolarHBondContact O-CA 3.35Å
149	T	98.4	Very high	98.4	Very high	77 Å²	77	30.9 Å²	30.9	47%	0.472	16%	0.163	S	C	.	.			trans	-140.9	148.2	159.8	49.2	0	0	0	0	109.9	C146	C146-T149 WeakPolarHBondContact CB-O 3.5Å; C146-T149 PolarHBondContact O-N 3.06Å; C146-T149 VanDerWaalsContact O-N 3.16Å; C146-T149 VanDerWaalsContact O-O 3.06Å
150	F	98.8	Very high	98.4	Very high	9 Å²	9	32 Å²	32	4%	0.039	17%	0.169	C	C	.	.			trans	-116.2	147.6	167	-71.7	-31.8	0	0	0	111.3	L142 F143 C146 T154 V155 I158 F258 D341 W342	L142-F150 HydrophobicContact CB-CZ 4.15Å; F143-F150 HydrophobicContact CB-CE1 4.3Å; F143-F150 HydrophobicContact CB-CE2 4.17Å; F143-F150 HydrophobicContact CB-CZ 3.78Å; F143-F150 HydrophobicContact CD2-CD1 4.07Å; F143-F150 AromaticContact CD2-CD2 3.93Å; F143-F150 HydrophobicContact CD2-CD2 3.93Å; F143-F150 HydrophobicContact CD2-CE1 4.04Å; F143-F150 AromaticContact CD2-CE2 3.89Å; F143-F150 HydrophobicContact CD2-CE2 3.89Å; F143-F150 HydrophobicContact CD2-CG 4.01Å; F143-F150 AromaticContact CD2-CZ 3.95Å; F143-F150 HydrophobicContact CD2-CZ 3.95Å; F143-F150 HydrophobicContact CE2-CD2 4.42Å; F143-F150 HydrophobicContact CE2-CG 4.4Å; F143-F150 HydrophobicContact CG-CE2 4.47Å; F143-F150 HydrophobicContact CG-CZ 4.38Å; C146-F150 HydrophobicContact CB-CD1 3.85Å; C146-F150 HydrophobicContact CB-CE1 3.73Å; F150-T154 HydrophobicContact CB-CG2 3.88Å; F150-T154 HydrophobicContact CD1-CG2 4.02Å; F150-T154 HydrophobicContact CD2-CG2 4.05Å; F150-T154 HydrophobicContact CG-CG2 3.74Å; F150-V155 HydrophobicContact CB-CG2 3.63Å; F150-V155 HydrophobicContact CD2-CG2 4.48Å; F150-I158 HydrophobicContact CD2-CD1 3.9Å; F150-I158 HydrophobicContact CE2-CD1 3.91Å; F150-F258 HydrophobicContact CB-CB 4.36Å; F150-F258 HydrophobicContact CD2-CB 3.82Å; F150-F258 AromaticContact CD2-CD1 3.69Å; F150-F258 HydrophobicContact CD2-CD1 3.69Å; F150-F258 HydrophobicContact CD2-CD2 4.31Å; F150-F258 HydrophobicContact CD2-CE1 4.31Å; F150-F258 AromaticContact CD2-CG 3.7Å; F150-F258 HydrophobicContact CD2-CG 3.7Å; F150-F258 AromaticContact CE2-CD1 3.69Å; F150-F258 HydrophobicContact CE2-CD1 3.69Å; F150-F258 AromaticContact CE2-CE1 3.86Å; F150-F258 HydrophobicContact CE2-CE1 3.86Å; F150-F258 HydrophobicContact CE2-CG 4.1Å; F150-F258 HydrophobicContact CE2-CZ 4.39Å; F150-F258 PolarHBondContact N-O 3.24Å; F150-D341 WeakPolarHBondContact CA-OD2 3.39Å; F150-D341 WeakPolarHBondContact CB-OD2 3.49Å; F150-D341 HydrophobicContact CD1-CB 4.45Å; F150-D341 WeakPolarHBondContact CD1-OD2 3.49Å; F150-W342 HydrophobicContact CD1-CZ3 4.47Å; F150-W342 AromaticContact CE1-CE3 3.72Å; F150-W342 HydrophobicContact CE1-CE3 3.72Å; F150-W342 AromaticContact CE1-CZ3 3.81Å; F150-W342 HydrophobicContact CE1-CZ3 3.81Å; F150-W342 HydrophobicContact CE2-CZ3 4.06Å; F150-W342 AromaticContact CZ-CE3 3.85Å; F150-W342 HydrophobicContact CZ-CE3 3.85Å; F150-W342 AromaticContact CZ-CZ3 3.58Å; F150-W342 HydrophobicContact CZ-CZ3 3.58Å
151	S	98.8	Very high	98.5	Very high	49 Å²	49	31.5 Å²	31.5	34%	0.343	17%	0.167	S	C	.	.			trans	-67.3	155.1	172.8	73.3	0	0	0	0	111.4	K153 T154 V155 D341	S151-K153 VanDerWaalsContact C-N 3.26Å; S151-K153 PolarHBondContact O-N 2.81Å; S151-T154 PolarHBondContact O-N 3.17Å; S151-T154 VanDerWaalsContact O-N 3.1Å; S151-T154 PolarHBondContact OG-N 2.94Å; S151-T154 PolarHBondContact OG-OG1 3Å; S151-V155 PolarHBondContact O-N 2.88Å; S151-D341 WeakPolarHBondContact CB-OD1 3.41Å; S151-D341 PolarHBondContact N-OD2 2.7Å; S151-D341 PolarHBondContact OG-OD1 3.21Å; S151-D341 PolarHBondContact OG-OD2 3.01Å
152	L	98.9	Very high	98.6	Very high	30 Å²	30	29 Å²	29	16%	0.157	15%	0.154	C	C	.	.	H	α-helix	trans	-54.9	-42.7	176.3	-179.6	63.9	0	0	0	111.6	T154 V155 L156 L259 P297 M300 L328 Y334	L152-T154 PolarHBondContact O-N 3.4Å; L152-V155 PolarHBondContact O-N 3.2Å; L152-L156 HydrophobicContact CD1-CD1 3.96Å; L152-L156 HydrophobicContact CD1-CD2 4.39Å; L152-L156 HydrophobicContact CD1-CG 3.99Å; L152-L156 HydrophobicContact CD2-CD1 4.42Å; L152-L156 HydrophobicContact CG-CD1 3.79Å; L152-L156 HydrophobicContact CG-CG 4.25Å; L152-L156 WeakPolarHBondContact O-CB 3.5Å; L152-L156 VanDerWaalsContact O-CG 3.24Å; L152-L156 WeakPolarHBondContact O-CG 3.33Å; L152-L156 PolarHBondContact O-N 2.74Å; L152-L259 HydrophobicContact CD1-CD2 4.26Å; L152-P297 HydrophobicContact CD1-CG 3.97Å; L152-P297 HydrophobicContact CD2-CG 3.68Å; L152-P297 HydrophobicContact CG-CG 4.5Å; L152-M300 HydrophobicContact CD1-CE 4.06Å; L152-L328 HydrophobicContact CD1-CD2 4.45Å; L152-Y334 HydrophobicContact CB-CE2 4.4Å; L152-Y334 HydrophobicContact CD2-CE2 4.27Å; L152-Y334 HydrophobicContact CG-CE2 4.19Å
153	K	98.8	Very high	98.6	Very high	35 Å²	35	29 Å²	29	15%	0.152	15%	0.154	C	C	.	.	H	α-helix	trans	-55.9	-49.1	175.8	-172	-168.9	170.6	-167.1	0	111.7	S151 L156 M157 F329 Y334 I335 D337	S151-K153 VanDerWaalsContact C-N 3.26Å; S151-K153 PolarHBondContact O-N 2.81Å; K153-L156 PolarHBondContact O-N 2.7Å; K153-M157 HydrophobicContact CD-CE 4.45Å; K153-M157 HydrophobicContact CG-CE 4.16Å; K153-M157 WeakPolarHBondContact O-CG 3.47Å; K153-M157 PolarHBondContact O-N 3.38Å; K153-M157 VanDerWaalsContact O-N 3.12Å; K153-F329 HydrophobicContact CG-CE2 3.72Å; K153-F329 HydrophobicContact CG-CZ 4.22Å; K153-Y334 HydrophobicContact CB-CD1 4.36Å; K153-Y334 HydrophobicContact CB-CD2 3.76Å; K153-Y334 HydrophobicContact CB-CE1 4.33Å; K153-Y334 HydrophobicContact CB-CE2 3.72Å; K153-Y334 HydrophobicContact CB-CG 4.09Å; K153-Y334 HydrophobicContact CD-CG 4.39Å; K153-Y334 HydrophobicContact CG-CD1 4.35Å; K153-Y334 HydrophobicContact CG-CD2 3.89Å; K153-Y334 HydrophobicContact CG-CE2 4.36Å; K153-Y334 HydrophobicContact CG-CG 3.88Å; K153-I335 WeakPolarHBondContact CE-O 3.47Å; K153-D337 WeakPolarHBondContact CE-OD1 3.21Å; K153-D337 IonicContact NZ-OD1 3.51Å; K153-D337 PolarHBondContact NZ-OD1 2.84Å; K153-D337 IonicContact NZ-OD2 3.18Å; K153-D337 PolarHBondContact NZ-OD2 3.37Å
154	T	98.9	Very high	98.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.7	-46.1	178.3	-74.4	0	0	0	0	111.6	F150 S151 L152 L156 M157 I158 Y340 D341 W342	F150-T154 HydrophobicContact CB-CG2 3.88Å; F150-T154 HydrophobicContact CD1-CG2 4.02Å; F150-T154 HydrophobicContact CD2-CG2 4.05Å; F150-T154 HydrophobicContact CG-CG2 3.74Å; S151-T154 PolarHBondContact O-N 3.17Å; S151-T154 VanDerWaalsContact O-N 3.1Å; S151-T154 PolarHBondContact OG-N 2.94Å; S151-T154 PolarHBondContact OG-OG1 3Å; L152-T154 PolarHBondContact O-N 3.4Å; T154-L156 PolarHBondContact O-N 3.25Å; T154-M157 PolarHBondContact O-N 2.79Å; T154-I158 HydrophobicContact CG2-CD1 3.77Å; T154-I158 WeakPolarHBondContact O-CD1 3.11Å; T154-I158 VanDerWaalsContact O-CG1 3.25Å; T154-I158 WeakPolarHBondContact O-CG1 3.42Å; T154-I158 PolarHBondContact O-N 3.38Å; T154-Y340 HydrophobicContact CG2-CD1 4.25Å; T154-Y340 WeakPolarHBondContact OG1-CA 3.46Å; T154-D341 VanDerWaalsContact CB-OD2 3.25Å; T154-D341 WeakPolarHBondContact CB-OD2 3.45Å; T154-D341 WeakPolarHBondContact CG2-OD2 3.42Å; T154-D341 PolarHBondContact OG1-N 3.42Å; T154-D341 PolarHBondContact OG1-OD1 3.09Å; T154-D341 PolarHBondContact OG1-OD2 3.29Å; T154-W342 HydrophobicContact CG2-CE3 4.37Å; T154-W342 HydrophobicContact CG2-CH2 4.27Å; T154-W342 HydrophobicContact CG2-CZ3 3.67Å
155	V	98.9	Very high	98.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.6	-38.2	179.6	177.7	0	0	0	0	112.2	F150 S151 L152 I158 A159 F255 F258 L259	F150-V155 HydrophobicContact CB-CG2 3.63Å; F150-V155 HydrophobicContact CD2-CG2 4.48Å; S151-V155 PolarHBondContact O-N 2.88Å; L152-V155 PolarHBondContact O-N 3.2Å; V155-I158 PolarHBondContact O-N 3.32Å; V155-A159 VanDerWaalsContact O-CB 3.31Å; V155-A159 WeakPolarHBondContact O-CB 3.47Å; V155-A159 PolarHBondContact O-N 2.95Å; V155-F255 HydrophobicContact CG1-CB 4.06Å; V155-F258 HydrophobicContact CG2-CB 3.71Å; V155-L259 HydrophobicContact CB-CD2 3.97Å; V155-L259 HydrophobicContact CB-CG 4.28Å; V155-L259 HydrophobicContact CG1-CD1 4.37Å; V155-L259 HydrophobicContact CG1-CD2 4.26Å; V155-L259 HydrophobicContact CG1-CG 4.07Å; V155-L259 HydrophobicContact CG2-CD2 3.75Å; V155-L259 HydrophobicContact CG2-CG 4.02Å
156	L	98.9	Very high	98.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-67.1	-43.9	176.9	-67.3	172	0	0	0	112.2	L152 K153 T154 I158 A159 I160 M300 F325 L328 F329 Y334	L152-L156 HydrophobicContact CD1-CD1 3.96Å; L152-L156 HydrophobicContact CD1-CD2 4.39Å; L152-L156 HydrophobicContact CD1-CG 3.99Å; L152-L156 HydrophobicContact CD2-CD1 4.42Å; L152-L156 HydrophobicContact CG-CD1 3.79Å; L152-L156 HydrophobicContact CG-CG 4.25Å; L152-L156 WeakPolarHBondContact O-CB 3.5Å; L152-L156 VanDerWaalsContact O-CG 3.24Å; L152-L156 WeakPolarHBondContact O-CG 3.33Å; L152-L156 PolarHBondContact O-N 2.74Å; K153-L156 PolarHBondContact O-N 2.7Å; T154-L156 PolarHBondContact O-N 3.25Å; L156-I158 VanDerWaalsContact C-N 3.26Å; L156-I158 PolarHBondContact O-N 3.38Å; L156-A159 PolarHBondContact O-N 2.97Å; L156-I160 WeakPolarHBondContact O-CD1 3.41Å; L156-I160 WeakPolarHBondContact O-CG1 3.36Å; L156-I160 PolarHBondContact O-N 2.81Å; L156-M300 HydrophobicContact CD2-CE 3.77Å; L156-F325 HydrophobicContact CD2-CB 3.69Å; L156-F325 HydrophobicContact CD2-CD1 3.55Å; L156-F325 HydrophobicContact CD2-CE1 4.41Å; L156-F325 HydrophobicContact CD2-CG 3.77Å; L156-L328 HydrophobicContact CD1-CD2 4.07Å; L156-L328 HydrophobicContact CD1-CG 4.08Å; L156-L328 HydrophobicContact CD2-CD2 3.96Å; L156-F329 HydrophobicContact CB-CD2 3.79Å; L156-F329 HydrophobicContact CB-CE2 4.49Å; L156-F329 HydrophobicContact CD1-CB 4.13Å; L156-F329 HydrophobicContact CD1-CD2 4.02Å; L156-Y334 HydrophobicContact CD1-CD2 4.42Å; L156-Y334 HydrophobicContact CD1-CE2 4.35Å
157	M	98.8	Very high	98.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.3	-30.9	174.6	-67.4	-171	-61.7	0	0	112.9	K153 T154 Q161 F329 F336 Y340	K153-M157 HydrophobicContact CD-CE 4.45Å; K153-M157 HydrophobicContact CG-CE 4.16Å; K153-M157 WeakPolarHBondContact O-CG 3.47Å; K153-M157 PolarHBondContact O-N 3.38Å; K153-M157 VanDerWaalsContact O-N 3.12Å; T154-M157 PolarHBondContact O-N 2.79Å; M157-Q161 PolarHBondContact O-NE2 3.18Å; M157-Q161 VanDerWaalsContact O-NE2 3.07Å; M157-F329 HydrophobicContact CG-CE2 3.59Å; M157-F329 HydrophobicContact CG-CZ 3.86Å; M157-F329 HydrophobicContact SD-CE2 4.32Å; M157-F329 HydrophobicContact SD-CZ 4.15Å; M157-F336 HydrophobicContact CB-CE2 4.12Å; M157-F336 HydrophobicContact CB-CZ 4.01Å; M157-F336 HydrophobicContact CG-CD2 3.99Å; M157-F336 HydrophobicContact CG-CE1 4.43Å; M157-F336 HydrophobicContact CG-CE2 3.75Å; M157-F336 HydrophobicContact CG-CG 4.44Å; M157-F336 HydrophobicContact CG-CZ 3.99Å; M157-F336 HydrophobicContact SD-CD1 4.49Å; M157-F336 HydrophobicContact SD-CG 4.49Å; M157-Y340 HydrophobicContact CB-CD1 4.37Å; M157-Y340 HydrophobicContact CB-CE1 3.8Å; M157-Y340 HydrophobicContact CE-CD1 3.69Å; M157-Y340 HydrophobicContact CE-CE1 4.04Å; M157-Y340 HydrophobicContact CE-CG 4.2Å
158	I	98.9	Very high	98.8	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-69.2	-51.7	170.3	-68.3	164.1	0	0	0	110.3	L139 F150 T154 V155 L156 I160 Q161 L162 I197 F258 Y340 W342	L139-I158 HydrophobicContact CD1-CG2 3.78Å; L139-I158 HydrophobicContact CD2-CD1 4.24Å; L139-I158 HydrophobicContact CD2-CG1 4.46Å; F150-I158 HydrophobicContact CD2-CD1 3.9Å; F150-I158 HydrophobicContact CE2-CD1 3.91Å; T154-I158 HydrophobicContact CG2-CD1 3.77Å; T154-I158 WeakPolarHBondContact O-CD1 3.11Å; T154-I158 VanDerWaalsContact O-CG1 3.25Å; T154-I158 WeakPolarHBondContact O-CG1 3.42Å; T154-I158 PolarHBondContact O-N 3.38Å; V155-I158 PolarHBondContact O-N 3.32Å; L156-I158 VanDerWaalsContact C-N 3.26Å; L156-I158 PolarHBondContact O-N 3.38Å; I158-I160 PolarHBondContact O-N 3.45Å; I158-Q161 PolarHBondContact O-N 3.37Å; I158-L162 HydrophobicContact CG2-CD1 3.67Å; I158-L162 HydrophobicContact CG2-CG 4Å; I158-L162 WeakPolarHBondContact O-CG 3.29Å; I158-L162 PolarHBondContact O-N 3.23Å; I158-I197 HydrophobicContact CB-CD1 4.02Å; I158-I197 HydrophobicContact CG1-CD1 3.72Å; I158-I197 HydrophobicContact CG2-CD1 4.09Å; I158-F258 HydrophobicContact CG2-CE2 4.34Å; I158-Y340 HydrophobicContact CG1-CE1 4.44Å; I158-W342 HydrophobicContact CD1-CH2 4.02Å; I158-W342 HydrophobicContact CD1-CZ3 4.13Å; I158-W342 HydrophobicContact CG1-CH2 4.3Å
159	A	98.9	Very high	98.8	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-61	-45	-172.6	0	0	0	0	0	112.9	V155 L156 Q161 L162 I163 F255 F325	V155-A159 VanDerWaalsContact O-CB 3.31Å; V155-A159 WeakPolarHBondContact O-CB 3.47Å; V155-A159 PolarHBondContact O-N 2.95Å; L156-A159 PolarHBondContact O-N 2.97Å; A159-Q161 VanDerWaalsContact C-N 3.3Å; A159-Q161 PolarHBondContact O-N 3.21Å; A159-L162 PolarHBondContact O-N 2.99Å; A159-I163 WeakPolarHBondContact O-CD1 3.24Å; A159-I163 VanDerWaalsContact O-CG1 3.27Å; A159-I163 WeakPolarHBondContact O-CG1 3.34Å; A159-I163 PolarHBondContact O-N 3.27Å; A159-F255 HydrophobicContact CB-CD1 4.04Å; A159-F255 HydrophobicContact CB-CD2 4.17Å; A159-F255 HydrophobicContact CB-CE1 3.66Å; A159-F255 HydrophobicContact CB-CE2 3.81Å; A159-F255 HydrophobicContact CB-CG 4.3Å; A159-F255 HydrophobicContact CB-CZ 3.54Å; A159-F325 HydrophobicContact CB-CD2 3.68Å; A159-F325 HydrophobicContact CB-CE2 3.84Å; A159-F325 HydrophobicContact CB-CG 4.48Å
160	I	98.8	Very high	98.9	Very high	23 Å²	23	14.8 Å²	14.8	12%	0.118	8%	0.078	C	C	.	.	H	α-helix	trans	-58.6	-41.6	178	-67.7	161	0	0	0	111.1	L156 I158 T164 F325 T326 F336	L156-I160 WeakPolarHBondContact O-CD1 3.41Å; L156-I160 WeakPolarHBondContact O-CG1 3.36Å; L156-I160 PolarHBondContact O-N 2.81Å; I158-I160 PolarHBondContact O-N 3.45Å; I160-T164 PolarHBondContact O-N 3.21Å; I160-T164 PolarHBondContact O-OG1 3.42Å; I160-F325 HydrophobicContact CD1-CB 4.42Å; I160-F325 HydrophobicContact CG1-CB 4.05Å; I160-T326 HydrophobicContact CD1-CG2 3.76Å; I160-T326 HydrophobicContact CG1-CG2 4.25Å; I160-F336 HydrophobicContact CD1-CE2 4.04Å
161	Q	98.8	Very high	98.8	Very high	17 Å²	17	18.7 Å²	18.7	8%	0.079	10%	0.103	C	C	.	.	H	α-helix	trans	-68.8	-46.1	174.1	-78.1	178.9	83	0	0	112.3	M157 I158 A159 T164 R165 I197 Y340	M157-Q161 PolarHBondContact O-NE2 3.18Å; M157-Q161 VanDerWaalsContact O-NE2 3.07Å; I158-Q161 PolarHBondContact O-N 3.37Å; A159-Q161 VanDerWaalsContact C-N 3.3Å; A159-Q161 PolarHBondContact O-N 3.21Å; Q161-T164 CarbonylContact O-C 3.52Å; Q161-T164 WeakPolarHBondContact O-CA 3.38Å; Q161-T164 WeakPolarHBondContact O-CB 3.37Å; Q161-T164 PolarHBondContact O-N 3.08Å; Q161-T164 VanDerWaalsContact O-N 3.07Å; Q161-R165 WeakPolarHBondContact O-CG 3.19Å; Q161-R165 PolarHBondContact O-N 3.25Å; Q161-I197 HydrophobicContact CB-CD1 4.39Å; Q161-Y340 PolarHBondContact NE2-OH 3.37Å
162	L	98.9	Very high	98.8	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-70.3	-33.5	-174.1	-68.2	-167.5	0	0	0	113.6	L139 I158 A159 T164 R165 M166 F184 I197 L251 M254 F255	L139-L162 HydrophobicContact CD1-CD1 4.11Å; I158-L162 HydrophobicContact CG2-CD1 3.67Å; I158-L162 HydrophobicContact CG2-CG 4Å; I158-L162 WeakPolarHBondContact O-CG 3.29Å; I158-L162 PolarHBondContact O-N 3.23Å; A159-L162 PolarHBondContact O-N 2.99Å; L162-T164 VanDerWaalsContact C-N 3.25Å; L162-T164 PolarHBondContact O-N 3.24Å; L162-R165 HydrophobicContact CD2-CG 4.37Å; L162-R165 PolarHBondContact O-N 2.9Å; L162-M166 WeakPolarHBondContact O-CB 3.4Å; L162-M166 PolarHBondContact O-N 3.29Å; L162-F184 HydrophobicContact CD1-CD1 4.16Å; L162-F184 HydrophobicContact CD1-CD2 4.07Å; L162-F184 HydrophobicContact CD1-CE1 4.35Å; L162-F184 HydrophobicContact CD1-CE2 4.29Å; L162-F184 HydrophobicContact CD1-CG 4Å; L162-F184 HydrophobicContact CD1-CZ 4.42Å; L162-F184 HydrophobicContact CD2-CB 4.41Å; L162-F184 HydrophobicContact CD2-CD1 3.36Å; L162-F184 HydrophobicContact CD2-CE1 3.7Å; L162-F184 HydrophobicContact CD2-CG 3.91Å; L162-F184 HydrophobicContact CG-CD1 4.41Å; L162-I197 HydrophobicContact CD2-CB 4.37Å; L162-I197 HydrophobicContact CD2-CG2 3.65Å; L162-L251 HydrophobicContact CB-CD1 4.41Å; L162-L251 HydrophobicContact CB-CD2 3.94Å; L162-L251 HydrophobicContact CD1-CD2 3.99Å; L162-M254 HydrophobicContact CD1-CE 3.34Å; L162-F255 HydrophobicContact CB-CE1 4.5Å; L162-F255 HydrophobicContact CD1-CE1 4.4Å
163	I	98.9	Very high	98.8	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-59	-42.3	168.3	-65.3	161.5	0	0	0	109.7	A159 M166 E167 Y303 Y318 L321 R322 F325	A159-I163 WeakPolarHBondContact O-CD1 3.24Å; A159-I163 VanDerWaalsContact O-CG1 3.27Å; A159-I163 WeakPolarHBondContact O-CG1 3.34Å; A159-I163 PolarHBondContact O-N 3.27Å; I163-M166 PolarHBondContact O-N 2.69Å; I163-E167 WeakPolarHBondContact O-CB 3.39Å; I163-E167 PolarHBondContact O-N 2.71Å; I163-Y303 HydrophobicContact CD1-CE2 3.87Å; I163-Y303 HydrophobicContact CG1-CE2 4.22Å; I163-Y318 HydrophobicContact CG2-CD1 4.26Å; I163-L321 HydrophobicContact CD1-CB 4.24Å; I163-L321 HydrophobicContact CG2-CB 4.46Å; I163-R322 HydrophobicContact CB-CG 4.32Å; I163-R322 HydrophobicContact CG2-CG 3.98Å; I163-F325 HydrophobicContact CD1-CD2 3.81Å; I163-F325 HydrophobicContact CD1-CE2 3.96Å
164	T	98.8	Very high	98.8	Very high	54 Å²	54	20 Å²	20	33%	0.331	10%	0.103	S	C	.	.	H	α-helix	trans	-68.8	-38.3	178.6	-53.8	0	0	0	0	112.8	I160 Q161 L162 F168 R322	I160-T164 PolarHBondContact O-N 3.21Å; I160-T164 PolarHBondContact O-OG1 3.42Å; Q161-T164 CarbonylContact O-C 3.52Å; Q161-T164 WeakPolarHBondContact O-CA 3.38Å; Q161-T164 WeakPolarHBondContact O-CB 3.37Å; Q161-T164 PolarHBondContact O-N 3.08Å; Q161-T164 VanDerWaalsContact O-N 3.07Å; L162-T164 VanDerWaalsContact C-N 3.25Å; L162-T164 PolarHBondContact O-N 3.24Å; T164-F168 WeakPolarHBondContact O-CB 3.43Å; T164-F168 PolarHBondContact O-N 2.83Å; T164-R322 PolarHBondContact OG1-NH1 3.34Å
165	R	98.8	Very high	98.8	Very high	15 Å²	15	20 Å²	20	6%	0.057	10%	0.103	C	C	.	.	H	α-helix	trans	-65	-41	172.2	-56.2	-43.5	172.6	-148.6	-14.3	111.3	E113 Q161 L162 F168 V169 I197 I199	E113-R165 VanDerWaalsContact CD-NH2 3.34Å; E113-R165 PolarHBondContact O-NH1 3.01Å; E113-R165 IonicContact OE1-CZ 3.55Å; E113-R165 IonicContact OE1-NH1 3.19Å; E113-R165 PolarHBondContact OE1-NH1 2.76Å; E113-R165 IonicContact OE1-NH2 3.34Å; E113-R165 PolarHBondContact OE1-NH2 3.16Å; E113-R165 IonicContact OE2-CZ 2.75Å; E113-R165 IonicContact OE2-NH1 2.71Å; E113-R165 PolarHBondContact OE2-NH1 2.8Å; E113-R165 IonicContact OE2-NH2 3.94Å; E113-R165 PolarHBondContact OE2-NH2 3.45Å; Q161-R165 WeakPolarHBondContact O-CG 3.19Å; Q161-R165 PolarHBondContact O-N 3.25Å; L162-R165 HydrophobicContact CD2-CG 4.37Å; L162-R165 PolarHBondContact O-N 2.9Å; R165-F168 PolarHBondContact O-N 2.83Å; R165-V169 WeakPolarHBondContact O-CG2 3.32Å; R165-V169 PolarHBondContact O-N 2.76Å; R165-V169 VanDerWaalsContact O-N 3.12Å; R165-I197 PolarHBondContact NE-O 3.47Å; R165-I199 HydrophobicContact CB-CG2 4.27Å
166	M	98.9	Very high	98.8	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-70.1	-42.2	-179.3	-162.7	58.5	70.3	0	0	112	L162 I163 F168 V169 H170 Y176 V179 I199 D247 L248 L251	L162-M166 WeakPolarHBondContact O-CB 3.4Å; L162-M166 PolarHBondContact O-N 3.29Å; I163-M166 PolarHBondContact O-N 2.69Å; M166-F168 VanDerWaalsContact C-N 3.31Å; M166-F168 PolarHBondContact O-N 3.4Å; M166-V169 PolarHBondContact O-N 2.73Å; M166-H170 WeakPolarHBondContact O-CB 3.4Å; M166-H170 PolarHBondContact O-CD2 2.9Å; M166-H170 PolarHBondContact O-N 2.81Å; M166-Y176 HydrophobicContact CE-CD1 3.94Å; M166-Y176 HydrophobicContact CE-CG 4.24Å; M166-V179 HydrophobicContact CE-CG2 3.54Å; M166-I199 HydrophobicContact CE-CD1 4.36Å; M166-D247 HydrophobicContact CE-CB 4.05Å; M166-D247 HydrophobicContact CG-CB 4.05Å; M166-D247 HydrophobicContact SD-CB 3.72Å; M166-L248 HydrophobicContact CB-CD2 4.37Å; M166-L248 HydrophobicContact CG-CD2 4.14Å; M166-L251 HydrophobicContact CB-CD1 4.03Å; M166-L251 HydrophobicContact CE-CD1 4.39Å; M166-L251 HydrophobicContact CG-CD1 4.38Å
167	E	98.9	Very high	98.8	Very high	35 Å²	35	22.1 Å²	22.1	16%	0.164	11%	0.111	C	C	.	.	H	α-helix	trans	-56.4	-45.9	170.2	-179.4	171.5	-149.6	0	0	111.4	I163 V169 H170 T171 Y318 R322	I163-E167 WeakPolarHBondContact O-CB 3.39Å; I163-E167 PolarHBondContact O-N 2.71Å; E167-V169 VanDerWaalsContact C-N 3.35Å; E167-V169 PolarHBondContact O-N 3.05Å; E167-H170 CarbonylContact O-C 3.35Å; E167-H170 WeakPolarHBondContact O-CA 3.36Å; E167-H170 WeakPolarHBondContact O-CB 3.07Å; E167-H170 PolarHBondContact O-N 2.92Å; E167-T171 HydrophobicContact CG-CG2 4.21Å; E167-T171 WeakPolarHBondContact O-CG2 3.34Å; E167-T171 PolarHBondContact O-N 2.8Å; E167-Y318 HydrophobicContact CB-CD1 3.71Å; E167-Y318 HydrophobicContact CB-CD2 4.01Å; E167-Y318 HydrophobicContact CB-CE1 4Å; E167-Y318 HydrophobicContact CB-CE2 4.29Å; E167-Y318 HydrophobicContact CB-CG 3.71Å; E167-Y318 HydrophobicContact CG-CD1 4.22Å; E167-Y318 HydrophobicContact CG-CD2 3.56Å; E167-Y318 HydrophobicContact CG-CE1 4.44Å; E167-Y318 HydrophobicContact CG-CE2 3.82Å; E167-Y318 HydrophobicContact CG-CG 3.78Å; E167-Y318 WeakPolarHBondContact OE1-CD2 3.24Å; E167-R322 IonicContact OE1-NH2 2.67Å; E167-R322 IonicContact OE2-CZ 2.83Å; E167-R322 IonicContact OE2-NH1 3.19Å; E167-R322 PolarHBondContact OE2-NH1 3.43Å; E167-R322 IonicContact OE2-NH2 3.8Å; E167-R322 PolarHBondContact OE2-NH2 3.34Å
168	F	98.9	Very high	98.7	Very high	40 Å²	40	22.4 Å²	22.4	18%	0.175	11%	0.112	C	C	.	.	H	α-helix	trans	-56.6	-47.7	177.9	177.7	-100.4	0	0	0	111.9	L109 S112 V115 T164 R165 M166 H170 T171 R172	L109-F168 HydrophobicContact CB-CE1 4.21Å; L109-F168 HydrophobicContact CD2-CD1 4.25Å; L109-F168 HydrophobicContact CD2-CE1 3.89Å; L109-F168 WeakPolarHBondContact O-CZ 3.41Å; S112-F168 WeakPolarHBondContact OG-CE2 3.44Å; S112-F168 WeakPolarHBondContact OG-CZ 3.5Å; V115-F168 HydrophobicContact CG2-CD1 4.17Å; V115-F168 HydrophobicContact CG2-CE1 3.86Å; T164-F168 WeakPolarHBondContact O-CB 3.43Å; T164-F168 PolarHBondContact O-N 2.83Å; R165-F168 PolarHBondContact O-N 2.83Å; M166-F168 VanDerWaalsContact C-N 3.31Å; M166-F168 PolarHBondContact O-N 3.4Å; F168-H170 VanDerWaalsContact C-N 3.31Å; F168-H170 PolarHBondContact O-N 2.84Å; F168-T171 PolarHBondContact O-N 3.01Å; F168-T171 PolarHBondContact O-OG1 2.94Å; F168-R172 HydrophobicContact CE1-CG 4.16Å; F168-R172 HydrophobicContact CE2-CG 4.31Å; F168-R172 HydrophobicContact CZ-CG 3.98Å; F168-R172 WeakPolarHBondContact O-CG 3.33Å; F168-R172 PolarHBondContact O-N 3.04Å; F168-R172 VanDerWaalsContact O-N 3.16Å
169	V	98.8	Very high	98.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-58.2	-43.6	174.3	176.4	0	0	0	0	111.1	L109 R165 M166 E167 T171 R172 L174 I199 F202	L109-V169 HydrophobicContact CD2-CB 4.48Å; L109-V169 HydrophobicContact CD2-CG2 4.05Å; R165-V169 WeakPolarHBondContact O-CG2 3.32Å; R165-V169 PolarHBondContact O-N 2.76Å; R165-V169 VanDerWaalsContact O-N 3.12Å; M166-V169 PolarHBondContact O-N 2.73Å; E167-V169 VanDerWaalsContact C-N 3.35Å; E167-V169 PolarHBondContact O-N 3.05Å; V169-T171 PolarHBondContact O-N 3.49Å; V169-R172 CarbonylContact O-C 3.53Å; V169-R172 WeakPolarHBondContact O-CB 3.41Å; V169-R172 PolarHBondContact O-N 3.01Å; V169-R172 VanDerWaalsContact O-N 3.12Å; V169-L174 CarbonylContact C-O 3.5Å; V169-L174 HydrophobicContact CG1-CB 3.71Å; V169-L174 PolarHBondContact O-N 3.12Å; V169-I199 HydrophobicContact CG2-CD1 4.28Å; V169-F202 HydrophobicContact CG1-CE1 4.11Å; V169-F202 HydrophobicContact CG2-CE1 3.77Å; V169-F202 HydrophobicContact CG2-CZ 3.97Å
170	H	98.8	Very high	98.7	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.009	12%	0.117	C	C	.	.	H	α-helix	trans	-66.6	-33.6	178.2	-65.2	176.3	0	0	0	113.7	M166 E167 F168 R172 S173 L174 Y208 R244 D247 Y318	M166-H170 WeakPolarHBondContact O-CB 3.4Å; M166-H170 PolarHBondContact O-CD2 2.9Å; M166-H170 PolarHBondContact O-N 2.81Å; E167-H170 CarbonylContact O-C 3.35Å; E167-H170 WeakPolarHBondContact O-CA 3.36Å; E167-H170 WeakPolarHBondContact O-CB 3.07Å; E167-H170 PolarHBondContact O-N 2.92Å; F168-H170 VanDerWaalsContact C-N 3.31Å; F168-H170 PolarHBondContact O-N 2.84Å; H170-R172 VanDerWaalsContact C-N 3.28Å; H170-R172 PolarHBondContact O-N 3.34Å; H170-S173 PolarHBondContact O-N 3.46Å; H170-L174 WeakPolarHBondContact CA-O 3.39Å; H170-L174 PolarHBondContact CD2-O 3.31Å; H170-L174 VanDerWaalsContact CD2-O 3.27Å; H170-Y208 VanDerWaalsContact O-CE1 3.27Å; H170-Y208 WeakPolarHBondContact O-CE1 3.24Å; H170-Y208 PolarHBondContact O-OH 3.12Å; H170-R244 HydrophobicContact CB-CG 4.28Å; H170-R244 VanDerWaalsContact CE1-CA 3.49Å; H170-R244 WeakPolarHBondContact CE1-CA 3.26Å; H170-R244 PolarHBondContact CE1-O 3.24Å; H170-R244 VanDerWaalsContact CE1-O 3.3Å; H170-D247 IonicContact NE2-OD2 3.97Å; H170-Y318 WeakPolarHBondContact CB-OH 3.41Å; H170-Y318 AromaticContact ND1-CE1 3.69Å; H170-Y318 AromaticContact ND1-CZ 3.64Å; H170-Y318 PolarHBondContact ND1-OH 2.93Å
171	T	98.3	Very high	98.6	Very high	91 Å²	91	22.3 Å²	22.3	56%	0.558	11%	0.111	S	C	*	.	H	α-helix	trans	-69.1	-27.3	172	64.8	0	0	0	0	112.3	E167 F168 V169 S173	E167-T171 HydrophobicContact CG-CG2 4.21Å; E167-T171 WeakPolarHBondContact O-CG2 3.34Å; E167-T171 PolarHBondContact O-N 2.8Å; F168-T171 PolarHBondContact O-N 3.01Å; F168-T171 PolarHBondContact O-OG1 2.94Å; V169-T171 PolarHBondContact O-N 3.49Å; T171-S173 PolarHBondContact O-N 3.1Å
172	R	98.3	Very high	98.6	Very high	104 Å²	104	24.4 Å²	24.4	39%	0.392	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	15.1	174.3	-63.5	-65.5	-162.9	-168.6	2	113.6	Q108 L109 F168 V169 H170 L174	Q108-R172 PolarHBondContact NE2-O 3.47Å; Q108-R172 WeakPolarHBondContact O-CD 3.31Å; L109-R172 HydrophobicContact CD2-CB 3.97Å; L109-R172 HydrophobicContact CD2-CG 4.03Å; L109-R172 PolarHBondContact O-NE 2.97Å; L109-R172 VanDerWaalsContact O-NE 3.1Å; L109-R172 PolarHBondContact O-NH2 2.87Å; F168-R172 HydrophobicContact CE1-CG 4.16Å; F168-R172 HydrophobicContact CE2-CG 4.31Å; F168-R172 HydrophobicContact CZ-CG 3.98Å; F168-R172 WeakPolarHBondContact O-CG 3.33Å; F168-R172 PolarHBondContact O-N 3.04Å; F168-R172 VanDerWaalsContact O-N 3.16Å; V169-R172 CarbonylContact O-C 3.53Å; V169-R172 WeakPolarHBondContact O-CB 3.41Å; V169-R172 PolarHBondContact O-N 3.01Å; V169-R172 VanDerWaalsContact O-N 3.12Å; H170-R172 VanDerWaalsContact C-N 3.28Å; H170-R172 PolarHBondContact O-N 3.34Å; R172-L174 PolarHBondContact O-N 3.24Å
173	S	98.4	Very high	98.5	Very high	38 Å²	38	24.7 Å²	24.7	27%	0.266	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	16	179.4	-61.2	0	0	0	0	115.2	H170 T171 E207 Y208	H170-S173 PolarHBondContact O-N 3.46Å; T171-S173 PolarHBondContact O-N 3.1Å; S173-E207 WeakPolarHBondContact O-CA 3.5Å; S173-Y208 VanDerWaalsContact C-CE1 3.41Å; S173-Y208 WeakPolarHBondContact O-CD1 3.38Å; S173-Y208 PolarHBondContact O-N 2.88Å
174	L	98.8	Very high	98.5	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	150	178.1	-61.9	176.9	0	0	0	111.5	F105 L109 V169 H170 R172 K206 E207 Y208	F105-L174 HydrophobicContact CB-CD1 3.9Å; F105-L174 HydrophobicContact CD1-CD1 3.97Å; F105-L174 HydrophobicContact CD1-CD2 3.5Å; F105-L174 VanDerWaalsContact CD1-CD2 3.5Å; F105-L174 HydrophobicContact CD1-CG 4.4Å; F105-L174 HydrophobicContact CE1-CD2 3.56Å; F105-L174 HydrophobicContact CG-CD1 4.06Å; F105-L174 HydrophobicContact CG-CD2 4.22Å; F105-L174 HydrophobicContact CZ-CD2 4.29Å; L109-L174 HydrophobicContact CD2-CD1 4.18Å; L109-L174 HydrophobicContact CG-CD1 4.19Å; V169-L174 CarbonylContact C-O 3.5Å; V169-L174 HydrophobicContact CG1-CB 3.71Å; V169-L174 PolarHBondContact O-N 3.12Å; H170-L174 WeakPolarHBondContact CA-O 3.39Å; H170-L174 PolarHBondContact CD2-O 3.31Å; H170-L174 VanDerWaalsContact CD2-O 3.27Å; R172-L174 PolarHBondContact O-N 3.24Å; L174-K206 CarbonylContact C-O 3.54Å; L174-K206 VanDerWaalsContact CA-O 3.31Å; L174-K206 WeakPolarHBondContact CA-O 3.37Å; L174-E207 HydrophobicContact CD2-CB 4.48Å; L174-E207 HydrophobicContact CD2-CG 3.69Å; L174-Y208 VanDerWaalsContact C-CD1 3.44Å; L174-Y208 WeakPolarHBondContact O-CD1 3.33Å; L174-Y208 WeakPolarHBondContact O-CE1 3.36Å
175	I	98.8	Very high	98.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	150.8	158.6	52.6	176.5	0	0	0	108.3	R177 A205 K206 Y208 Q242 R244 D247	I175-R177 HydrophobicContact CB-CG 4.35Å; I175-R177 HydrophobicContact CD1-CG 4.05Å; I175-R177 HydrophobicContact CG1-CG 3.95Å; I175-A205 CarbonylContact O-C 3.42Å; I175-A205 VanDerWaalsContact O-CA 3.27Å; I175-A205 WeakPolarHBondContact O-CA 3.43Å; I175-A205 WeakPolarHBondContact O-CB 3.41Å; I175-K206 HydrophobicContact CD1-CB 4.48Å; I175-K206 HydrophobicContact CG1-CB 4.05Å; I175-K206 WeakPolarHBondContact CG1-O 3.5Å; I175-K206 PolarHBondContact N-O 3.35Å; I175-K206 PolarHBondContact O-N 3.01Å; I175-Y208 HydrophobicContact CG2-CD1 3.73Å; I175-Y208 HydrophobicContact CG2-CG 3.85Å; I175-Q242 HydrophobicContact CD1-CB 4.29Å; I175-Q242 WeakPolarHBondContact CD1-O 3.33Å; I175-R244 HydrophobicContact CG2-CG 4.11Å; I175-D247 WeakPolarHBondContact CB-OD2 3.31Å
176	Y	98.7	Very high	98.4	Very high	1 Å²	1	22.9 Å²	22.9	0%	0.004	11%	0.112	C	C	.	.			trans	-97	-43.8	-162.9	179.5	-110.7	0	0	0	113.5	M166 D178 V179 N183 I199 I200 F202 D247	M166-Y176 HydrophobicContact CE-CD1 3.94Å; M166-Y176 HydrophobicContact CE-CG 4.24Å; Y176-D178 VanDerWaalsContact C-N 3.26Å; Y176-D178 VanDerWaalsContact CE1-O 3.3Å; Y176-D178 WeakPolarHBondContact CE1-O 3.38Å; Y176-D178 PolarHBondContact O-N 3.16Å; Y176-D178 VanDerWaalsContact O-N 3.14Å; Y176-V179 HydrophobicContact CD1-CG2 3.8Å; Y176-V179 HydrophobicContact CE1-CG2 4.35Å; Y176-N183 WeakPolarHBondContact OH-CB 3.45Å; Y176-N183 PolarHBondContact OH-ND2 3.35Å; Y176-I199 HydrophobicContact CD1-CD1 4.03Å; Y176-I199 HydrophobicContact CD2-CD1 3.68Å; Y176-I199 HydrophobicContact CD2-CG1 4.28Å; Y176-I199 HydrophobicContact CE1-CD1 4.04Å; Y176-I199 HydrophobicContact CE1-CG1 4.39Å; Y176-I199 HydrophobicContact CE2-CD1 3.72Å; Y176-I199 HydrophobicContact CE2-CG1 3.82Å; Y176-I199 HydrophobicContact CG-CD1 3.84Å; Y176-I200 WeakPolarHBondContact CE2-O 3.27Å; Y176-I200 PolarHBondContact OH-O 3.13Å; Y176-F202 AromaticContact CD2-CD1 3.8Å; Y176-F202 HydrophobicContact CD2-CD1 3.8Å; Y176-F202 AromaticContact CD2-CE1 3.63Å; Y176-F202 HydrophobicContact CD2-CE1 3.63Å; Y176-F202 HydrophobicContact CD2-CZ 4.27Å; Y176-F202 HydrophobicContact CE2-CD1 4.06Å; Y176-F202 HydrophobicContact CE2-CE1 4Å; Y176-F202 HydrophobicContact CE2-CG 4.38Å; Y176-F202 HydrophobicContact CE2-CZ 4.28Å; Y176-D247 PolarHBondContact N-OD2 3.27Å
177	R	98.5	Very high	98.3	Very high	43 Å²	43	22.9 Å²	22.9	16%	0.162	11%	0.113	C	C	.	.			trans	67.4	0.5	167	-48.7	-163.1	-62.6	156.1	2.4	118.1	I175 L204 G227 Q242 D247	I175-R177 HydrophobicContact CB-CG 4.35Å; I175-R177 HydrophobicContact CD1-CG 4.05Å; I175-R177 HydrophobicContact CG1-CG 3.95Å; R177-L204 PolarHBondContact NE-O 3.06Å; R177-L204 PolarHBondContact NH2-O 2.92Å; R177-G227 WeakPolarHBondContact O-CA 3.4Å; R177-Q242 HydrophobicContact CG-CB 4.46Å; R177-D247 PolarHBondContact N-OD1 3.4Å
178	D	97.6	Very high	98	Very high	5 Å²	5	24.6 Å²	24.6	3%	0.027	12%	0.117	C	C	.	.			trans	-137.8	49.1	173.1	-163.6	35.2	0	0	0	113.1	Y176 K180 N183 L204 G227 T228	Y176-D178 VanDerWaalsContact C-N 3.26Å; Y176-D178 VanDerWaalsContact CE1-O 3.3Å; Y176-D178 WeakPolarHBondContact CE1-O 3.38Å; Y176-D178 PolarHBondContact O-N 3.16Å; Y176-D178 VanDerWaalsContact O-N 3.14Å; D178-K180 PolarHBondContact O-N 3.38Å; D178-K180 VanDerWaalsContact O-N 3.12Å; D178-K180 IonicContact OD2-NZ 2.7Å; D178-K180 PolarHBondContact OD2-NZ 2.86Å; D178-N183 PolarHBondContact O-ND2 3.27Å; D178-N183 PolarHBondContact OD2-ND2 3.43Å; D178-L204 HydrophobicContact CB-CB 4.33Å; D178-L204 HydrophobicContact CB-CD1 4.05Å; D178-G227 WeakPolarHBondContact OD1-CA 3.4Å; D178-T228 WeakPolarHBondContact OD1-CB 3.28Å; D178-T228 PolarHBondContact OD1-N 3.13Å; D178-T228 PolarHBondContact OD1-OG1 3.12Å
179	V	98.8	Very high	97.6	Very high	5 Å²	5	25.9 Å²	25.9	3%	0.03	13%	0.13	C	C	.	.			trans	-59.3	112.6	173	177.6	0	0	0	0	110.2	M166 Y176 F184 Y231 D247 A250 L251 M254	M166-V179 HydrophobicContact CE-CG2 3.54Å; Y176-V179 HydrophobicContact CD1-CG2 3.8Å; Y176-V179 HydrophobicContact CE1-CG2 4.35Å; V179-F184 HydrophobicContact CG1-CE2 3.98Å; V179-F184 HydrophobicContact CG1-CZ 4.28Å; V179-Y231 WeakPolarHBondContact O-CB 3.39Å; V179-Y231 WeakPolarHBondContact O-CD2 3.39Å; V179-D247 HydrophobicContact CG2-CB 4.34Å; V179-A250 HydrophobicContact CB-CB 3.7Å; V179-A250 HydrophobicContact CG1-CB 4.03Å; V179-A250 HydrophobicContact CG2-CB 4.15Å; V179-L251 HydrophobicContact CG1-CD2 3.68Å; V179-L251 HydrophobicContact CG1-CG 3.96Å; V179-M254 HydrophobicContact CG1-CE 4.4Å; V179-M254 HydrophobicContact CG1-SD 4.18Å
180	K	98.4	Very high	97	Very high	17 Å²	17	29.5 Å²	29.5	7%	0.074	17%	0.168	C	C	.	.			trans	-158.3	149.5	175.5	71.1	-167.1	-168.8	-143.5	0	110.6	D178 E182 N183 F184 T228 Y231 M254	D178-K180 PolarHBondContact O-N 3.38Å; D178-K180 VanDerWaalsContact O-N 3.12Å; D178-K180 IonicContact OD2-NZ 2.7Å; D178-K180 PolarHBondContact OD2-NZ 2.86Å; K180-E182 VanDerWaalsContact CB-OE2 3.29Å; K180-E182 WeakPolarHBondContact CB-OE2 3.4Å; K180-E182 HydrophobicContact CD-CB 4.48Å; K180-E182 HydrophobicContact CG-CB 4.2Å; K180-E182 VanDerWaalsContact CG-OE2 3.31Å; K180-E182 WeakPolarHBondContact CG-OE2 3.42Å; K180-E182 PolarHBondContact O-N 2.78Å; K180-E182 VanDerWaalsContact O-N 3.13Å; K180-N183 VanDerWaalsContact CE-CG 3.44Å; K180-N183 WeakPolarHBondContact CE-ND2 3.34Å; K180-N183 WeakPolarHBondContact CE-OD1 3.4Å; K180-N183 HydrophobicContact CG-CB 4.12Å; K180-N183 PolarHBondContact O-N 2.92Å; K180-F184 WeakPolarHBondContact O-CD2 3.38Å; K180-F184 WeakPolarHBondContact O-CE2 3.37Å; K180-T228 VanDerWaalsContact CD-OG1 3.27Å; K180-T228 WeakPolarHBondContact CD-OG1 3.5Å; K180-Y231 HydrophobicContact CB-CD2 3.57Å; K180-Y231 HydrophobicContact CB-CE2 3.62Å; K180-M254 VanDerWaalsContact C-SD 3.57Å
181	P	98.6	Very high	96.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-55.5	-31.5	-177.4	-28.2	36.1	0	0	0	114.5	L139 E140 N183 F184 Y231 M254 Y257 F258	L139-P181 HydrophobicContact CB-CB 4.08Å; L139-P181 PolarHBondContact N-O 3.41Å; E140-P181 HydrophobicContact CB-CB 3.97Å; P181-N183 PolarHBondContact O-N 3.34Å; P181-F184 PolarHBondContact O-N 3.34Å; P181-Y231 WeakPolarHBondContact CD-OH 3.43Å; P181-Y231 HydrophobicContact CG-CE1 4.44Å; P181-Y231 HydrophobicContact CG-CE2 4.43Å; P181-Y231 WeakPolarHBondContact CG-OH 3.49Å; P181-M254 HydrophobicContact CB-SD 4.41Å; P181-M254 VanDerWaalsContact CD-SD 3.51Å; P181-M254 HydrophobicContact CG-CG 3.72Å; P181-M254 HydrophobicContact CG-SD 3.73Å; P181-M254 VanDerWaalsContact N-SD 3.39Å; P181-Y257 HydrophobicContact CG-CD1 4.08Å; P181-Y257 HydrophobicContact CG-CE1 3.77Å; P181-F258 HydrophobicContact CB-CE1 3.85Å; P181-F258 HydrophobicContact CB-CZ 3.76Å; P181-F258 HydrophobicContact CG-CE1 3.72Å; P181-F258 HydrophobicContact CG-CZ 3.68Å
182	E	97.2	Very high	96.2	Very high	61 Å²	61	37.5 Å²	37.5	29%	0.285	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-63.4	-24.4	178.6	-56.9	90.6	150.5	0	0	112.9	E140 K180 L185	E140-E182 HydrophobicContact CB-CG 3.98Å; E140-E182 HydrophobicContact CG-CG 4.31Å; K180-E182 VanDerWaalsContact CB-OE2 3.29Å; K180-E182 WeakPolarHBondContact CB-OE2 3.4Å; K180-E182 HydrophobicContact CD-CB 4.48Å; K180-E182 HydrophobicContact CG-CB 4.2Å; K180-E182 VanDerWaalsContact CG-OE2 3.31Å; K180-E182 WeakPolarHBondContact CG-OE2 3.42Å; K180-E182 PolarHBondContact O-N 2.78Å; K180-E182 VanDerWaalsContact O-N 3.13Å; E182-L185 WeakPolarHBondContact O-CD1 3.39Å
183	N	98.1	Very high	96	Very high	7 Å²	7	35.7 Å²	35.7	4%	0.037	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-96	2.6	179.9	-73.1	-7.8	0	0	0	114	Y176 D178 K180 P181 I200	Y176-N183 WeakPolarHBondContact OH-CB 3.45Å; Y176-N183 PolarHBondContact OH-ND2 3.35Å; D178-N183 PolarHBondContact O-ND2 3.27Å; D178-N183 PolarHBondContact OD2-ND2 3.43Å; K180-N183 VanDerWaalsContact CE-CG 3.44Å; K180-N183 WeakPolarHBondContact CE-ND2 3.34Å; K180-N183 WeakPolarHBondContact CE-OD1 3.4Å; K180-N183 HydrophobicContact CG-CB 4.12Å; K180-N183 PolarHBondContact O-N 2.92Å; P181-N183 PolarHBondContact O-N 3.34Å; N183-I200 HydrophobicContact CB-CG1 4.38Å; N183-I200 WeakPolarHBondContact O-CG1 3.43Å; N183-I200 PolarHBondContact O-N 3.4Å; N183-I200 VanDerWaalsContact O-N 3.1Å
184	F	98.7	Very high	95.8	Very high	1 Å²	1	37.2 Å²	37.2	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	116.2	176	-62.9	-70.1	0	0	0	110.2	S138 L139 L162 V179 K180 P181 I197 H198 I199 L251 M254	S138-F184 CarbonylContact C-O 3.58Å; S138-F184 VanDerWaalsContact CA-O 3.27Å; S138-F184 WeakPolarHBondContact CA-O 3.21Å; L139-F184 HydrophobicContact CD1-CB 3.68Å; L139-F184 HydrophobicContact CD1-CG 4.47Å; L139-F184 HydrophobicContact CG-CB 3.9Å; L139-F184 PolarHBondContact N-O 2.85Å; L162-F184 HydrophobicContact CD1-CD1 4.16Å; L162-F184 HydrophobicContact CD1-CD2 4.07Å; L162-F184 HydrophobicContact CD1-CE1 4.35Å; L162-F184 HydrophobicContact CD1-CE2 4.29Å; L162-F184 HydrophobicContact CD1-CG 4Å; L162-F184 HydrophobicContact CD1-CZ 4.42Å; L162-F184 HydrophobicContact CD2-CB 4.41Å; L162-F184 HydrophobicContact CD2-CD1 3.36Å; L162-F184 HydrophobicContact CD2-CE1 3.7Å; L162-F184 HydrophobicContact CD2-CG 3.91Å; L162-F184 HydrophobicContact CG-CD1 4.41Å; V179-F184 HydrophobicContact CG1-CE2 3.98Å; V179-F184 HydrophobicContact CG1-CZ 4.28Å; K180-F184 WeakPolarHBondContact O-CD2 3.38Å; K180-F184 WeakPolarHBondContact O-CE2 3.37Å; P181-F184 PolarHBondContact O-N 3.34Å; F184-I197 HydrophobicContact CB-CG2 4.04Å; F184-H198 CarbonylContact C-O 3.52Å; F184-H198 VanDerWaalsContact CA-O 3.23Å; F184-H198 WeakPolarHBondContact CA-O 3.45Å; F184-I199 HydrophobicContact CD1-CB 4.16Å; F184-I199 HydrophobicContact CD1-CG1 4.28Å; F184-I199 HydrophobicContact CE1-CB 3.99Å; F184-I199 HydrophobicContact CE1-CD1 3.86Å; F184-I199 HydrophobicContact CE1-CG1 3.76Å; F184-I199 HydrophobicContact CZ-CD1 4.42Å; F184-L251 HydrophobicContact CE2-CD2 4.37Å; F184-L251 HydrophobicContact CZ-CD2 4.17Å; F184-M254 HydrophobicContact CD2-CE 3.69Å; F184-M254 HydrophobicContact CD2-SD 3.9Å; F184-M254 HydrophobicContact CE2-CE 3.61Å; F184-M254 HydrophobicContact CE2-SD 3.85Å
185	L	98.1	Very high	95.6	Very high	26 Å²	26	40.2 Å²	40.2	14%	0.136	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	138.4	-171	-79.5	65.7	0	0	0	111.6	L135 P137 E182 H198 I200	L135-L185 HydrophobicContact CB-CB 4.07Å; L135-L185 HydrophobicContact CB-CD2 3.93Å; L135-L185 HydrophobicContact CD1-CB 3.85Å; L135-L185 HydrophobicContact CD1-CD2 4.17Å; P137-L185 WeakPolarHBondContact O-CA 3.49Å; E182-L185 WeakPolarHBondContact O-CD1 3.39Å; L185-H198 PolarHBondContact N-O 2.81Å; L185-H198 WeakPolarHBondContact O-CB 3.31Å; L185-H198 PolarHBondContact O-N 3.38Å; L185-H198 PolarHBondContact O-ND1 3.12Å; L185-H198 VanDerWaalsContact O-ND1 3.1Å; L185-I200 HydrophobicContact CD1-CD1 3.63Å; L185-I200 HydrophobicContact CD1-CG1 3.96Å; L185-I200 HydrophobicContact CD2-CD1 4.09Å
186	V	97.9	Very high	95.5	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.018	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	159.5	170	-62.1	0	0	0	0	110.8	G136 P137 L142 T196 W342	G136-V186 WeakPolarHBondContact CA-O 3.39Å; G136-V186 PolarHBondContact N-O 3.11Å; P137-V186 HydrophobicContact CG-CG2 3.86Å; P137-V186 PolarHBondContact O-N 2.86Å; P137-V186 VanDerWaalsContact O-N 3.08Å; L142-V186 HydrophobicContact CD1-CG1 3.7Å; L142-V186 HydrophobicContact CD1-CG2 4.04Å; V186-T196 WeakPolarHBondContact CA-O 3.33Å; V186-W342 HydrophobicContact CG1-CZ2 4.04Å
187	G	95.9	Very high	95.5	Very high	2 Å²	2	41.1 Å²	41.1	2%	0.021	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-65.2	167	170.5	0	0	0	0	0	112.7	R193 T196	G187-R193 VanDerWaalsContact CA-O 3.3Å; G187-R193 WeakPolarHBondContact CA-O 3.34Å; G187-R193 PolarHBondContact N-O 3.35Å; G187-T196 PolarHBondContact N-O 3.48Å; G187-T196 VanDerWaalsContact N-O 3.16Å
188	R	93.6	Very high	95.5	Very high	70 Å²	70	39 Å²	39	26%	0.264	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-62.7	139.7	177.7	-65	-170.6	-65.1	-148.2	1.6	111.2	Y84 L134 S191 Q194	Y84-R188 PolarHBondContact O-NH1 3.12Å; L134-R188 WeakPolarHBondContact O-CD 3.25Å; L134-R188 WeakPolarHBondContact O-CG 3.22Å; L134-R188 PolarHBondContact O-NE 2.75Å; R188-S191 VanDerWaalsContact O-CB 3.24Å; R188-S191 WeakPolarHBondContact O-CB 3.15Å; R188-S191 PolarHBondContact O-N 3.44Å; R188-S191 PolarHBondContact O-OG 2.85Å; R188-Q194 VanDerWaalsContact O-CB 3.28Å; R188-Q194 WeakPolarHBondContact O-CB 3.4Å
189	P	88.7	Confident	95.6	Very high	67 Å²	67	38.9 Å²	38.9	44%	0.435	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	141.4	171.1	-25.8	36	0	0	0	111.8	S191 L347	P189-S191 PolarHBondContact O-N 3.04Å; P189-L347 HydrophobicContact CG-CD1 3.89Å
190	G	86.3	Confident	95.5	Very high	77 Å²	77	40.4 Å²	40.4	79%	0.794	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.1	-3.1	-175.3	0	0	0	0	0	115
191	S	90.6	Very high	95.3	Very high	38 Å²	38	40.6 Å²	40.6	27%	0.266	22%	0.216	S	C	.	.	S	Bend	trans	-89	153.8	173.1	78.9	0	0	0	0	111.8	R188 P189 R193 Q194	R188-S191 VanDerWaalsContact O-CB 3.24Å; R188-S191 WeakPolarHBondContact O-CB 3.15Å; R188-S191 PolarHBondContact O-N 3.44Å; R188-S191 PolarHBondContact O-OG 2.85Å; P189-S191 PolarHBondContact O-N 3.04Å; S191-R193 PolarHBondContact O-N 3.07Å; S191-R193 PolarHBondContact OG-N 3.46Å; S191-Q194 WeakPolarHBondContact O-CB 3.2Å; S191-Q194 PolarHBondContact O-N 2.88Å; S191-Q194 PolarHBondContact OG-N 3Å
192	K	91.3	Very high	95.2	Very high	223 Å²	223	40.6 Å²	40.6	97%	0.97	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-17	173.3	-66.3	-176.1	178.4	-176.4	0	114
193	R	92.8	Very high	95.1	Very high	65 Å²	65	38 Å²	38	25%	0.245	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	8.3	-179.8	-61.3	174.6	71.8	171.2	7.9	113.1	V115 E133 G187 S191 H195 T196 H198	V115-R193 PolarHBondContact O-NH2 2.83Å; E133-R193 IonicContact OE1-CZ 2.71Å; E133-R193 IonicContact OE1-NE 3.84Å; E133-R193 IonicContact OE1-NH1 3.46Å; E133-R193 PolarHBondContact OE1-NH1 3.18Å; E133-R193 IonicContact OE2-CZ 3.4Å; E133-R193 IonicContact OE2-NH1 3.6Å; E133-R193 PolarHBondContact OE2-NH1 3.36Å; E133-R193 IonicContact OE2-NH2 3.17Å; G187-R193 VanDerWaalsContact CA-O 3.3Å; G187-R193 WeakPolarHBondContact CA-O 3.34Å; G187-R193 PolarHBondContact N-O 3.35Å; S191-R193 PolarHBondContact O-N 3.07Å; S191-R193 PolarHBondContact OG-N 3.46Å; R193-H195 PolarHBondContact O-N 2.92Å; R193-H195 VanDerWaalsContact O-N 3.09Å; R193-T196 VanDerWaalsContact O-CB 3.31Å; R193-T196 WeakPolarHBondContact O-CB 3.49Å; R193-T196 PolarHBondContact O-N 3.18Å; R193-H198 PolarHBondContact NE-NE2 3.32Å; R193-H198 PolarHBondContact NH2-CD2 3.04Å; R193-H198 PolarHBondContact NH2-NE2 2.98Å
194	Q	93.8	Very high	95	Very high	71 Å²	71	38.9 Å²	38.9	33%	0.332	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-27.9	-171	73.2	-178.8	3.8	0	0	114.5	R188 S191	R188-Q194 VanDerWaalsContact O-CB 3.28Å; R188-Q194 WeakPolarHBondContact O-CB 3.4Å; S191-Q194 WeakPolarHBondContact O-CB 3.2Å; S191-Q194 PolarHBondContact O-N 2.88Å; S191-Q194 PolarHBondContact OG-N 3Å
195	H	94.6	Very high	94.9	Very high	62 Å²	62	39 Å²	39	29%	0.287	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-12	178.2	-53.3	-74.1	0	0	0	113.8	R193 Y338 Y340	R193-H195 PolarHBondContact O-N 2.92Å; R193-H195 VanDerWaalsContact O-N 3.09Å; H195-Y338 HydrophobicContact CB-CD1 3.47Å; H195-Y338 VanDerWaalsContact CB-CD1 3.47Å; H195-Y338 HydrophobicContact CB-CE1 4.08Å; H195-Y338 HydrophobicContact CB-CG 3.74Å; H195-Y338 AromaticContact CG-CG 3.88Å; H195-Y338 WeakPolarHBondContact ND1-CB 3.44Å; H195-Y340 HydrophobicContact CB-CE2 4.4Å; H195-Y340 PolarHBondContact O-OH 2.65Å
196	T	97.8	Very high	94.9	Very high	20 Å²	20	40 Å²	40	12%	0.123	21%	0.214	C	C	.	.			trans	-70.7	124.2	174.8	-63.8	0	0	0	0	109.4	E113 V186 G187 R193 H198	E113-T196 HydrophobicContact CG-CG2 4.31Å; E113-T196 WeakPolarHBondContact OE1-CG2 3.43Å; E113-T196 PolarHBondContact OE1-OG1 3.21Å; V186-T196 WeakPolarHBondContact CA-O 3.33Å; G187-T196 PolarHBondContact N-O 3.48Å; G187-T196 VanDerWaalsContact N-O 3.16Å; R193-T196 VanDerWaalsContact O-CB 3.31Å; R193-T196 WeakPolarHBondContact O-CB 3.49Å; R193-T196 PolarHBondContact O-N 3.18Å; T196-H198 VanDerWaalsContact CG2-CE1 3.45Å; T196-H198 WeakPolarHBondContact CG2-CE1 3.35Å; T196-H198 PolarHBondContact O-CE1 2.95Å; T196-H198 PolarHBondContact O-ND1 3.29Å
197	I	98.6	Very high	94.9	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	129.8	167.7	-52.7	171.5	0	0	0	109	L139 I158 Q161 L162 R165 F184	L139-I197 HydrophobicContact CD1-CG2 4.44Å; I158-I197 HydrophobicContact CB-CD1 4.02Å; I158-I197 HydrophobicContact CG1-CD1 3.72Å; I158-I197 HydrophobicContact CG2-CD1 4.09Å; Q161-I197 HydrophobicContact CB-CD1 4.39Å; L162-I197 HydrophobicContact CD2-CB 4.37Å; L162-I197 HydrophobicContact CD2-CG2 3.65Å; R165-I197 PolarHBondContact NE-O 3.47Å; F184-I197 HydrophobicContact CB-CG2 4.04Å
198	H	98.8	Very high	95	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	152	-177.2	-57.1	73.5	0	0	0	111.1	G114 L135 F184 L185 R193 T196	G114-H198 CarbonylContact O-C 3.59Å; G114-H198 WeakPolarHBondContact O-CA 3.47Å; G114-H198 WeakPolarHBondContact O-CB 3.27Å; L135-H198 HydrophobicContact CD1-CB 3.64Å; F184-H198 CarbonylContact C-O 3.52Å; F184-H198 VanDerWaalsContact CA-O 3.23Å; F184-H198 WeakPolarHBondContact CA-O 3.45Å; L185-H198 PolarHBondContact N-O 2.81Å; L185-H198 WeakPolarHBondContact O-CB 3.31Å; L185-H198 PolarHBondContact O-N 3.38Å; L185-H198 PolarHBondContact O-ND1 3.12Å; L185-H198 VanDerWaalsContact O-ND1 3.1Å; R193-H198 PolarHBondContact NE-NE2 3.32Å; R193-H198 PolarHBondContact NH2-CD2 3.04Å; R193-H198 PolarHBondContact NH2-NE2 2.98Å; T196-H198 VanDerWaalsContact CG2-CE1 3.45Å; T196-H198 WeakPolarHBondContact CG2-CE1 3.35Å; T196-H198 PolarHBondContact O-CE1 2.95Å; T196-H198 PolarHBondContact O-ND1 3.29Å
199	I	98.7	Very high	95.3	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	135	171.2	-174.5	171.1	0	0	0	110	G114 P116 R165 M166 V169 Y176 F184 F202	G114-I199 PolarHBondContact O-N 2.93Å; P116-I199 VanDerWaalsContact CD-O 3.32Å; P116-I199 WeakPolarHBondContact CD-O 3.32Å; R165-I199 HydrophobicContact CB-CG2 4.27Å; M166-I199 HydrophobicContact CE-CD1 4.36Å; V169-I199 HydrophobicContact CG2-CD1 4.28Å; Y176-I199 HydrophobicContact CD1-CD1 4.03Å; Y176-I199 HydrophobicContact CD2-CD1 3.68Å; Y176-I199 HydrophobicContact CD2-CG1 4.28Å; Y176-I199 HydrophobicContact CE1-CD1 4.04Å; Y176-I199 HydrophobicContact CE1-CG1 4.39Å; Y176-I199 HydrophobicContact CE2-CD1 3.72Å; Y176-I199 HydrophobicContact CE2-CG1 3.82Å; Y176-I199 HydrophobicContact CG-CD1 3.84Å; F184-I199 HydrophobicContact CD1-CB 4.16Å; F184-I199 HydrophobicContact CD1-CG1 4.28Å; F184-I199 HydrophobicContact CE1-CB 3.99Å; F184-I199 HydrophobicContact CE1-CD1 3.86Å; F184-I199 HydrophobicContact CE1-CG1 3.76Å; F184-I199 HydrophobicContact CZ-CD1 4.42Å; I199-F202 HydrophobicContact CB-CZ 4.47Å; I199-F202 HydrophobicContact CD1-CE1 4.49Å; I199-F202 HydrophobicContact CD1-CZ 4.11Å; I199-F202 HydrophobicContact CG1-CE2 4.4Å; I199-F202 HydrophobicContact CG1-CZ 3.99Å; I199-F202 HydrophobicContact CG2-CE2 4.3Å; I199-F202 HydrophobicContact CG2-CZ 3.83Å
200	I	97.3	Very high	95.5	Very high	38 Å²	38	40.2 Å²	40.2	20%	0.195	21%	0.214	C	C	.	.			trans	-129.4	-175.9	-179	71.9	162	0	0	0	112.3	P116 L135 Y176 N183 L185	P116-I200 HydrophobicContact CG-CG2 4.13Å; L135-I200 HydrophobicContact CD1-CG2 3.77Å; Y176-I200 WeakPolarHBondContact CE2-O 3.27Å; Y176-I200 PolarHBondContact OH-O 3.13Å; N183-I200 HydrophobicContact CB-CG1 4.38Å; N183-I200 WeakPolarHBondContact O-CG1 3.43Å; N183-I200 PolarHBondContact O-N 3.4Å; N183-I200 VanDerWaalsContact O-N 3.1Å; L185-I200 HydrophobicContact CD1-CD1 3.63Å; L185-I200 HydrophobicContact CD1-CG1 3.96Å; L185-I200 HydrophobicContact CD2-CD1 4.09Å
201	D	95.1	Very high	95.7	Very high	21 Å²	21	39.6 Å²	39.6	11%	0.112	20%	0.195	C	C	.	.			trans	51.9	67.5	173.4	-154.1	-1.4	0	0	0	115.3	K88 Y106 G203	K88-D201 IonicContact NZ-OD1 3.82Å; K88-D201 PolarHBondContact NZ-OD1 3.23Å; K88-D201 IonicContact NZ-OD2 3.64Å; Y106-D201 PolarHBondContact OH-N 3.44Å; D201-G203 PolarHBondContact O-N 3.48Å
202	F	96.7	Very high	95.9	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-78.9	16.3	176.4	-70.5	-92.7	0	0	0	113.6	E102 F105 Y106 L109 V169 Y176 I199 L204 A205	E102-F202 HydrophobicContact CG-CB 4.01Å; F105-F202 HydrophobicContact CB-CB 4.19Å; F105-F202 HydrophobicContact CD2-CB 4.42Å; Y106-F202 HydrophobicContact CD1-CD2 4.21Å; Y106-F202 HydrophobicContact CD1-CE2 4.44Å; Y106-F202 AromaticContact CE1-CD2 3.62Å; Y106-F202 HydrophobicContact CE1-CD2 3.62Å; Y106-F202 AromaticContact CE1-CE2 3.8Å; Y106-F202 HydrophobicContact CE1-CE2 3.8Å; Y106-F202 HydrophobicContact CE2-CD2 4.3Å; Y106-F202 AromaticContact CZ-CD2 3.68Å; L109-F202 HydrophobicContact CD1-CD1 4Å; L109-F202 HydrophobicContact CD1-CD2 4.09Å; L109-F202 HydrophobicContact CD1-CE1 3.62Å; L109-F202 HydrophobicContact CD1-CE2 3.71Å; L109-F202 HydrophobicContact CD1-CG 4.23Å; L109-F202 HydrophobicContact CD1-CZ 3.46Å; L109-F202 VanDerWaalsContact CD1-CZ 3.46Å; V169-F202 HydrophobicContact CG1-CE1 4.11Å; V169-F202 HydrophobicContact CG2-CE1 3.77Å; V169-F202 HydrophobicContact CG2-CZ 3.97Å; Y176-F202 AromaticContact CD2-CD1 3.8Å; Y176-F202 HydrophobicContact CD2-CD1 3.8Å; Y176-F202 AromaticContact CD2-CE1 3.63Å; Y176-F202 HydrophobicContact CD2-CE1 3.63Å; Y176-F202 HydrophobicContact CD2-CZ 4.27Å; Y176-F202 HydrophobicContact CE2-CD1 4.06Å; Y176-F202 HydrophobicContact CE2-CE1 4Å; Y176-F202 HydrophobicContact CE2-CG 4.38Å; Y176-F202 HydrophobicContact CE2-CZ 4.28Å; I199-F202 HydrophobicContact CB-CZ 4.47Å; I199-F202 HydrophobicContact CD1-CE1 4.49Å; I199-F202 HydrophobicContact CD1-CZ 4.11Å; I199-F202 HydrophobicContact CG1-CE2 4.4Å; I199-F202 HydrophobicContact CG1-CZ 3.99Å; I199-F202 HydrophobicContact CG2-CE2 4.3Å; I199-F202 HydrophobicContact CG2-CZ 3.83Å; F202-L204 PolarHBondContact O-N 2.62Å; F202-A205 HydrophobicContact CB-CB 4.05Å; F202-A205 HydrophobicContact CD1-CB 3.87Å; F202-A205 HydrophobicContact CG-CB 4.47Å; F202-A205 WeakPolarHBondContact O-CB 3.25Å; F202-A205 PolarHBondContact O-N 3.25Å; F202-A205 VanDerWaalsContact O-N 3.08Å
203	G	94.3	Very high	96.1	Very high	6 Å²	6	39.4 Å²	39.4	6%	0.062	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-60.5	-31.8	-178.7	0	0	0	0	0	113.9	Q98 D201	Q98-G203 VanDerWaalsContact OE1-C 3.25Å; Q98-G203 PolarHBondContact OE1-O 2.93Å; Q98-G203 VanDerWaalsContact OE1-O 3.12Å; D201-G203 PolarHBondContact O-N 3.48Å
204	L	95.3	Very high	96.3	Very high	25 Å²	25	43.5 Å²	43.5	13%	0.131	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-97.6	2.8	175.4	-59.6	-172.7	0	0	0	114.1	F70 R177 D178 F202 T226	F70-L204 HydrophobicContact CE2-CD2 4.27Å; F70-L204 HydrophobicContact CZ-CD2 4.06Å; R177-L204 PolarHBondContact NE-O 3.06Å; R177-L204 PolarHBondContact NH2-O 2.92Å; D178-L204 HydrophobicContact CB-CB 4.33Å; D178-L204 HydrophobicContact CB-CD1 4.05Å; F202-L204 PolarHBondContact O-N 2.62Å; L204-T226 HydrophobicContact CD1-CG2 4.22Å; L204-T226 HydrophobicContact CD2-CG2 4.4Å
205	A	97.6	Very high	96.5	Very high	4 Å²	4	47.1 Å²	47.1	3%	0.033	23%	0.234	C	C	.	.			trans	-66.3	166	178	0	0	0	0	0	112.4	F105 I175 F202	F105-A205 HydrophobicContact CD2-CB 3.79Å; F105-A205 HydrophobicContact CE2-CB 3.93Å; F105-A205 WeakPolarHBondContact CE2-O 3.24Å; I175-A205 CarbonylContact O-C 3.42Å; I175-A205 VanDerWaalsContact O-CA 3.27Å; I175-A205 WeakPolarHBondContact O-CA 3.43Å; I175-A205 WeakPolarHBondContact O-CB 3.41Å; F202-A205 HydrophobicContact CB-CB 4.05Å; F202-A205 HydrophobicContact CD1-CB 3.87Å; F202-A205 HydrophobicContact CG-CB 4.47Å; F202-A205 WeakPolarHBondContact O-CB 3.25Å; F202-A205 PolarHBondContact O-N 3.25Å; F202-A205 VanDerWaalsContact O-N 3.08Å
206	K	97.4	Very high	96.6	Very high	46 Å²	46	45.8 Å²	45.8	20%	0.2	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	143.2	-177.1	178.7	-176.7	173.1	-161.8	0	111.8	L174 I175 Y208 E241	L174-K206 CarbonylContact C-O 3.54Å; L174-K206 VanDerWaalsContact CA-O 3.31Å; L174-K206 WeakPolarHBondContact CA-O 3.37Å; I175-K206 HydrophobicContact CD1-CB 4.48Å; I175-K206 HydrophobicContact CG1-CB 4.05Å; I175-K206 WeakPolarHBondContact CG1-O 3.5Å; I175-K206 PolarHBondContact N-O 3.35Å; I175-K206 PolarHBondContact O-N 3.01Å; K206-Y208 PolarHBondContact O-N 3.47Å; K206-E241 IonicContact NZ-OE1 3.36Å; K206-E241 PolarHBondContact NZ-OE1 2.97Å; K206-E241 IonicContact NZ-OE2 2.72Å; K206-E241 PolarHBondContact NZ-OE2 3.37Å
207	E	98.3	Very high	96.7	Very high	47 Å²	47	45.8 Å²	45.8	22%	0.22	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	119	167.8	-69.8	165.6	166.7	0	0	110	R104 F105 Q108 S173 L174	R104-E207 IonicContact CZ-OE1 3.25Å; R104-E207 IonicContact NE-OE1 2.75Å; R104-E207 IonicContact NH2-OE1 3.84Å; R104-E207 PolarHBondContact NH2-OE1 3.46Å; R104-E207 IonicContact NH2-OE2 3.74Å; R104-E207 PolarHBondContact NH2-OE2 3.31Å; F105-E207 HydrophobicContact CE1-CG 4.06Å; Q108-E207 PolarHBondContact OE1-OE1 3.03Å; S173-E207 WeakPolarHBondContact O-CA 3.5Å; L174-E207 HydrophobicContact CD2-CB 4.48Å; L174-E207 HydrophobicContact CD2-CG 3.69Å
208	Y	98.6	Very high	96.6	Very high	12 Å²	12	49.1 Å²	49.1	5%	0.047	25%	0.249	C	C	.	.	S	Bend	trans	-104.3	-18.6	177.8	84.4	-85.7	0	0	0	113	H170 S173 L174 I175 K206 H216 I217 R244	H170-Y208 VanDerWaalsContact O-CE1 3.27Å; H170-Y208 WeakPolarHBondContact O-CE1 3.24Å; H170-Y208 PolarHBondContact O-OH 3.12Å; S173-Y208 VanDerWaalsContact C-CE1 3.41Å; S173-Y208 WeakPolarHBondContact O-CD1 3.38Å; S173-Y208 PolarHBondContact O-N 2.88Å; L174-Y208 VanDerWaalsContact C-CD1 3.44Å; L174-Y208 WeakPolarHBondContact O-CD1 3.33Å; L174-Y208 WeakPolarHBondContact O-CE1 3.36Å; I175-Y208 HydrophobicContact CG2-CD1 3.73Å; I175-Y208 HydrophobicContact CG2-CG 3.85Å; K206-Y208 PolarHBondContact O-N 3.47Å; Y208-H216 AromaticContact CD2-CD2 3.56Å; Y208-H216 AromaticContact CD2-NE2 3.59Å; Y208-H216 AromaticContact CE2-CD2 3.92Å; Y208-H216 CarbonylContact O-C 3.43Å; Y208-H216 WeakPolarHBondContact O-CA 3.48Å; Y208-I217 PolarHBondContact O-N 3.27Å; Y208-R244 HydrophobicContact CD2-CG 4.3Å; Y208-R244 HydrophobicContact CE1-CG 4.27Å; Y208-R244 HydrophobicContact CE2-CG 3.97Å; Y208-R244 VanDerWaalsContact CE2-NH1 3.27Å; Y208-R244 PolarHBondContact OH-NH1 3.12Å
209	I	98.2	Very high	96.6	Very high	31 Å²	31	53.3 Å²	53.3	16%	0.159	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-99.9	126.7	159.3	-55	-56.9	0	0	0	107.1	K214 K215 H216	I209-K214 WeakPolarHBondContact CG2-O 3.42Å; I209-K215 WeakPolarHBondContact CA-O 3.43Å; I209-H216 HydrophobicContact CD1-CB 4.24Å
210	D	94.3	Very high	96.5	Very high	58 Å²	58	60.1 Å²	60.1	31%	0.31	29%	0.291	S	S	.	.			trans	-65.8	128.8	175.5	174.4	-93.2	0	0	0	110.6	E212 T213 K214 K215	D210-E212 VanDerWaalsContact C-N 3.28Å; D210-E212 PolarHBondContact O-N 3.4Å; D210-E212 PolarHBondContact OD1-N 3.04Å; D210-T213 WeakPolarHBondContact CB-OG1 3.46Å; D210-T213 VanDerWaalsContact CG-OG1 3.3Å; D210-T213 WeakPolarHBondContact OD1-CB 3.23Å; D210-T213 WeakPolarHBondContact OD1-CG2 3.48Å; D210-T213 PolarHBondContact OD1-N 3.35Å; D210-T213 PolarHBondContact OD1-OG1 2.95Å; D210-K214 VanDerWaalsContact O-CA 3.25Å; D210-K214 WeakPolarHBondContact O-CA 3.29Å; D210-K214 PolarHBondContact O-N 3.48Å; D210-K215 PolarHBondContact N-O 3.12Å
211	P	90.6	Very high	96.5	Very high	63 Å²	63	62.7 Å²	62.7	41%	0.409	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-18.1	-169.2	28.2	-35.3	0	0	0	113.9	K214	P211-K214 WeakPolarHBondContact O-CE 3.35Å; P211-K214 PolarHBondContact O-NZ 2.95Å
212	E	93.9	Very high	96.5	Very high	174 Å²	174	70.4 Å²	70.4	81%	0.813	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-57.1	-178.9	-63.7	-179.4	-172.8	0	0	110.8	D210 K214	D210-E212 VanDerWaalsContact C-N 3.28Å; D210-E212 PolarHBondContact O-N 3.4Å; D210-E212 PolarHBondContact OD1-N 3.04Å; E212-K214 VanDerWaalsContact C-N 3.35Å; E212-K214 PolarHBondContact O-N 2.91Å
213	T	96	Very high	96.4	Very high	84 Å²	84	73.8 Å²	73.8	52%	0.515	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-15	-176.1	66.2	0	0	0	0	114.1	D210 K215	D210-T213 WeakPolarHBondContact CB-OG1 3.46Å; D210-T213 VanDerWaalsContact CG-OG1 3.3Å; D210-T213 WeakPolarHBondContact OD1-CB 3.23Å; D210-T213 WeakPolarHBondContact OD1-CG2 3.48Å; D210-T213 PolarHBondContact OD1-N 3.35Å; D210-T213 PolarHBondContact OD1-OG1 2.95Å; T213-K215 PolarHBondContact O-N 3.26Å; T213-K215 VanDerWaalsContact O-N 3.16Å; T213-K215 PolarHBondContact OG1-N 3.23Å
214	K	96.1	Very high	96.2	Very high	150 Å²	150	78.1 Å²	78.1	65%	0.652	38%	0.381	S	S	*	.			trans	58	17.7	-172.9	-48.1	-53.4	-174.1	-172	0	114.6	I209 D210 P211 E212	I209-K214 WeakPolarHBondContact CG2-O 3.42Å; D210-K214 VanDerWaalsContact O-CA 3.25Å; D210-K214 WeakPolarHBondContact O-CA 3.29Å; D210-K214 PolarHBondContact O-N 3.48Å; P211-K214 WeakPolarHBondContact O-CE 3.35Å; P211-K214 PolarHBondContact O-NZ 2.95Å; E212-K214 VanDerWaalsContact C-N 3.35Å; E212-K214 PolarHBondContact O-N 2.91Å
215	K	97.7	Very high	96	Very high	148 Å²	148	79.9 Å²	79.9	64%	0.643	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-91.5	154.6	178	-67.1	179.5	-178.1	179.2	0	111.3	I209 D210 T213	I209-K215 WeakPolarHBondContact CA-O 3.43Å; D210-K215 PolarHBondContact N-O 3.12Å; T213-K215 PolarHBondContact O-N 3.26Å; T213-K215 VanDerWaalsContact O-N 3.16Å; T213-K215 PolarHBondContact OG1-N 3.23Å
216	H	98.7	Very high	95.7	Very high	33 Å²	33	81.1 Å²	81.1	15%	0.153	40%	0.397	C	S	.	.	B	Isolated β-bridge	trans	-63.6	143.4	168.9	-166	-74	0	0	0	110.1	Y208 I209 F312 F313	Y208-H216 AromaticContact CD2-CD2 3.56Å; Y208-H216 AromaticContact CD2-NE2 3.59Å; Y208-H216 AromaticContact CE2-CD2 3.92Å; Y208-H216 CarbonylContact O-C 3.43Å; Y208-H216 WeakPolarHBondContact O-CA 3.48Å; I209-H216 HydrophobicContact CD1-CB 4.24Å; H216-F312 AromaticContact CE1-CE1 3.6Å; H216-F312 AromaticContact CE1-CZ 3.76Å; H216-F312 PolarHBondContact CE1-O 3.4Å; H216-F312 AromaticContact ND1-CE1 3.77Å; H216-F312 PolarHBondContact NE2-O 3.08Å; H216-F313 HydrophobicContact CB-CD1 3.98Å; H216-F313 AromaticContact CG-CD1 3.76Å; H216-F313 AromaticContact ND1-CD1 3.51Å; H216-F313 AromaticContact ND1-CE1 3.97Å
217	I	98.2	Very high	95.4	Very high	21 Å²	21	79.6 Å²	79.6	11%	0.108	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-53.1	142.8	172.6	53.5	170.2	0	0	0	110.8	Y208 E241 F312	Y208-I217 PolarHBondContact O-N 3.27Å; I217-E241 HydrophobicContact CD1-CG 4.06Å; I217-F312 HydrophobicContact CD1-CZ 4.43Å; I217-F312 HydrophobicContact CG1-CZ 4.25Å; I217-F312 WeakPolarHBondContact O-CE1 3.49Å
218	P	97.9	Very high	95.2	Very high	70 Å²	70	79 Å²	79	46%	0.455	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-67.2	148	179.5	28.1	-35.4	0	0	0	111.3
219	Y	98.1	Very high	95.1	Very high	87 Å²	87	78.9 Å²	78.9	34%	0.341	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-61.5	138.8	170.5	-175.5	-105.2	0	0	0	110.7	E221 K240 F312	Y219-E221 HydrophobicContact CE1-CG 3.6Å; Y219-E221 WeakPolarHBondContact CE1-OE1 3.2Å; Y219-E221 PolarHBondContact OH-OE1 3.06Å; Y219-K240 HydrophobicContact CE2-CB 4.44Å; Y219-K240 HydrophobicContact CE2-CD 4.48Å; Y219-K240 WeakPolarHBondContact OH-CD 3.34Å; Y219-K240 WeakPolarHBondContact OH-CE 3.46Å; Y219-K240 WeakPolarHBondContact OH-CG 3.34Å; Y219-F312 VanDerWaalsContact CA-CE1 3.49Å; Y219-F312 HydrophobicContact CD2-CB 4.04Å; Y219-F312 AromaticContact CD2-CD1 3.78Å; Y219-F312 HydrophobicContact CD2-CD1 3.78Å; Y219-F312 AromaticContact CD2-CD2 3.89Å; Y219-F312 HydrophobicContact CD2-CD2 3.89Å; Y219-F312 HydrophobicContact CD2-CE1 4.17Å; Y219-F312 HydrophobicContact CD2-CE2 4.27Å; Y219-F312 AromaticContact CD2-CG 3.61Å; Y219-F312 HydrophobicContact CD2-CG 3.61Å; Y219-F312 HydrophobicContact CD2-CZ 4.39Å; Y219-F312 HydrophobicContact CE2-CB 4.48Å; Y219-F312 HydrophobicContact CE2-CD2 4.4Å; Y219-F312 HydrophobicContact CE2-CG 4.34Å; Y219-F312 HydrophobicContact CG-CD1 4.33Å
220	R	97.3	Very high	95.1	Very high	145 Å²	145	80.7 Å²	80.7	55%	0.547	40%	0.4	S	S	.	.			trans	-148.4	152.7	177.3	-60.8	-176.6	-178.7	-177	1.5	109.6	K223 E241	R220-K223 HydrophobicContact CB-CD 4.45Å; R220-E241 HydrophobicContact CB-CB 4.17Å; R220-E241 WeakPolarHBondContact O-CB 3.3Å; R220-E241 PolarHBondContact O-N 3.14Å
221	E	96.8	Very high	95.3	Very high	91 Å²	91	78 Å²	78	43%	0.425	39%	0.386	S	S	.	.			trans	-118.6	-172	172.2	-54.5	-161	156.1	0	0	110.3	Y219 K223 G239 K240	Y219-E221 HydrophobicContact CE1-CG 3.6Å; Y219-E221 WeakPolarHBondContact CE1-OE1 3.2Å; Y219-E221 PolarHBondContact OH-OE1 3.06Å; E221-K223 PolarHBondContact O-N 2.7Å; E221-G239 CarbonylContact C-O 3.51Å; E221-G239 VanDerWaalsContact C-O 3.28Å; E221-G239 WeakPolarHBondContact CA-O 3.43Å; E221-K240 HydrophobicContact CG-CG 4.28Å
222	H	94.4	Very high	95.7	Very high	183 Å²	183	75.4 Å²	75.4	85%	0.847	37%	0.368	S	S	*	.	S	Bend	trans	54.3	32.3	-177.3	-45.7	-53.7	0	0	0	114.5	G239	H222-G239 PolarHBondContact N-O 3.12Å
223	K	95.5	Very high	95.9	Very high	72 Å²	72	67.2 Å²	67.2	31%	0.313	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-73.6	145.1	173.5	-58.9	-61	-56.3	-161.1	0	111.2	R220 E221 G239 E241	R220-K223 HydrophobicContact CB-CD 4.45Å; E221-K223 PolarHBondContact O-N 2.7Å; K223-G239 WeakPolarHBondContact CB-O 3.42Å; K223-G239 WeakPolarHBondContact CG-O 3.39Å; K223-G239 PolarHBondContact N-O 3.29Å; K223-E241 HydrophobicContact CD-CB 4.35Å; K223-E241 WeakPolarHBondContact CE-OE1 3.49Å; K223-E241 VanDerWaalsContact CE-OE2 3.3Å; K223-E241 WeakPolarHBondContact CE-OE2 3.49Å; K223-E241 HydrophobicContact CG-CB 4.16Å; K223-E241 IonicContact NZ-OE1 2.73Å; K223-E241 PolarHBondContact NZ-OE1 2.99Å; K223-E241 IonicContact NZ-OE2 2.72Å; K223-E241 PolarHBondContact NZ-OE2 2.97Å
224	S	90.4	Very high	96	Very high	96 Å²	96	64.4 Å²	64.4	67%	0.671	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-64.7	133.9	165.6	46	0	0	0	0	111.1	T226	S224-T226 PolarHBondContact O-N 3.48Å; S224-T226 PolarHBondContact O-OG1 3.05Å
225	L	89.8	Confident	96.1	Very high	62 Å²	62	58.2 Å²	58.2	33%	0.325	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-56	120.8	175	-67.8	155.6	0	0	0	109.4	M232 T236 Y277	L225-M232 HydrophobicContact CD2-SD 4.23Å; L225-T236 WeakPolarHBondContact CD2-O 3.27Å; L225-Y277 HydrophobicContact CB-CD1 3.98Å; L225-Y277 HydrophobicContact CB-CE1 4.14Å; L225-Y277 HydrophobicContact CD1-CD1 3.79Å; L225-Y277 HydrophobicContact CD1-CG 4.14Å; L225-Y277 HydrophobicContact CD2-CD1 4.23Å; L225-Y277 HydrophobicContact CG-CD1 4.2Å
226	T	90.8	Very high	96.1	Very high	31 Å²	31	51.4 Å²	51.4	19%	0.19	26%	0.256	C	S	.	.			trans	-132.5	135.1	-173.8	-55.9	0	0	0	0	109.2	L204 S224 M232 Q242	L204-T226 HydrophobicContact CD1-CG2 4.22Å; L204-T226 HydrophobicContact CD2-CG2 4.4Å; S224-T226 PolarHBondContact O-N 3.48Å; S224-T226 PolarHBondContact O-OG1 3.05Å; T226-M232 WeakPolarHBondContact O-CE 3.33Å; T226-Q242 PolarHBondContact O-NE2 3.35Å; T226-Q242 VanDerWaalsContact O-NE2 3.16Å
227	G	91.6	Very high	96.1	Very high	13 Å²	13	50.7 Å²	50.7	13%	0.134	25%	0.253	C	S	.	.	S	Bend	trans	89.4	-179	-175.5	0	0	0	0	0	113.4	R177 D178 A229 M232	R177-G227 WeakPolarHBondContact O-CA 3.4Å; D178-G227 WeakPolarHBondContact OD1-CA 3.4Å; G227-A229 PolarHBondContact O-N 2.95Å; G227-M232 WeakPolarHBondContact O-CE 3.43Å
228	T	94.5	Very high	96	Very high	34 Å²	34	53.2 Å²	53.2	21%	0.209	27%	0.267	C	S	.	.			trans	-79.3	114.3	-169.5	-60.9	0	0	0	0	113.5	D178 K180 R230 Y231 M232	D178-T228 WeakPolarHBondContact OD1-CB 3.28Å; D178-T228 PolarHBondContact OD1-N 3.13Å; D178-T228 PolarHBondContact OD1-OG1 3.12Å; K180-T228 VanDerWaalsContact CD-OG1 3.27Å; K180-T228 WeakPolarHBondContact CD-OG1 3.5Å; T228-R230 HydrophobicContact CG2-CB 4.23Å; T228-R230 PolarHBondContact O-N 2.87Å; T228-Y231 HydrophobicContact CG2-CD2 3.75Å; T228-Y231 HydrophobicContact CG2-CE2 4.12Å; T228-Y231 PolarHBondContact O-N 3.02Å; T228-M232 PolarHBondContact O-N 2.98Å
229	A	96.4	Very high	96	Very high	10 Å²	10	50.4 Å²	50.4	8%	0.083	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.3	-39	-176.3	0	0	0	0	0	115.2	G227 Y231 H237 Y277 I280 K284	G227-A229 PolarHBondContact O-N 2.95Å; A229-Y231 VanDerWaalsContact C-N 3.28Å; A229-Y231 PolarHBondContact O-N 3.12Å; A229-H237 PolarHBondContact O-NE2 2.79Å; A229-Y277 HydrophobicContact CB-CD1 3.89Å; A229-Y277 HydrophobicContact CB-CD2 4.26Å; A229-Y277 HydrophobicContact CB-CE1 3.61Å; A229-Y277 HydrophobicContact CB-CE2 3.98Å; A229-Y277 HydrophobicContact CB-CG 4.23Å; A229-I280 HydrophobicContact CB-CD1 4.12Å; A229-K284 PolarHBondContact O-NZ 3.35Å
230	R	98.1	Very high	96	Very high	70 Å²	70	48.5 Å²	48.5	26%	0.264	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-39	-179	-160.8	-170.2	-51.7	153.1	8	111.6	T228 Y257 L263 W265 Q266 K284	T228-R230 HydrophobicContact CG2-CB 4.23Å; T228-R230 PolarHBondContact O-N 2.87Å; R230-Y257 PolarHBondContact NH1-OH 3.37Å; R230-L263 HydrophobicContact CG-CD1 4.23Å; R230-W265 PolarHBondContact O-NE1 2.95Å; R230-Q266 HydrophobicContact CG-CG 4.03Å; R230-K284 WeakPolarHBondContact O-CE 3.21Å; R230-K284 PolarHBondContact O-NZ 2.84Å
231	Y	98.6	Very high	96.1	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-34.6	-171.2	-54.2	-66.3	0	0	0	113.7	V179 K180 P181 T228 A229 A250 H253 M254 Y257 L263	V179-Y231 WeakPolarHBondContact O-CB 3.39Å; V179-Y231 WeakPolarHBondContact O-CD2 3.39Å; K180-Y231 HydrophobicContact CB-CD2 3.57Å; K180-Y231 HydrophobicContact CB-CE2 3.62Å; P181-Y231 WeakPolarHBondContact CD-OH 3.43Å; P181-Y231 HydrophobicContact CG-CE1 4.44Å; P181-Y231 HydrophobicContact CG-CE2 4.43Å; P181-Y231 WeakPolarHBondContact CG-OH 3.49Å; T228-Y231 HydrophobicContact CG2-CD2 3.75Å; T228-Y231 HydrophobicContact CG2-CE2 4.12Å; T228-Y231 PolarHBondContact O-N 3.02Å; A229-Y231 VanDerWaalsContact C-N 3.28Å; A229-Y231 PolarHBondContact O-N 3.12Å; Y231-A250 VanDerWaalsContact O-CA 3.28Å; Y231-A250 WeakPolarHBondContact O-CA 3.44Å; Y231-A250 WeakPolarHBondContact O-CB 3.23Å; Y231-H253 PolarHBondContact O-ND1 2.97Å; Y231-M254 HydrophobicContact CD1-CB 4.03Å; Y231-M254 HydrophobicContact CD1-CG 4.35Å; Y231-M254 HydrophobicContact CE1-CB 4.3Å; Y231-M254 HydrophobicContact CE1-CG 4.19Å; Y231-Y257 HydrophobicContact CE1-CD1 4.1Å; Y231-Y257 HydrophobicContact CE1-CD2 4.31Å; Y231-Y257 AromaticContact CE1-CG 3.92Å; Y231-Y257 HydrophobicContact CE1-CG 3.92Å; Y231-Y257 VanDerWaalsContact OH-CE1 3.27Å; Y231-Y257 WeakPolarHBondContact OH-CE1 3.23Å; Y231-Y257 VanDerWaalsContact OH-CZ 3.26Å; Y231-L263 HydrophobicContact CD1-CD1 4.38Å; Y231-L263 HydrophobicContact CE1-CD1 4.36Å
232	M	98.3	Very high	96.2	Very high	10 Å²	10	38.2 Å²	38.2	5%	0.049	20%	0.202	C	C	.	.	S	Bend	trans	-47.6	150.5	-176.7	64.2	167.8	57.2	0	0	115.1	L225 T226 G227 T228 T236 H237 Y277 K284	L225-M232 HydrophobicContact CD2-SD 4.23Å; T226-M232 WeakPolarHBondContact O-CE 3.33Å; G227-M232 WeakPolarHBondContact O-CE 3.43Å; T228-M232 PolarHBondContact O-N 2.98Å; M232-T236 HydrophobicContact CB-CG2 4.05Å; M232-T236 HydrophobicContact CE-CG2 3.88Å; M232-T236 HydrophobicContact CG-CG2 4.27Å; M232-T236 HydrophobicContact SD-CG2 3.5Å; M232-T236 VanDerWaalsContact SD-CG2 3.5Å; M232-H237 WeakPolarHBondContact CG-NE2 3.25Å; M232-H237 PolarHBondContact SD-NE2 3.22Å; M232-H237 VanDerWaalsContact SD-NE2 3.45Å; M232-Y277 HydrophobicContact CE-CD1 4.47Å; M232-Y277 HydrophobicContact CE-CE1 3.99Å; M232-K284 PolarHBondContact O-NZ 3.3Å
233	S	98.8	Very high	96.4	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.007	16%	0.162	C	C	.	.			trans	-60.9	161	-178.1	64.7	0	0	0	0	114.4	N235 T236 H237 D246 E249	S233-N235 VanDerWaalsContact C-N 3.27Å; S233-N235 PolarHBondContact O-N 3.09Å; S233-T236 WeakPolarHBondContact O-CB 3.24Å; S233-T236 PolarHBondContact O-N 3.42Å; S233-T236 WeakPolarHBondContact OG-CB 3.45Å; S233-T236 PolarHBondContact OG-N 3.36Å; S233-T236 PolarHBondContact OG-OG1 2.96Å; S233-H237 PolarHBondContact O-N 3.01Å; S233-D246 VanDerWaalsContact CB-OD1 3.22Å; S233-D246 WeakPolarHBondContact CB-OD1 3.27Å; S233-D246 PolarHBondContact OG-OD1 3.43Å; S233-E249 VanDerWaalsContact CB-OE2 3.25Å; S233-E249 WeakPolarHBondContact CB-OE2 3.27Å
234	I	98.6	Very high	96.5	Very high	25 Å²	25	27.2 Å²	27.2	13%	0.128	15%	0.151	C	C	.	.	H	α-helix	trans	-57.3	-42	167.3	-72	170.9	0	0	0	110.8	T236 H237 L238 E249 K284 R285	I234-T236 VanDerWaalsContact C-N 3.29Å; I234-T236 PolarHBondContact O-N 3.07Å; I234-H237 WeakPolarHBondContact O-CB 3.2Å; I234-H237 PolarHBondContact O-N 3.43Å; I234-H237 VanDerWaalsContact O-N 3.13Å; I234-L238 HydrophobicContact CG2-CD1 4.06Å; I234-L238 HydrophobicContact CG2-CG 4.43Å; I234-L238 WeakPolarHBondContact O-CG 3.41Å; I234-L238 PolarHBondContact O-N 2.88Å; I234-E249 PolarHBondContact N-OE1 2.91Å; I234-K284 WeakPolarHBondContact CD1-O 3.45Å; I234-K284 HydrophobicContact CG1-CB 4.03Å; I234-R285 HydrophobicContact CD1-CG 4.13Å; I234-R285 HydrophobicContact CG1-CG 4.2Å; I234-R285 HydrophobicContact CG2-CG 3.64Å
235	N	98.5	Very high	96.9	Very high	20 Å²	20	23.8 Å²	23.8	11%	0.107	12%	0.123	C	C	.	.	H	α-helix	trans	-63.5	-34.1	179.3	-73	-62.2	0	0	0	112.4	S233 L238 G239 K240 D246	S233-N235 VanDerWaalsContact C-N 3.27Å; S233-N235 PolarHBondContact O-N 3.09Å; N235-L238 PolarHBondContact O-N 2.9Å; N235-G239 PolarHBondContact O-N 2.82Å; N235-K240 HydrophobicContact CB-CB 4.36Å; N235-K240 HydrophobicContact CB-CD 3.94Å; N235-K240 WeakPolarHBondContact O-CB 3.43Å; N235-K240 PolarHBondContact O-N 2.94Å; N235-K240 VanDerWaalsContact OD1-CD 3.24Å; N235-K240 WeakPolarHBondContact OD1-CD 3.47Å; N235-K240 PolarHBondContact OD1-NZ 3.44Å; N235-K240 VanDerWaalsContact OD1-NZ 3.15Å; N235-D246 WeakPolarHBondContact CB-OD1 3.27Å
236	T	98.1	Very high	97.4	Very high	5 Å²	5	21 Å²	21	3%	0.031	11%	0.109	C	C	.	.	H	α-helix	trans	-63.5	-44.8	172	-57.1	0	0	0	0	111.3	L225 M232 S233 I234 L238 G239 Q242	L225-T236 WeakPolarHBondContact CD2-O 3.27Å; M232-T236 HydrophobicContact CB-CG2 4.05Å; M232-T236 HydrophobicContact CE-CG2 3.88Å; M232-T236 HydrophobicContact CG-CG2 4.27Å; M232-T236 HydrophobicContact SD-CG2 3.5Å; M232-T236 VanDerWaalsContact SD-CG2 3.5Å; S233-T236 WeakPolarHBondContact O-CB 3.24Å; S233-T236 PolarHBondContact O-N 3.42Å; S233-T236 WeakPolarHBondContact OG-CB 3.45Å; S233-T236 PolarHBondContact OG-N 3.36Å; S233-T236 PolarHBondContact OG-OG1 2.96Å; I234-T236 VanDerWaalsContact C-N 3.29Å; I234-T236 PolarHBondContact O-N 3.07Å; T236-L238 PolarHBondContact O-N 3.21Å; T236-G239 PolarHBondContact O-N 3.19Å; T236-Q242 HydrophobicContact CG2-CG 4.42Å; T236-Q242 WeakPolarHBondContact OG1-CG 3.4Å; T236-Q242 PolarHBondContact OG1-NE2 2.97Å
237	H	97.8	Very high	97.8	Very high	18 Å²	18	19.6 Å²	19.6	8%	0.083	10%	0.1	C	C	.	.	H	α-helix	trans	-61.3	-31.8	176	-87.2	-73.4	0	0	0	112.9	A229 M232 S233 I234 G239 Y277 G281	A229-H237 PolarHBondContact O-NE2 2.79Å; M232-H237 WeakPolarHBondContact CG-NE2 3.25Å; M232-H237 PolarHBondContact SD-NE2 3.22Å; M232-H237 VanDerWaalsContact SD-NE2 3.45Å; S233-H237 PolarHBondContact O-N 3.01Å; I234-H237 WeakPolarHBondContact O-CB 3.2Å; I234-H237 PolarHBondContact O-N 3.43Å; I234-H237 VanDerWaalsContact O-N 3.13Å; H237-G239 PolarHBondContact O-N 3.35Å; H237-Y277 PolarHBondContact CE1-O 3.04Å; H237-Y277 VanDerWaalsContact CE1-O 3.27Å; H237-Y277 PolarHBondContact ND1-O 2.6Å; H237-G281 VanDerWaalsContact CG-CA 3.42Å
238	L	96.8	Very high	98.1	Very high	75 Å²	75	19 Å²	19	39%	0.393	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	8.3	172.4	-63.1	174.1	0	0	0	113.9	I234 N235 T236 K240	I234-L238 HydrophobicContact CG2-CD1 4.06Å; I234-L238 HydrophobicContact CG2-CG 4.43Å; I234-L238 WeakPolarHBondContact O-CG 3.41Å; I234-L238 PolarHBondContact O-N 2.88Å; N235-L238 PolarHBondContact O-N 2.9Å; T236-L238 PolarHBondContact O-N 3.21Å; L238-K240 VanDerWaalsContact C-N 3.28Å; L238-K240 HydrophobicContact CB-CD 4.34Å; L238-K240 HydrophobicContact CB-CG 4.3Å; L238-K240 PolarHBondContact O-N 3.42Å
239	G	97.2	Very high	98.3	Very high	11 Å²	11	17.5 Å²	17.5	11%	0.113	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	24.3	178.5	0	0	0	0	0	113.9	E221 H222 K223 N235 T236 H237	E221-G239 CarbonylContact C-O 3.51Å; E221-G239 VanDerWaalsContact C-O 3.28Å; E221-G239 WeakPolarHBondContact CA-O 3.43Å; H222-G239 PolarHBondContact N-O 3.12Å; K223-G239 WeakPolarHBondContact CB-O 3.42Å; K223-G239 WeakPolarHBondContact CG-O 3.39Å; K223-G239 PolarHBondContact N-O 3.29Å; N235-G239 PolarHBondContact O-N 2.82Å; T236-G239 PolarHBondContact O-N 3.19Å; H237-G239 PolarHBondContact O-N 3.35Å
240	K	98.3	Very high	98.4	Very high	47 Å²	47	17.2 Å²	17.2	20%	0.204	8%	0.083	C	C	.	.	P	Polyproline II helix	trans	-82.9	152.6	176.2	-59.7	172.3	174	-172.4	0	110.5	Y219 E221 N235 L238 Q242	Y219-K240 HydrophobicContact CE2-CB 4.44Å; Y219-K240 HydrophobicContact CE2-CD 4.48Å; Y219-K240 WeakPolarHBondContact OH-CD 3.34Å; Y219-K240 WeakPolarHBondContact OH-CE 3.46Å; Y219-K240 WeakPolarHBondContact OH-CG 3.34Å; E221-K240 HydrophobicContact CG-CG 4.28Å; N235-K240 HydrophobicContact CB-CB 4.36Å; N235-K240 HydrophobicContact CB-CD 3.94Å; N235-K240 WeakPolarHBondContact O-CB 3.43Å; N235-K240 PolarHBondContact O-N 2.94Å; N235-K240 VanDerWaalsContact OD1-CD 3.24Å; N235-K240 WeakPolarHBondContact OD1-CD 3.47Å; N235-K240 PolarHBondContact OD1-NZ 3.44Å; N235-K240 VanDerWaalsContact OD1-NZ 3.15Å; L238-K240 VanDerWaalsContact C-N 3.28Å; L238-K240 HydrophobicContact CB-CD 4.34Å; L238-K240 HydrophobicContact CB-CG 4.3Å; L238-K240 PolarHBondContact O-N 3.42Å; K240-Q242 PolarHBondContact O-N 2.75Å
241	E	98.4	Very high	98.5	Very high	8 Å²	8	13.9 Å²	13.9	4%	0.037	7%	0.07	C	C	.	.	P	Polyproline II helix	trans	-62.4	133.4	169.1	-167.3	76.1	-104.1	0	0	109	K206 I217 R220 K223 F312	K206-E241 IonicContact NZ-OE1 3.36Å; K206-E241 PolarHBondContact NZ-OE1 2.97Å; K206-E241 IonicContact NZ-OE2 2.72Å; K206-E241 PolarHBondContact NZ-OE2 3.37Å; I217-E241 HydrophobicContact CD1-CG 4.06Å; R220-E241 HydrophobicContact CB-CB 4.17Å; R220-E241 WeakPolarHBondContact O-CB 3.3Å; R220-E241 PolarHBondContact O-N 3.14Å; K223-E241 HydrophobicContact CD-CB 4.35Å; K223-E241 WeakPolarHBondContact CE-OE1 3.49Å; K223-E241 VanDerWaalsContact CE-OE2 3.3Å; K223-E241 WeakPolarHBondContact CE-OE2 3.49Å; K223-E241 HydrophobicContact CG-CB 4.16Å; K223-E241 IonicContact NZ-OE1 2.73Å; K223-E241 PolarHBondContact NZ-OE1 2.99Å; K223-E241 IonicContact NZ-OE2 2.72Å; K223-E241 PolarHBondContact NZ-OE2 2.97Å; E241-F312 HydrophobicContact CB-CE2 4.28Å; E241-F312 HydrophobicContact CB-CZ 4.36Å; E241-F312 HydrophobicContact CG-CZ 4.38Å; E241-F312 WeakPolarHBondContact O-CE2 3.44Å
242	Q	98.8	Very high	98.5	Very high	12 Å²	12	14 Å²	14	6%	0.056	7%	0.071	C	C	.	.	P	Polyproline II helix	trans	-79	147.1	-179.1	-65.8	176.9	21.6	0	0	110.7	I175 R177 T226 T236 K240 D246	I175-Q242 HydrophobicContact CD1-CB 4.29Å; I175-Q242 WeakPolarHBondContact CD1-O 3.33Å; R177-Q242 HydrophobicContact CG-CB 4.46Å; T226-Q242 PolarHBondContact O-NE2 3.35Å; T226-Q242 VanDerWaalsContact O-NE2 3.16Å; T236-Q242 HydrophobicContact CG2-CG 4.42Å; T236-Q242 WeakPolarHBondContact OG1-CG 3.4Å; T236-Q242 PolarHBondContact OG1-NE2 2.97Å; K240-Q242 PolarHBondContact O-N 2.75Å; Q242-D246 WeakPolarHBondContact CA-OD2 3.29Å; Q242-D246 HydrophobicContact CB-CB 4.12Å; Q242-D246 HydrophobicContact CG-CB 4.21Å
243	S	98.8	Very high	98.5	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.069	C	C	.	.			trans	-136.6	-168.8	165.1	79.2	0	0	0	0	111.2	R245 D246 F312	S243-R245 PolarHBondContact O-N 3.07Å; S243-D246 PolarHBondContact N-OD2 3.03Å; S243-D246 WeakPolarHBondContact O-CB 3.44Å; S243-D246 PolarHBondContact O-N 3.4Å; S243-F312 VanDerWaalsContact CB-O 3.25Å; S243-F312 WeakPolarHBondContact CB-O 3.2Å; S243-F312 PolarHBondContact OG-O 2.79Å
244	R	98.9	Very high	98.5	Very high	24 Å²	24	13.5 Å²	13.5	9%	0.091	7%	0.068	C	C	.	.	H	α-helix	trans	-51.6	-30.6	-175.3	-63.5	-179.8	-75.1	-139.5	-2.9	114.5	H170 I175 Y208 D246 L248 F313 E314 P316	H170-R244 HydrophobicContact CB-CG 4.28Å; H170-R244 VanDerWaalsContact CE1-CA 3.49Å; H170-R244 WeakPolarHBondContact CE1-CA 3.26Å; H170-R244 PolarHBondContact CE1-O 3.24Å; H170-R244 VanDerWaalsContact CE1-O 3.3Å; I175-R244 HydrophobicContact CG2-CG 4.11Å; Y208-R244 HydrophobicContact CD2-CG 4.3Å; Y208-R244 HydrophobicContact CE1-CG 4.27Å; Y208-R244 HydrophobicContact CE2-CG 3.97Å; Y208-R244 VanDerWaalsContact CE2-NH1 3.27Å; Y208-R244 PolarHBondContact OH-NH1 3.12Å; R244-D246 VanDerWaalsContact C-N 3.33Å; R244-L248 WeakPolarHBondContact O-CG 3.5Å; R244-F313 PolarHBondContact NH2-O 2.95Å; R244-E314 VanDerWaalsContact CZ-O 3.27Å; R244-E314 PolarHBondContact NE-O 2.9Å; R244-E314 PolarHBondContact NH2-O 3.45Å; R244-P316 HydrophobicContact CB-CG 4.01Å
245	R	98.8	Very high	98.5	Very high	23 Å²	23	12.3 Å²	12.3	9%	0.087	6%	0.062	C	C	.	.	H	α-helix	trans	-68.3	-32.3	178.7	67.7	-176.2	-178.5	177.8	-1.6	112.8	S243 L248 E249 L310	S243-R245 PolarHBondContact O-N 3.07Å; R245-L248 PolarHBondContact O-N 3.5Å; R245-E249 PolarHBondContact O-N 3.46Å; R245-L310 HydrophobicContact CB-CB 3.69Å; R245-L310 HydrophobicContact CB-CD1 3.77Å; R245-L310 HydrophobicContact CB-CG 4.41Å; R245-L310 WeakPolarHBondContact CD-O 3.49Å; R245-L310 PolarHBondContact NH1-O 2.91Å
246	D	98.9	Very high	98.6	Very high	3 Å²	3	11.4 Å²	11.4	2%	0.016	6%	0.058	C	C	.	.	H	α-helix	trans	-74.4	-36	-173.1	-62.2	-79.7	0	0	0	111.6	S233 N235 Q242 S243 R244 A250	S233-D246 VanDerWaalsContact CB-OD1 3.22Å; S233-D246 WeakPolarHBondContact CB-OD1 3.27Å; S233-D246 PolarHBondContact OG-OD1 3.43Å; N235-D246 WeakPolarHBondContact CB-OD1 3.27Å; Q242-D246 WeakPolarHBondContact CA-OD2 3.29Å; Q242-D246 HydrophobicContact CB-CB 4.12Å; Q242-D246 HydrophobicContact CG-CB 4.21Å; S243-D246 PolarHBondContact N-OD2 3.03Å; S243-D246 WeakPolarHBondContact O-CB 3.44Å; S243-D246 PolarHBondContact O-N 3.4Å; R244-D246 VanDerWaalsContact C-N 3.33Å; D246-A250 WeakPolarHBondContact O-CB 3.37Å; D246-A250 PolarHBondContact O-N 3.28Å
247	D	98.9	Very high	98.6	Very high	3 Å²	3	11.2 Å²	11.2	2%	0.016	6%	0.056	C	C	.	.	H	α-helix	trans	-64	-38.4	169.7	-80.3	-49.7	0	0	0	112.1	M166 H170 I175 Y176 R177 V179 A250 L251	M166-D247 HydrophobicContact CE-CB 4.05Å; M166-D247 HydrophobicContact CG-CB 4.05Å; M166-D247 HydrophobicContact SD-CB 3.72Å; H170-D247 IonicContact NE2-OD2 3.97Å; I175-D247 WeakPolarHBondContact CB-OD2 3.31Å; Y176-D247 PolarHBondContact N-OD2 3.27Å; R177-D247 PolarHBondContact N-OD1 3.4Å; V179-D247 HydrophobicContact CG2-CB 4.34Å; D247-A250 PolarHBondContact O-N 3.1Å; D247-L251 PolarHBondContact O-N 2.88Å
248	L	98.9	Very high	98.7	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-74.1	-39.5	177.1	-62.8	179.2	0	0	0	112.5	M166 R244 R245 A250 L251 G252 Y303 V307 L310 P316 Y318 L321	M166-L248 HydrophobicContact CB-CD2 4.37Å; M166-L248 HydrophobicContact CG-CD2 4.14Å; R244-L248 WeakPolarHBondContact O-CG 3.5Å; R245-L248 PolarHBondContact O-N 3.5Å; L248-A250 VanDerWaalsContact C-N 3.26Å; L248-A250 PolarHBondContact O-N 3.23Å; L248-L251 HydrophobicContact CD2-CD1 4.13Å; L248-L251 WeakPolarHBondContact O-CB 3.39Å; L248-L251 PolarHBondContact O-N 2.71Å; L248-G252 PolarHBondContact O-N 3.34Å; L248-Y303 WeakPolarHBondContact O-CE1 3.17Å; L248-Y303 PolarHBondContact O-OH 2.92Å; L248-V307 HydrophobicContact CB-CB 4.17Å; L248-V307 HydrophobicContact CB-CG1 3.74Å; L248-V307 HydrophobicContact CD1-CG1 4.41Å; L248-L310 HydrophobicContact CD1-CD1 4.46Å; L248-P316 HydrophobicContact CD1-CB 3.41Å; L248-P316 VanDerWaalsContact CD1-CB 3.41Å; L248-P316 HydrophobicContact CD1-CG 3.47Å; L248-P316 VanDerWaalsContact CD1-CG 3.47Å; L248-Y318 HydrophobicContact CD1-CD1 4.35Å; L248-Y318 HydrophobicContact CD1-CE1 3.99Å; L248-Y318 HydrophobicContact CD2-CD1 4.46Å; L248-Y318 HydrophobicContact CD2-CE1 4.3Å; L248-L321 HydrophobicContact CD1-CD1 3.89Å
249	E	98.9	Very high	98.8	Very high	2 Å²	2	7.5 Å²	7.5	1%	0.009	4%	0.037	C	C	.	.	H	α-helix	trans	-60	-39.4	171.8	-166.7	-172.3	146.5	0	0	111.1	S233 I234 R245 G252 H253 V307 R308	S233-E249 VanDerWaalsContact CB-OE2 3.25Å; S233-E249 WeakPolarHBondContact CB-OE2 3.27Å; I234-E249 PolarHBondContact N-OE1 2.91Å; R245-E249 PolarHBondContact O-N 3.46Å; E249-G252 PolarHBondContact O-N 3.12Å; E249-H253 PolarHBondContact O-N 2.84Å; E249-H253 PolarHBondContact O-ND1 3.32Å; E249-H253 IonicContact OE1-CE1 3.44Å; E249-H253 PolarHBondContact OE1-CE1 2.74Å; E249-H253 IonicContact OE1-NE2 2.71Å; E249-V307 HydrophobicContact CB-CG2 4.01Å; E249-V307 HydrophobicContact CG-CG2 4.31Å; E249-R308 HydrophobicContact CG-CG 3.83Å; E249-R308 IonicContact OE1-CZ 2.75Å; E249-R308 IonicContact OE1-NE 3.51Å; E249-R308 PolarHBondContact OE1-NE 3.07Å; E249-R308 IonicContact OE1-NH2 3.34Å
250	A	98.9	Very high	98.8	Very high	5 Å²	5	11 Å²	11	4%	0.041	5%	0.047	C	C	.	.	H	α-helix	trans	-68.2	-35	175.9	0	0	0	0	0	113.4	V179 Y231 D246 D247 L248 H253 M254	V179-A250 HydrophobicContact CB-CB 3.7Å; V179-A250 HydrophobicContact CG1-CB 4.03Å; V179-A250 HydrophobicContact CG2-CB 4.15Å; Y231-A250 VanDerWaalsContact O-CA 3.28Å; Y231-A250 WeakPolarHBondContact O-CA 3.44Å; Y231-A250 WeakPolarHBondContact O-CB 3.23Å; D246-A250 WeakPolarHBondContact O-CB 3.37Å; D246-A250 PolarHBondContact O-N 3.28Å; D247-A250 PolarHBondContact O-N 3.1Å; L248-A250 VanDerWaalsContact C-N 3.26Å; L248-A250 PolarHBondContact O-N 3.23Å; A250-H253 PolarHBondContact O-N 3.5Å; A250-M254 WeakPolarHBondContact O-CB 3.31Å; A250-M254 PolarHBondContact O-N 3.05Å
251	L	98.9	Very high	98.8	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-62	-44	168.8	-79.5	178.8	0	0	0	111.2	L162 M166 V179 F184 D247 L248 H253 M254 F255	L162-L251 HydrophobicContact CB-CD1 4.41Å; L162-L251 HydrophobicContact CB-CD2 3.94Å; L162-L251 HydrophobicContact CD1-CD2 3.99Å; M166-L251 HydrophobicContact CB-CD1 4.03Å; M166-L251 HydrophobicContact CE-CD1 4.39Å; M166-L251 HydrophobicContact CG-CD1 4.38Å; V179-L251 HydrophobicContact CG1-CD2 3.68Å; V179-L251 HydrophobicContact CG1-CG 3.96Å; F184-L251 HydrophobicContact CE2-CD2 4.37Å; F184-L251 HydrophobicContact CZ-CD2 4.17Å; D247-L251 PolarHBondContact O-N 2.88Å; L248-L251 HydrophobicContact CD2-CD1 4.13Å; L248-L251 WeakPolarHBondContact O-CB 3.39Å; L248-L251 PolarHBondContact O-N 2.71Å; L251-H253 PolarHBondContact O-N 2.83Å; L251-M254 HydrophobicContact CD2-CE 3.65Å; L251-M254 CarbonylContact O-C 3.55Å; L251-M254 WeakPolarHBondContact O-CA 3.07Å; L251-M254 WeakPolarHBondContact O-CB 3.16Å; L251-M254 PolarHBondContact O-N 2.96Å; L251-F255 HydrophobicContact CB-CE1 4.43Å; L251-F255 HydrophobicContact CB-CE2 4Å; L251-F255 HydrophobicContact CB-CZ 3.8Å; L251-F255 HydrophobicContact CD1-CZ 4.45Å; L251-F255 HydrophobicContact CD2-CE1 4.31Å; L251-F255 HydrophobicContact CD2-CZ 4.23Å; L251-F255 HydrophobicContact CG-CZ 4.39Å; L251-F255 WeakPolarHBondContact O-CD1 3.29Å; L251-F255 WeakPolarHBondContact O-CD2 3.19Å; L251-F255 WeakPolarHBondContact O-CG 3.49Å; L251-F255 PolarHBondContact O-N 2.94Å
252	G	98.9	Very high	98.8	Very high	2 Å²	2	12 Å²	12	2%	0.021	6%	0.063	C	C	.	.	H	α-helix	trans	-58.7	-45.7	175.8	0	0	0	0	0	113	L248 E249 M254 F255 M256	L248-G252 PolarHBondContact O-N 3.34Å; E249-G252 PolarHBondContact O-N 3.12Å; G252-M254 VanDerWaalsContact C-N 3.27Å; G252-M254 PolarHBondContact O-N 2.68Å; G252-F255 PolarHBondContact O-N 3.18Å; G252-M256 PolarHBondContact O-N 3.04Å; G252-M256 VanDerWaalsContact O-N 3.11Å
253	H	98.9	Very high	98.8	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-60.3	-36	172	-65.7	142.7	0	0	0	112.4	Y231 E249 A250 L251 Y257 W265 R308	Y231-H253 PolarHBondContact O-ND1 2.97Å; E249-H253 PolarHBondContact O-N 2.84Å; E249-H253 PolarHBondContact O-ND1 3.32Å; E249-H253 IonicContact OE1-CE1 3.44Å; E249-H253 PolarHBondContact OE1-CE1 2.74Å; E249-H253 IonicContact OE1-NE2 2.71Å; A250-H253 PolarHBondContact O-N 3.5Å; L251-H253 PolarHBondContact O-N 2.83Å; H253-Y257 WeakPolarHBondContact O-CB 3.38Å; H253-Y257 PolarHBondContact O-N 2.67Å; H253-W265 HydrophobicContact CB-CZ2 4.38Å; H253-W265 AromaticContact CD2-CH2 3.65Å; H253-W265 AromaticContact CD2-CZ2 3.68Å; H253-W265 AromaticContact NE2-CH2 3.97Å; H253-R308 PolarHBondContact NE2-NH2 2.92Å
254	M	98.9	Very high	98.8	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-73	-35.4	178.5	-167.4	177.8	73.2	0	0	113.1	L162 V179 K180 P181 F184 Y231 A250 L251 G252 Y257 F258	L162-M254 HydrophobicContact CD1-CE 3.34Å; V179-M254 HydrophobicContact CG1-CE 4.4Å; V179-M254 HydrophobicContact CG1-SD 4.18Å; K180-M254 VanDerWaalsContact C-SD 3.57Å; P181-M254 HydrophobicContact CB-SD 4.41Å; P181-M254 VanDerWaalsContact CD-SD 3.51Å; P181-M254 HydrophobicContact CG-CG 3.72Å; P181-M254 HydrophobicContact CG-SD 3.73Å; P181-M254 VanDerWaalsContact N-SD 3.39Å; F184-M254 HydrophobicContact CD2-CE 3.69Å; F184-M254 HydrophobicContact CD2-SD 3.9Å; F184-M254 HydrophobicContact CE2-CE 3.61Å; F184-M254 HydrophobicContact CE2-SD 3.85Å; Y231-M254 HydrophobicContact CD1-CB 4.03Å; Y231-M254 HydrophobicContact CD1-CG 4.35Å; Y231-M254 HydrophobicContact CE1-CB 4.3Å; Y231-M254 HydrophobicContact CE1-CG 4.19Å; A250-M254 WeakPolarHBondContact O-CB 3.31Å; A250-M254 PolarHBondContact O-N 3.05Å; L251-M254 HydrophobicContact CD2-CE 3.65Å; L251-M254 CarbonylContact O-C 3.55Å; L251-M254 WeakPolarHBondContact O-CA 3.07Å; L251-M254 WeakPolarHBondContact O-CB 3.16Å; L251-M254 PolarHBondContact O-N 2.96Å; G252-M254 VanDerWaalsContact C-N 3.27Å; G252-M254 PolarHBondContact O-N 2.68Å; M254-Y257 WeakPolarHBondContact O-CB 3.27Å; M254-Y257 PolarHBondContact O-N 3.36Å; M254-F258 HydrophobicContact CE-CE2 4.06Å; M254-F258 HydrophobicContact CE-CZ 4.49Å; M254-F258 HydrophobicContact CG-CD2 4.43Å; M254-F258 HydrophobicContact CG-CE2 3.81Å; M254-F258 HydrophobicContact CG-CZ 3.98Å; M254-F258 VanDerWaalsContact O-CD2 3.25Å; M254-F258 WeakPolarHBondContact O-CD2 3.4Å; M254-F258 WeakPolarHBondContact O-CG 3.39Å; M254-F258 PolarHBondContact O-N 3.13Å; M254-F258 VanDerWaalsContact O-N 3.09Å; M254-F258 HydrophobicContact SD-CE2 4.34Å; M254-F258 HydrophobicContact SD-CZ 4.31Å
255	F	98.9	Very high	98.8	Very high	1 Å²	1	13.4 Å²	13.4	0%	0.004	8%	0.076	C	C	.	.	H	α-helix	trans	-64.5	-44.7	172.6	-54.4	-32.4	0	0	0	111	V155 A159 L162 L251 G252 Y257 F258 L259 M300 Y303 F325	V155-F255 HydrophobicContact CG1-CB 4.06Å; A159-F255 HydrophobicContact CB-CD1 4.04Å; A159-F255 HydrophobicContact CB-CD2 4.17Å; A159-F255 HydrophobicContact CB-CE1 3.66Å; A159-F255 HydrophobicContact CB-CE2 3.81Å; A159-F255 HydrophobicContact CB-CG 4.3Å; A159-F255 HydrophobicContact CB-CZ 3.54Å; L162-F255 HydrophobicContact CB-CE1 4.5Å; L162-F255 HydrophobicContact CD1-CE1 4.4Å; L251-F255 HydrophobicContact CB-CE1 4.43Å; L251-F255 HydrophobicContact CB-CE2 4Å; L251-F255 HydrophobicContact CB-CZ 3.8Å; L251-F255 HydrophobicContact CD1-CZ 4.45Å; L251-F255 HydrophobicContact CD2-CE1 4.31Å; L251-F255 HydrophobicContact CD2-CZ 4.23Å; L251-F255 HydrophobicContact CG-CZ 4.39Å; L251-F255 WeakPolarHBondContact O-CD1 3.29Å; L251-F255 WeakPolarHBondContact O-CD2 3.19Å; L251-F255 WeakPolarHBondContact O-CG 3.49Å; L251-F255 PolarHBondContact O-N 2.94Å; G252-F255 PolarHBondContact O-N 3.18Å; F255-Y257 VanDerWaalsContact C-N 3.31Å; F255-Y257 PolarHBondContact O-N 3.29Å; F255-F258 PolarHBondContact O-N 3.24Å; F255-L259 WeakPolarHBondContact O-CG 3.16Å; F255-L259 PolarHBondContact O-N 3.26Å; F255-L259 VanDerWaalsContact O-N 3.07Å; F255-M300 HydrophobicContact CB-SD 4.47Å; F255-Y303 HydrophobicContact CE2-CE1 4.31Å; F255-Y303 HydrophobicContact CE2-CE2 4.16Å; F255-Y303 AromaticContact CE2-CZ 3.9Å; F255-F325 HydrophobicContact CD2-CE2 4.12Å; F255-F325 HydrophobicContact CD2-CZ 4.26Å; F255-F325 AromaticContact CE2-CE2 3.96Å; F255-F325 HydrophobicContact CE2-CE2 3.96Å
256	M	98.9	Very high	98.7	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-65.6	-32.7	175.4	-66.3	-48.1	-51.8	0	0	113	G252 L259 R260 L263 L292 C293 F296 M300 L304	G252-M256 PolarHBondContact O-N 3.04Å; G252-M256 VanDerWaalsContact O-N 3.11Å; M256-L259 HydrophobicContact CE-CD1 4.36Å; M256-L259 HydrophobicContact SD-CD1 4.04Å; M256-R260 HydrophobicContact CE-CG 4.12Å; M256-R260 VanDerWaalsContact O-CB 3.24Å; M256-R260 WeakPolarHBondContact O-CB 3.22Å; M256-R260 VanDerWaalsContact O-CG 3.27Å; M256-R260 WeakPolarHBondContact O-CG 3.41Å; M256-R260 PolarHBondContact O-N 2.68Å; M256-L263 HydrophobicContact CB-CD2 4.06Å; M256-L292 HydrophobicContact CB-CD1 4.49Å; M256-L292 HydrophobicContact CB-CG 4.42Å; M256-L292 WeakPolarHBondContact CE-O 3.4Å; M256-L292 HydrophobicContact CG-CD2 4.42Å; M256-L292 HydrophobicContact CG-CG 4.29Å; M256-C293 HydrophobicContact CE-CB 4.39Å; M256-C293 VanDerWaalsContact SD-SG 3.62Å; M256-F296 HydrophobicContact CE-CB 4.31Å; M256-F296 HydrophobicContact CE-CD2 3.71Å; M256-F296 HydrophobicContact CE-CE2 4.29Å; M256-F296 HydrophobicContact CE-CG 4.02Å; M256-M300 HydrophobicContact SD-CB 3.69Å; M256-M300 HydrophobicContact SD-CG 4.03Å; M256-M300 HydrophobicContact SD-SD 4.29Å; M256-L304 HydrophobicContact CG-CD1 4.06Å
257	Y	98.9	Very high	98.4	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.7	-46.6	171.2	167.5	-101.1	0	0	0	112.1	E140 F143 R148 P181 R230 Y231 H253 M254 F255 G261 L263	E140-Y257 PolarHBondContact OE1-OH 3.1Å; E140-Y257 WeakPolarHBondContact OE2-CE1 3.32Å; E140-Y257 PolarHBondContact OE2-OH 3.01Å; F143-Y257 AromaticContact CD1-CE1 3.78Å; F143-Y257 HydrophobicContact CD1-CE1 3.78Å; F143-Y257 HydrophobicContact CE1-CD1 4.07Å; F143-Y257 AromaticContact CE1-CE1 3.44Å; F143-Y257 HydrophobicContact CE1-CE1 3.44Å; F143-Y257 VanDerWaalsContact CE1-CE1 3.44Å; F143-Y257 HydrophobicContact CE1-CE2 4.22Å; F143-Y257 AromaticContact CE1-CZ 3.58Å; F143-Y257 HydrophobicContact CZ-CD1 4.34Å; F143-Y257 HydrophobicContact CZ-CE1 4.15Å; R148-Y257 PolarHBondContact NH2-OH 3.28Å; P181-Y257 HydrophobicContact CG-CD1 4.08Å; P181-Y257 HydrophobicContact CG-CE1 3.77Å; R230-Y257 PolarHBondContact NH1-OH 3.37Å; Y231-Y257 HydrophobicContact CE1-CD1 4.1Å; Y231-Y257 HydrophobicContact CE1-CD2 4.31Å; Y231-Y257 AromaticContact CE1-CG 3.92Å; Y231-Y257 HydrophobicContact CE1-CG 3.92Å; Y231-Y257 VanDerWaalsContact OH-CE1 3.27Å; Y231-Y257 WeakPolarHBondContact OH-CE1 3.23Å; Y231-Y257 VanDerWaalsContact OH-CZ 3.26Å; H253-Y257 WeakPolarHBondContact O-CB 3.38Å; H253-Y257 PolarHBondContact O-N 2.67Å; M254-Y257 WeakPolarHBondContact O-CB 3.27Å; M254-Y257 PolarHBondContact O-N 3.36Å; F255-Y257 VanDerWaalsContact C-N 3.31Å; F255-Y257 PolarHBondContact O-N 3.29Å; Y257-G261 WeakPolarHBondContact O-CA 3.36Å; Y257-G261 PolarHBondContact O-N 2.63Å; Y257-L263 HydrophobicContact CD2-CD1 4.4Å; Y257-L263 HydrophobicContact CD2-CG 4.37Å
258	F	98.9	Very high	98.1	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64.6	-39.6	178.2	-67.4	-42.8	0	0	0	113.1	L139 F143 F150 V155 I158 P181 M254 F255	L139-F258 HydrophobicContact CB-CE1 4.29Å; L139-F258 HydrophobicContact CB-CZ 3.78Å; L139-F258 HydrophobicContact CD1-CE2 4.07Å; L139-F258 HydrophobicContact CD1-CZ 3.88Å; L139-F258 HydrophobicContact CG-CZ 4.46Å; F143-F258 HydrophobicContact CD1-CD1 4.49Å; F143-F258 AromaticContact CD2-CD1 3.81Å; F143-F258 HydrophobicContact CD2-CD1 3.81Å; F143-F258 HydrophobicContact CD2-CE1 4.49Å; F143-F258 HydrophobicContact CE2-CB 4.26Å; F143-F258 AromaticContact CE2-CD1 3.86Å; F143-F258 HydrophobicContact CE2-CD1 3.86Å; F143-F258 WeakPolarHBondContact CE2-O 3.07Å; F143-F258 HydrophobicContact CG-CD1 4.12Å; F143-F258 HydrophobicContact CG-CE1 4.42Å; F143-F258 HydrophobicContact CZ-CD1 4.2Å; F150-F258 HydrophobicContact CB-CB 4.36Å; F150-F258 HydrophobicContact CD2-CB 3.82Å; F150-F258 AromaticContact CD2-CD1 3.69Å; F150-F258 HydrophobicContact CD2-CD1 3.69Å; F150-F258 HydrophobicContact CD2-CD2 4.31Å; F150-F258 HydrophobicContact CD2-CE1 4.31Å; F150-F258 AromaticContact CD2-CG 3.7Å; F150-F258 HydrophobicContact CD2-CG 3.7Å; F150-F258 AromaticContact CE2-CD1 3.69Å; F150-F258 HydrophobicContact CE2-CD1 3.69Å; F150-F258 AromaticContact CE2-CE1 3.86Å; F150-F258 HydrophobicContact CE2-CE1 3.86Å; F150-F258 HydrophobicContact CE2-CG 4.1Å; F150-F258 HydrophobicContact CE2-CZ 4.39Å; F150-F258 PolarHBondContact N-O 3.24Å; V155-F258 HydrophobicContact CG2-CB 3.71Å; I158-F258 HydrophobicContact CG2-CE2 4.34Å; P181-F258 HydrophobicContact CB-CE1 3.85Å; P181-F258 HydrophobicContact CB-CZ 3.76Å; P181-F258 HydrophobicContact CG-CE1 3.72Å; P181-F258 HydrophobicContact CG-CZ 3.68Å; M254-F258 HydrophobicContact CE-CE2 4.06Å; M254-F258 HydrophobicContact CE-CZ 4.49Å; M254-F258 HydrophobicContact CG-CD2 4.43Å; M254-F258 HydrophobicContact CG-CE2 3.81Å; M254-F258 HydrophobicContact CG-CZ 3.98Å; M254-F258 VanDerWaalsContact O-CD2 3.25Å; M254-F258 WeakPolarHBondContact O-CD2 3.4Å; M254-F258 WeakPolarHBondContact O-CG 3.39Å; M254-F258 PolarHBondContact O-N 3.13Å; M254-F258 VanDerWaalsContact O-N 3.09Å; M254-F258 HydrophobicContact SD-CE2 4.34Å; M254-F258 HydrophobicContact SD-CZ 4.31Å; F255-F258 PolarHBondContact O-N 3.24Å
259	L	98.8	Very high	97.9	Very high	15 Å²	15	29.9 Å²	29.9	8%	0.079	17%	0.172	C	C	.	.	H	α-helix	trans	-70.6	-38.8	178.6	-70.6	171.3	0	0	0	113	L152 V155 F255 M256 F296 M300	L152-L259 HydrophobicContact CD1-CD2 4.26Å; V155-L259 HydrophobicContact CB-CD2 3.97Å; V155-L259 HydrophobicContact CB-CG 4.28Å; V155-L259 HydrophobicContact CG1-CD1 4.37Å; V155-L259 HydrophobicContact CG1-CD2 4.26Å; V155-L259 HydrophobicContact CG1-CG 4.07Å; V155-L259 HydrophobicContact CG2-CD2 3.75Å; V155-L259 HydrophobicContact CG2-CG 4.02Å; F255-L259 WeakPolarHBondContact O-CG 3.16Å; F255-L259 PolarHBondContact O-N 3.26Å; F255-L259 VanDerWaalsContact O-N 3.07Å; M256-L259 HydrophobicContact CE-CD1 4.36Å; M256-L259 HydrophobicContact SD-CD1 4.04Å; L259-F296 HydrophobicContact CB-CD1 3.83Å; L259-F296 HydrophobicContact CB-CE1 3.65Å; L259-F296 HydrophobicContact CB-CZ 4.23Å; L259-F296 HydrophobicContact CD1-CD1 4.09Å; L259-F296 HydrophobicContact CD1-CG 4.45Å; L259-F296 HydrophobicContact CD2-CD1 4.32Å; L259-F296 HydrophobicContact CG-CD1 4.3Å; L259-M300 HydrophobicContact CD1-CE 3.94Å; L259-M300 HydrophobicContact CD1-CG 4.05Å; L259-M300 HydrophobicContact CD1-SD 3.85Å
260	R	98.5	Very high	97.7	Very high	84 Å²	84	31 Å²	31	32%	0.317	18%	0.182	S	C	.	.	H	α-helix	trans	-93.9	-11.4	-174	-64.5	-179.4	69.9	97.7	10.2	114.8	M256 S262 V291 L292 F296	M256-R260 HydrophobicContact CE-CG 4.12Å; M256-R260 VanDerWaalsContact O-CB 3.24Å; M256-R260 WeakPolarHBondContact O-CB 3.22Å; M256-R260 VanDerWaalsContact O-CG 3.27Å; M256-R260 WeakPolarHBondContact O-CG 3.41Å; M256-R260 PolarHBondContact O-N 2.68Å; R260-S262 VanDerWaalsContact CB-O 3.23Å; R260-S262 WeakPolarHBondContact CB-O 3.1Å; R260-S262 PolarHBondContact O-N 2.77Å; R260-V291 PolarHBondContact NH1-O 2.92Å; R260-L292 WeakPolarHBondContact CD-O 3.37Å; R260-L292 PolarHBondContact NH1-O 3.38Å; R260-F296 HydrophobicContact CG-CD2 4.36Å; R260-F296 HydrophobicContact CG-CE2 3.5Å; R260-F296 HydrophobicContact CG-CZ 3.71Å
261	G	98.4	Very high	97.5	Very high	14 Å²	14	38.3 Å²	38.3	14%	0.144	22%	0.221	C	C	.	.	S	Bend	trans	72.3	-24.7	-168.6	0	0	0	0	0	115.2	R148 Y257	R148-G261 WeakPolarHBondContact O-CA 3.35Å; Y257-G261 WeakPolarHBondContact O-CA 3.36Å; Y257-G261 PolarHBondContact O-N 2.63Å
262	S	98.1	Very high	97.2	Very high	62 Å²	62	41.6 Å²	41.6	43%	0.434	24%	0.24	S	C	.	.	S	Bend	trans	-157.7	154.3	174.3	60	0	0	0	0	112.4	R260	R260-S262 VanDerWaalsContact CB-O 3.23Å; R260-S262 WeakPolarHBondContact CB-O 3.1Å; R260-S262 PolarHBondContact O-N 2.77Å
263	L	98.6	Very high	96.7	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.021	26%	0.26	C	S	.	.			trans	-96.7	148	173.9	-65.7	164.5	0	0	0	111	R230 Y231 M256 Y257 W265 Q266 L292	R230-L263 HydrophobicContact CG-CD1 4.23Å; Y231-L263 HydrophobicContact CD1-CD1 4.38Å; Y231-L263 HydrophobicContact CE1-CD1 4.36Å; M256-L263 HydrophobicContact CB-CD2 4.06Å; Y257-L263 HydrophobicContact CD2-CD1 4.4Å; Y257-L263 HydrophobicContact CD2-CG 4.37Å; L263-W265 HydrophobicContact CB-CD2 4.11Å; L263-W265 HydrophobicContact CB-CG 4.49Å; L263-W265 HydrophobicContact CB-CZ2 3.91Å; L263-W265 HydrophobicContact CD1-CZ2 3.72Å; L263-W265 HydrophobicContact CD2-CH2 4.15Å; L263-W265 HydrophobicContact CD2-CZ2 3.82Å; L263-W265 HydrophobicContact CG-CZ2 4.02Å; L263-W265 PolarHBondContact O-N 2.81Å; L263-Q266 HydrophobicContact CB-CG 4.4Å; L263-Q266 WeakPolarHBondContact O-CB 3.47Å; L263-Q266 PolarHBondContact O-N 3.32Å; L263-L292 HydrophobicContact CD2-CD1 3.98Å
264	P	98.3	Very high	96.3	Very high	59 Å²	59	53.6 Å²	53.6	38%	0.383	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-29	-175.5	-28.5	36.4	0	0	0	115.4	Q266 T287 L292	P264-Q266 VanDerWaalsContact C-N 3.33Å; P264-Q266 PolarHBondContact O-N 2.91Å; P264-T287 HydrophobicContact CG-CG2 4.33Å; P264-L292 HydrophobicContact CG-CD1 4.14Å
265	W	98.4	Very high	96.1	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.015	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	11.7	178.8	50.6	82.9	0	0	0	114.6	R230 H253 L263 L268 I280 T283 K284 L292	R230-W265 PolarHBondContact O-NE1 2.95Å; H253-W265 HydrophobicContact CB-CZ2 4.38Å; H253-W265 AromaticContact CD2-CH2 3.65Å; H253-W265 AromaticContact CD2-CZ2 3.68Å; H253-W265 AromaticContact NE2-CH2 3.97Å; L263-W265 HydrophobicContact CB-CD2 4.11Å; L263-W265 HydrophobicContact CB-CG 4.49Å; L263-W265 HydrophobicContact CB-CZ2 3.91Å; L263-W265 HydrophobicContact CD1-CZ2 3.72Å; L263-W265 HydrophobicContact CD2-CH2 4.15Å; L263-W265 HydrophobicContact CD2-CZ2 3.82Å; L263-W265 HydrophobicContact CG-CZ2 4.02Å; L263-W265 PolarHBondContact O-N 2.81Å; W265-L268 HydrophobicContact CB-CD1 4Å; W265-I280 HydrophobicContact CB-CG1 4.48Å; W265-I280 HydrophobicContact CB-CG2 4.16Å; W265-I280 HydrophobicContact CG-CG2 4.12Å; W265-T283 HydrophobicContact CB-CG2 3.84Å; W265-K284 HydrophobicContact CD2-CD 4.37Å; W265-K284 HydrophobicContact CD2-CG 3.55Å; W265-K284 HydrophobicContact CE3-CB 4.49Å; W265-K284 HydrophobicContact CE3-CG 3.62Å; W265-K284 HydrophobicContact CG-CG 4.11Å; W265-K284 HydrophobicContact CH2-CG 3.99Å; W265-K284 HydrophobicContact CZ2-CD 4.34Å; W265-K284 VanDerWaalsContact CZ2-CE 3.45Å; W265-K284 HydrophobicContact CZ2-CG 3.94Å; W265-K284 HydrophobicContact CZ3-CG 3.85Å; W265-L292 HydrophobicContact CH2-CD1 4.07Å; W265-L292 HydrophobicContact CH2-CD2 3.8Å; W265-L292 HydrophobicContact CZ3-CD1 4.19Å; W265-L292 HydrophobicContact CZ3-CD2 4.31Å
266	Q	96.6	Very high	95.8	Very high	63 Å²	63	60.9 Å²	60.9	29%	0.294	33%	0.326	S	S	.	.	S	Bend	trans	-81.4	148.8	172.2	-75.7	-178.8	-117.8	0	0	112.3	R230 L263 P264 L268	R230-Q266 HydrophobicContact CG-CG 4.03Å; L263-Q266 HydrophobicContact CB-CG 4.4Å; L263-Q266 WeakPolarHBondContact O-CB 3.47Å; L263-Q266 PolarHBondContact O-N 3.32Å; P264-Q266 VanDerWaalsContact C-N 3.33Å; P264-Q266 PolarHBondContact O-N 2.91Å; Q266-L268 PolarHBondContact O-N 2.98Å
267	G	93.3	Very high	95.5	Very high	76 Å²	76	62.4 Å²	62.4	78%	0.784	33%	0.332	S	S	*	.	S	Bend	trans	77.4	-3.3	177	0	0	0	0	0	115.7	K269	G267-K269 PolarHBondContact O-N 3.02Å
268	L	93.9	Very high	95.3	Very high	52 Å²	52	67 Å²	67	27%	0.272	35%	0.353	S	S	.	.			trans	-55.8	134.4	176.9	-62.2	179.5	0	0	0	112	W265 Q266 K279 I280 T283	W265-L268 HydrophobicContact CB-CD1 4Å; Q266-L268 PolarHBondContact O-N 2.98Å; L268-K279 HydrophobicContact CD1-CB 4.38Å; L268-I280 HydrophobicContact CD1-CG1 4Å; L268-T283 WeakPolarHBondContact CD1-OG1 3.4Å
269	K	93.3	Very high	95.3	Very high	183 Å²	183	71.1 Å²	71.1	80%	0.796	37%	0.371	S	S	*	.			trans	-105.6	142	-179.8	-62	-177.9	-177.7	178.1	0	111.4	G267 K279	G267-K269 PolarHBondContact O-N 3.02Å; K269-K279 WeakPolarHBondContact O-CD 3.38Å; K269-K279 PolarHBondContact O-NZ 2.87Å
270	A	94.2	Very high	95.2	Very high	25 Å²	25	71 Å²	71	21%	0.207	37%	0.371	C	S	.	.			trans	-153.8	168.1	167.9	0	0	0	0	0	108.7	E275 R276 K279	A270-E275 HydrophobicContact CB-CB 3.49Å; A270-E275 VanDerWaalsContact CB-CB 3.49Å; A270-R276 HydrophobicContact CB-CB 3.98Å; A270-K279 HydrophobicContact CB-CD 4.05Å
271	D	94.8	Very high	95.2	Very high	160 Å²	160	67.1 Å²	67.1	86%	0.856	36%	0.357	S	S	*	.	S	Bend	trans	-89.3	-28.5	-171.9	-56.1	-42.1	0	0	0	110.8	E275	D271-E275 PolarHBondContact N-OE2 3.22Å
272	T	94.3	Very high	95.2	Very high	68 Å²	68	68.4 Å²	68.4	42%	0.417	36%	0.36	S	S	.	.	S	Bend	trans	-112.7	155.7	168.1	70.1	0	0	0	0	113.5	K274 E275 R276	T272-K274 PolarHBondContact O-N 3.48Å; T272-E275 WeakPolarHBondContact CB-OE1 3.25Å; T272-E275 VanDerWaalsContact CG2-OE1 3.24Å; T272-E275 WeakPolarHBondContact CG2-OE1 3.48Å; T272-E275 PolarHBondContact N-OE1 2.92Å; T272-E275 PolarHBondContact N-OE2 2.86Å; T272-E275 PolarHBondContact O-N 2.99Å; T272-E275 WeakPolarHBondContact OG1-CG 3.49Å; T272-E275 PolarHBondContact OG1-N 2.94Å; T272-E275 PolarHBondContact OG1-OE1 3.15Å; T272-R276 PolarHBondContact O-N 3.47Å
273	L	88.3	Confident	95.2	Very high	82 Å²	82	67.1 Å²	67.1	43%	0.429	35%	0.35	S	S	.	.	H	α-helix	trans	-59.8	-36.3	173.6	-169.9	65.2	0	0	0	111.7	R276 Y277	L273-R276 PolarHBondContact O-N 2.69Å; L273-Y277 HydrophobicContact CD1-CD2 4.1Å; L273-Y277 HydrophobicContact CD1-CE2 3.72Å; L273-Y277 HydrophobicContact CG-CD2 4.12Å; L273-Y277 HydrophobicContact CG-CE2 3.92Å; L273-Y277 VanDerWaalsContact O-CD2 3.29Å; L273-Y277 WeakPolarHBondContact O-CD2 3.45Å; L273-Y277 PolarHBondContact O-N 3.16Å
274	K	89.6	Confident	95.2	Very high	172 Å²	172	67 Å²	67	75%	0.748	35%	0.349	S	S	*	.	H	α-helix	trans	-62.1	-49.8	177.9	-175.7	177.9	178.5	179.8	0	111.7	T272 R276 Y277 Q278	T272-K274 PolarHBondContact O-N 3.48Å; K274-R276 VanDerWaalsContact C-N 3.31Å; K274-R276 PolarHBondContact O-N 2.77Å; K274-Y277 PolarHBondContact O-N 2.76Å; K274-Q278 PolarHBondContact O-N 3.16Å
275	E	94.2	Very high	95.2	Very high	69 Å²	69	69.9 Å²	69.9	32%	0.322	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-37.8	173.2	-68.7	148.8	-130	0	0	112.3	A270 D271 T272 Y277 Q278 K279	A270-E275 HydrophobicContact CB-CB 3.49Å; A270-E275 VanDerWaalsContact CB-CB 3.49Å; D271-E275 PolarHBondContact N-OE2 3.22Å; T272-E275 WeakPolarHBondContact CB-OE1 3.25Å; T272-E275 VanDerWaalsContact CG2-OE1 3.24Å; T272-E275 WeakPolarHBondContact CG2-OE1 3.48Å; T272-E275 PolarHBondContact N-OE1 2.92Å; T272-E275 PolarHBondContact N-OE2 2.86Å; T272-E275 PolarHBondContact O-N 2.99Å; T272-E275 WeakPolarHBondContact OG1-CG 3.49Å; T272-E275 PolarHBondContact OG1-N 2.94Å; T272-E275 PolarHBondContact OG1-OE1 3.15Å; E275-Y277 VanDerWaalsContact C-N 3.32Å; E275-Y277 PolarHBondContact O-N 2.91Å; E275-Q278 PolarHBondContact O-N 3.18Å; E275-K279 WeakPolarHBondContact O-CG 3.32Å; E275-K279 PolarHBondContact O-N 2.87Å
276	R	94.1	Very high	95.2	Very high	86 Å²	86	75.4 Å²	75.4	33%	0.325	38%	0.382	S	S	.	.	H	α-helix	trans	-63.5	-40.5	179.5	-174.8	174.8	170.6	-127	-1.3	111.2	A270 T272 L273 K274 I280 D408	A270-R276 HydrophobicContact CB-CB 3.98Å; T272-R276 PolarHBondContact O-N 3.47Å; L273-R276 PolarHBondContact O-N 2.69Å; K274-R276 VanDerWaalsContact C-N 3.31Å; K274-R276 PolarHBondContact O-N 2.77Å; R276-I280 HydrophobicContact CG-CD1 4.38Å; R276-I280 WeakPolarHBondContact O-CD1 3.17Å; R276-I280 VanDerWaalsContact O-CG1 3.23Å; R276-I280 WeakPolarHBondContact O-CG1 3.18Å; R276-I280 PolarHBondContact O-N 2.98Å; R276-D408 IonicContact CZ-OD2 3.61Å; R276-D408 IonicContact NH1-OD2 2.65Å; R276-D408 PolarHBondContact NH1-OD2 3.43Å; R276-D408 IonicContact NH2-OD2 2.73Å; R276-D408 PolarHBondContact NH2-OD2 2.81Å
277	Y	92.9	Very high	95.3	Very high	33 Å²	33	73.2 Å²	73.2	13%	0.129	37%	0.373	C	S	.	.	H	α-helix	trans	-66.2	-46.8	171.7	-84.7	-122.3	0	0	0	110.8	L225 A229 M232 H237 L273 K274 E275 K279 I280 G281	L225-Y277 HydrophobicContact CB-CD1 3.98Å; L225-Y277 HydrophobicContact CB-CE1 4.14Å; L225-Y277 HydrophobicContact CD1-CD1 3.79Å; L225-Y277 HydrophobicContact CD1-CG 4.14Å; L225-Y277 HydrophobicContact CD2-CD1 4.23Å; L225-Y277 HydrophobicContact CG-CD1 4.2Å; A229-Y277 HydrophobicContact CB-CD1 3.89Å; A229-Y277 HydrophobicContact CB-CD2 4.26Å; A229-Y277 HydrophobicContact CB-CE1 3.61Å; A229-Y277 HydrophobicContact CB-CE2 3.98Å; A229-Y277 HydrophobicContact CB-CG 4.23Å; M232-Y277 HydrophobicContact CE-CD1 4.47Å; M232-Y277 HydrophobicContact CE-CE1 3.99Å; H237-Y277 PolarHBondContact CE1-O 3.04Å; H237-Y277 VanDerWaalsContact CE1-O 3.27Å; H237-Y277 PolarHBondContact ND1-O 2.6Å; L273-Y277 HydrophobicContact CD1-CD2 4.1Å; L273-Y277 HydrophobicContact CD1-CE2 3.72Å; L273-Y277 HydrophobicContact CG-CD2 4.12Å; L273-Y277 HydrophobicContact CG-CE2 3.92Å; L273-Y277 VanDerWaalsContact O-CD2 3.29Å; L273-Y277 WeakPolarHBondContact O-CD2 3.45Å; L273-Y277 PolarHBondContact O-N 3.16Å; K274-Y277 PolarHBondContact O-N 2.76Å; E275-Y277 VanDerWaalsContact C-N 3.32Å; E275-Y277 PolarHBondContact O-N 2.91Å; Y277-K279 PolarHBondContact O-N 3.41Å; Y277-I280 WeakPolarHBondContact O-CB 3.31Å; Y277-I280 PolarHBondContact O-N 3.26Å; Y277-I280 VanDerWaalsContact O-N 3.08Å; Y277-G281 PolarHBondContact O-N 2.83Å
278	Q	94.5	Very high	95.5	Very high	95 Å²	95	72.7 Å²	72.7	44%	0.444	36%	0.356	S	S	.	.	H	α-helix	trans	-53.9	-52.9	177.4	-172	62	60.9	0	0	111.8	K274 E275 I280 G281 D282	K274-Q278 PolarHBondContact O-N 3.16Å; E275-Q278 PolarHBondContact O-N 3.18Å; Q278-I280 VanDerWaalsContact C-N 3.26Å; Q278-I280 PolarHBondContact O-N 2.72Å; Q278-G281 CarbonylContact O-C 3.28Å; Q278-G281 WeakPolarHBondContact O-CA 3.25Å; Q278-G281 PolarHBondContact O-N 2.75Å; Q278-D282 PolarHBondContact NE2-OD1 2.7Å; Q278-D282 PolarHBondContact O-N 2.9Å
279	K	97.6	Very high	95.8	Very high	88 Å²	88	71.1 Å²	71.1	38%	0.383	35%	0.348	S	S	.	.	H	α-helix	trans	-58.7	-34	177.5	-68.4	-179.7	-166.5	-178.1	0	113	L268 K269 A270 E275 Y277 T283	L268-K279 HydrophobicContact CD1-CB 4.38Å; K269-K279 WeakPolarHBondContact O-CD 3.38Å; K269-K279 PolarHBondContact O-NZ 2.87Å; A270-K279 HydrophobicContact CB-CD 4.05Å; E275-K279 WeakPolarHBondContact O-CG 3.32Å; E275-K279 PolarHBondContact O-N 2.87Å; Y277-K279 PolarHBondContact O-N 3.41Å; K279-T283 WeakPolarHBondContact O-CB 3.24Å; K279-T283 PolarHBondContact O-N 2.6Å; K279-T283 PolarHBondContact O-OG1 2.73Å
280	I	98.1	Very high	96	Very high	13 Å²	13	67.4 Å²	67.4	7%	0.067	33%	0.333	C	S	.	.	H	α-helix	trans	-68.9	-43.5	173.8	-70.2	165.2	0	0	0	110.5	A229 W265 L268 R276 Y277 Q278 K284	A229-I280 HydrophobicContact CB-CD1 4.12Å; W265-I280 HydrophobicContact CB-CG1 4.48Å; W265-I280 HydrophobicContact CB-CG2 4.16Å; W265-I280 HydrophobicContact CG-CG2 4.12Å; L268-I280 HydrophobicContact CD1-CG1 4Å; R276-I280 HydrophobicContact CG-CD1 4.38Å; R276-I280 WeakPolarHBondContact O-CD1 3.17Å; R276-I280 VanDerWaalsContact O-CG1 3.23Å; R276-I280 WeakPolarHBondContact O-CG1 3.18Å; R276-I280 PolarHBondContact O-N 2.98Å; Y277-I280 WeakPolarHBondContact O-CB 3.31Å; Y277-I280 PolarHBondContact O-N 3.26Å; Y277-I280 VanDerWaalsContact O-N 3.08Å; Q278-I280 VanDerWaalsContact C-N 3.26Å; Q278-I280 PolarHBondContact O-N 2.72Å; I280-K284 HydrophobicContact CG2-CD 4.26Å; I280-K284 WeakPolarHBondContact O-CB 3.39Å; I280-K284 VanDerWaalsContact O-CG 3.31Å; I280-K284 WeakPolarHBondContact O-CG 3.44Å; I280-K284 PolarHBondContact O-N 2.72Å
281	G	97.9	Very high	96.2	Very high	2 Å²	2	70 Å²	70	2%	0.021	35%	0.346	C	S	.	.	H	α-helix	trans	-64.1	-39.4	176	0	0	0	0	0	113.3	H237 Y277 Q278 K284 R285	H237-G281 VanDerWaalsContact CG-CA 3.42Å; Y277-G281 PolarHBondContact O-N 2.83Å; Q278-G281 CarbonylContact O-C 3.28Å; Q278-G281 WeakPolarHBondContact O-CA 3.25Å; Q278-G281 PolarHBondContact O-N 2.75Å; G281-K284 PolarHBondContact O-N 3.24Å; G281-R285 WeakPolarHBondContact O-CG 3.4Å; G281-R285 PolarHBondContact O-N 2.65Å
282	D	98.1	Very high	96.4	Very high	40 Å²	40	62.5 Å²	62.5	21%	0.214	31%	0.306	C	S	.	.	H	α-helix	trans	-63.9	-56.4	174.4	-58.6	-25.8	0	0	0	110	Q278 K284 R285 D286	Q278-D282 PolarHBondContact NE2-OD1 2.7Å; Q278-D282 PolarHBondContact O-N 2.9Å; D282-K284 PolarHBondContact O-N 3.38Å; D282-R285 WeakPolarHBondContact O-CA 3.37Å; D282-R285 WeakPolarHBondContact O-CB 3.45Å; D282-R285 PolarHBondContact O-N 2.9Å; D282-R285 IonicContact OD1-CZ 3.71Å; D282-R285 IonicContact OD1-NE 2.79Å; D282-R285 IonicContact OD1-NH2 2.68Å; D282-R285 PolarHBondContact OD1-NH2 2.91Å; D282-D286 VanDerWaalsContact O-CG 3.22Å; D282-D286 PolarHBondContact O-N 3.08Å
283	T	98.5	Very high	96.6	Very high	36 Å²	36	59.6 Å²	59.6	22%	0.221	29%	0.288	C	S	.	.	H	α-helix	trans	-54.9	-33.3	176.7	-51.5	0	0	0	0	112.6	W265 L268 K279 T287	W265-T283 HydrophobicContact CB-CG2 3.84Å; L268-T283 WeakPolarHBondContact CD1-OG1 3.4Å; K279-T283 WeakPolarHBondContact O-CB 3.24Å; K279-T283 PolarHBondContact O-N 2.6Å; K279-T283 PolarHBondContact O-OG1 2.73Å; T283-T287 VanDerWaalsContact O-CB 3.29Å; T283-T287 WeakPolarHBondContact O-CB 3.33Å; T283-T287 PolarHBondContact O-N 3.19Å; T283-T287 PolarHBondContact O-OG1 3.44Å
284	K	98.6	Very high	97	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-68.7	-31.6	174.8	-85	177.9	169.7	-178.3	0	114.4	A229 R230 M232 I234 W265 I280 G281 D282	A229-K284 PolarHBondContact O-NZ 3.35Å; R230-K284 WeakPolarHBondContact O-CE 3.21Å; R230-K284 PolarHBondContact O-NZ 2.84Å; M232-K284 PolarHBondContact O-NZ 3.3Å; I234-K284 WeakPolarHBondContact CD1-O 3.45Å; I234-K284 HydrophobicContact CG1-CB 4.03Å; W265-K284 HydrophobicContact CD2-CD 4.37Å; W265-K284 HydrophobicContact CD2-CG 3.55Å; W265-K284 HydrophobicContact CE3-CB 4.49Å; W265-K284 HydrophobicContact CE3-CG 3.62Å; W265-K284 HydrophobicContact CG-CG 4.11Å; W265-K284 HydrophobicContact CH2-CG 3.99Å; W265-K284 HydrophobicContact CZ2-CD 4.34Å; W265-K284 VanDerWaalsContact CZ2-CE 3.45Å; W265-K284 HydrophobicContact CZ2-CG 3.94Å; W265-K284 HydrophobicContact CZ3-CG 3.85Å; I280-K284 HydrophobicContact CG2-CD 4.26Å; I280-K284 WeakPolarHBondContact O-CB 3.39Å; I280-K284 VanDerWaalsContact O-CG 3.31Å; I280-K284 WeakPolarHBondContact O-CG 3.44Å; I280-K284 PolarHBondContact O-N 2.72Å; G281-K284 PolarHBondContact O-N 3.24Å; D282-K284 PolarHBondContact O-N 3.38Å
285	R	97.9	Very high	97.4	Very high	120 Å²	120	59.8 Å²	59.8	45%	0.453	30%	0.295	S	S	.	.	H	α-helix	trans	-79.5	-42.1	174.7	-68.5	-176.3	-64.5	149.5	-3.6	111.1	I234 G281 D282 T287	I234-R285 HydrophobicContact CD1-CG 4.13Å; I234-R285 HydrophobicContact CG1-CG 4.2Å; I234-R285 HydrophobicContact CG2-CG 3.64Å; G281-R285 WeakPolarHBondContact O-CG 3.4Å; G281-R285 PolarHBondContact O-N 2.65Å; D282-R285 WeakPolarHBondContact O-CA 3.37Å; D282-R285 WeakPolarHBondContact O-CB 3.45Å; D282-R285 PolarHBondContact O-N 2.9Å; D282-R285 IonicContact OD1-CZ 3.71Å; D282-R285 IonicContact OD1-NE 2.79Å; D282-R285 IonicContact OD1-NH2 2.68Å; D282-R285 PolarHBondContact OD1-NH2 2.91Å; R285-T287 VanDerWaalsContact C-N 3.31Å; R285-T287 PolarHBondContact O-N 2.79Å
286	D	98.4	Very high	97.6	Very high	120 Å²	120	59.6 Å²	59.6	64%	0.642	29%	0.293	S	S	*	.	H	α-helix	trans	-81.3	-10.9	-173.4	-55.9	-21.7	0	0	0	112.8	D282 P288	D282-D286 VanDerWaalsContact O-CG 3.22Å; D282-D286 PolarHBondContact O-N 3.08Å; D286-P288 WeakPolarHBondContact O-CD 3.39Å
287	T	98.6	Very high	97.8	Very high	18 Å²	18	57 Å²	57	11%	0.11	29%	0.287	C	S	.	.	S	Bend	trans	-90.1	111.8	168.4	-54.8	0	0	0	0	109.9	P264 T283 R285 V291 L292	P264-T287 HydrophobicContact CG-CG2 4.33Å; T283-T287 VanDerWaalsContact O-CB 3.29Å; T283-T287 WeakPolarHBondContact O-CB 3.33Å; T283-T287 PolarHBondContact O-N 3.19Å; T283-T287 PolarHBondContact O-OG1 3.44Å; R285-T287 VanDerWaalsContact C-N 3.31Å; R285-T287 PolarHBondContact O-N 2.79Å; T287-V291 HydrophobicContact CG2-CB 4.49Å; T287-V291 HydrophobicContact CG2-CG1 4.43Å; T287-L292 HydrophobicContact CG2-CB 4.11Å
288	P	98.4	Very high	98.1	Very high	64 Å²	64	60.4 Å²	60.4	42%	0.416	30%	0.304	S	S	.	.			trans	-59.2	152.2	171.8	-21.8	33.1	0	0	0	111.8	D286 E290 V291 L292	D286-P288 WeakPolarHBondContact O-CD 3.39Å; P288-E290 WeakPolarHBondContact CB-OE2 3.17Å; P288-E290 PolarHBondContact O-N 3.23Å; P288-V291 HydrophobicContact CB-CB 4.32Å; P288-V291 HydrophobicContact CB-CG2 4Å; P288-V291 HydrophobicContact CG-CB 4.44Å; P288-V291 HydrophobicContact CG-CG2 3.89Å; P288-V291 PolarHBondContact O-N 3.03Å; P288-L292 PolarHBondContact O-N 3.37Å
289	I	98.8	Very high	98.3	Very high	20 Å²	20	57 Å²	57	10%	0.103	29%	0.288	C	S	.	.	H	α-helix	trans	-65.1	-35.8	-180	-63.3	166	0	0	0	109.7	V291 L292 C293 A301 L304 R305	I289-V291 VanDerWaalsContact C-N 3.32Å; I289-V291 PolarHBondContact O-N 3.34Å; I289-L292 PolarHBondContact O-N 2.93Å; I289-C293 WeakPolarHBondContact O-CB 3.39Å; I289-C293 PolarHBondContact O-N 2.99Å; I289-A301 HydrophobicContact CG2-CB 3.94Å; I289-L304 HydrophobicContact CD1-CB 4.38Å; I289-L304 HydrophobicContact CG1-CB 4.44Å; I289-L304 HydrophobicContact CG2-CB 3.67Å; I289-L304 HydrophobicContact CG2-CD1 4.2Å; I289-R305 HydrophobicContact CB-CG 4.48Å; I289-R305 HydrophobicContact CD1-CB 4.39Å; I289-R305 HydrophobicContact CD1-CG 3.62Å; I289-R305 HydrophobicContact CG2-CG 4.27Å
290	E	98.2	Very high	98.3	Very high	104 Å²	104	53 Å²	53	49%	0.486	27%	0.271	S	S	.	.	H	α-helix	trans	-64	-35.7	178.7	-59.3	67.6	-148.6	0	0	111.3	P288 E294	P288-E290 WeakPolarHBondContact CB-OE2 3.17Å; P288-E290 PolarHBondContact O-N 3.23Å; E290-E294 WeakPolarHBondContact O-CA 3.32Å; E290-E294 PolarHBondContact O-N 3.13Å
291	V	98.4	Very high	98.4	Very high	80 Å²	80	52.3 Å²	52.3	49%	0.485	27%	0.267	S	S	.	.	H	α-helix	trans	-78.1	-36.8	174.4	176.4	0	0	0	0	111.3	R260 T287 P288 I289 E294	R260-V291 PolarHBondContact NH1-O 2.92Å; T287-V291 HydrophobicContact CG2-CB 4.49Å; T287-V291 HydrophobicContact CG2-CG1 4.43Å; P288-V291 HydrophobicContact CB-CB 4.32Å; P288-V291 HydrophobicContact CB-CG2 4Å; P288-V291 HydrophobicContact CG-CB 4.44Å; P288-V291 HydrophobicContact CG-CG2 3.89Å; P288-V291 PolarHBondContact O-N 3.03Å; I289-V291 VanDerWaalsContact C-N 3.32Å; I289-V291 PolarHBondContact O-N 3.34Å; V291-E294 WeakPolarHBondContact O-CB 3.17Å
292	L	98.6	Very high	98.4	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-66.2	-38.3	175	-179.6	62.2	0	0	0	111.9	M256 R260 L263 P264 W265 T287 P288 I289 L304	M256-L292 HydrophobicContact CB-CD1 4.49Å; M256-L292 HydrophobicContact CB-CG 4.42Å; M256-L292 WeakPolarHBondContact CE-O 3.4Å; M256-L292 HydrophobicContact CG-CD2 4.42Å; M256-L292 HydrophobicContact CG-CG 4.29Å; R260-L292 WeakPolarHBondContact CD-O 3.37Å; R260-L292 PolarHBondContact NH1-O 3.38Å; L263-L292 HydrophobicContact CD2-CD1 3.98Å; P264-L292 HydrophobicContact CG-CD1 4.14Å; W265-L292 HydrophobicContact CH2-CD1 4.07Å; W265-L292 HydrophobicContact CH2-CD2 3.8Å; W265-L292 HydrophobicContact CZ3-CD1 4.19Å; W265-L292 HydrophobicContact CZ3-CD2 4.31Å; T287-L292 HydrophobicContact CG2-CB 4.11Å; P288-L292 PolarHBondContact O-N 3.37Å; I289-L292 PolarHBondContact O-N 2.93Å; L292-L304 HydrophobicContact CD2-CD1 3.82Å
293	C	98.6	Very high	98.5	Very high	7 Å²	7	51.5 Å²	51.5	5%	0.047	26%	0.263	C	S	.	.	S	Bend	trans	-95.3	3.5	-179.1	-64.4	0	0	0	0	114	M256 I289 N295 F296 M300 A301	M256-C293 HydrophobicContact CE-CB 4.39Å; M256-C293 VanDerWaalsContact SD-SG 3.62Å; I289-C293 WeakPolarHBondContact O-CB 3.39Å; I289-C293 PolarHBondContact O-N 2.99Å; C293-N295 PolarHBondContact O-N 2.9Å; C293-F296 WeakPolarHBondContact O-CB 3.27Å; C293-F296 PolarHBondContact O-N 3.46Å; C293-M300 HydrophobicContact CB-CB 4.49Å; C293-A301 HydrophobicContact CB-CB 3.89Å
294	E	97.8	Very high	98.5	Very high	114 Å²	114	49.8 Å²	49.8	53%	0.533	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	132.2	178.2	-164.3	-160.7	-142.8	0	0	111.8	E290 V291 F296	E290-E294 WeakPolarHBondContact O-CA 3.32Å; E290-E294 PolarHBondContact O-N 3.13Å; V291-E294 WeakPolarHBondContact O-CB 3.17Å; E294-F296 VanDerWaalsContact C-N 3.26Å; E294-F296 WeakPolarHBondContact O-CD2 3.14Å; E294-F296 WeakPolarHBondContact O-CE2 3.28Å; E294-F296 PolarHBondContact O-N 3.16Å
295	N	97.2	Very high	98.5	Very high	145 Å²	145	53.5 Å²	53.5	78%	0.775	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	11.7	-173.7	-50.9	-78.2	0	0	0	115.9	C293	C293-N295 PolarHBondContact O-N 2.9Å
296	F	98.4	Very high	98.5	Very high	64 Å²	64	50.3 Å²	50.3	28%	0.281	26%	0.255	S	S	.	.	S	Bend	trans	-117.5	165.4	170.9	-57.9	-81.5	0	0	0	111	M256 L259 R260 C293 E294	M256-F296 HydrophobicContact CE-CB 4.31Å; M256-F296 HydrophobicContact CE-CD2 3.71Å; M256-F296 HydrophobicContact CE-CE2 4.29Å; M256-F296 HydrophobicContact CE-CG 4.02Å; L259-F296 HydrophobicContact CB-CD1 3.83Å; L259-F296 HydrophobicContact CB-CE1 3.65Å; L259-F296 HydrophobicContact CB-CZ 4.23Å; L259-F296 HydrophobicContact CD1-CD1 4.09Å; L259-F296 HydrophobicContact CD1-CG 4.45Å; L259-F296 HydrophobicContact CD2-CD1 4.32Å; L259-F296 HydrophobicContact CG-CD1 4.3Å; R260-F296 HydrophobicContact CG-CD2 4.36Å; R260-F296 HydrophobicContact CG-CE2 3.5Å; R260-F296 HydrophobicContact CG-CZ 3.71Å; C293-F296 WeakPolarHBondContact O-CB 3.27Å; C293-F296 PolarHBondContact O-N 3.46Å; E294-F296 VanDerWaalsContact C-N 3.26Å; E294-F296 WeakPolarHBondContact O-CD2 3.14Å; E294-F296 WeakPolarHBondContact O-CE2 3.28Å; E294-F296 PolarHBondContact O-N 3.16Å
297	P	98.6	Very high	98.6	Very high	31 Å²	31	44.7 Å²	44.7	20%	0.201	23%	0.225	C	C	.	.			trans	-61.7	142.3	-178.4	-24.7	35.7	0	0	0	113.5	L152 E299 M300 L328	L152-P297 HydrophobicContact CD1-CG 3.97Å; L152-P297 HydrophobicContact CD2-CG 3.68Å; L152-P297 HydrophobicContact CG-CG 4.5Å; P297-E299 WeakPolarHBondContact CB-OE2 3.45Å; P297-E299 PolarHBondContact O-N 3.44Å; P297-M300 WeakPolarHBondContact O-CB 3.31Å; P297-M300 PolarHBondContact O-N 3.08Å; P297-L328 HydrophobicContact CB-CD1 3.92Å; P297-L328 HydrophobicContact CB-CD2 3.57Å; P297-L328 HydrophobicContact CB-CG 4.41Å; P297-L328 HydrophobicContact CG-CD1 4.29Å; P297-L328 HydrophobicContact CG-CD2 3.93Å
298	E	98.4	Very high	98.6	Very high	105 Å²	105	46.2 Å²	46.2	49%	0.491	23%	0.229	S	C	.	.	H	α-helix	trans	-61.4	-18.8	-175.4	-177.9	51	-141.7	0	0	113.3	M300 A301 T302 R305	E298-M300 PolarHBondContact O-N 2.98Å; E298-A301 PolarHBondContact O-N 3.14Å; E298-A301 WeakPolarHBondContact OE1-CB 3.45Å; E298-T302 WeakPolarHBondContact O-CB 3.45Å; E298-T302 PolarHBondContact O-N 3.1Å; E298-T302 PolarHBondContact O-OG1 3.16Å; E298-R305 IonicContact OE1-CZ 3.6Å; E298-R305 IonicContact OE1-NE 3.77Å; E298-R305 IonicContact OE1-NH2 2.64Å; E298-R305 PolarHBondContact OE1-NH2 3.09Å
299	E	98.8	Very high	98.6	Very high	24 Å²	24	53.2 Å²	53.2	11%	0.112	25%	0.247	C	C	.	.	H	α-helix	trans	-63.7	-28.2	172.8	-63.6	78.3	-176.6	0	0	112.2	P297 Y303 L324 F325 L328 R331	P297-E299 WeakPolarHBondContact CB-OE2 3.45Å; P297-E299 PolarHBondContact O-N 3.44Å; E299-Y303 VanDerWaalsContact O-CB 3.29Å; E299-Y303 WeakPolarHBondContact O-CB 3.49Å; E299-Y303 PolarHBondContact O-N 2.81Å; E299-L324 HydrophobicContact CB-CB 4.45Å; E299-F325 HydrophobicContact CB-CD1 4.37Å; E299-F325 HydrophobicContact CB-CE1 4.34Å; E299-L328 HydrophobicContact CB-CD2 4.05Å; E299-L328 HydrophobicContact CG-CB 4.14Å; E299-L328 HydrophobicContact CG-CD2 4.24Å; E299-R331 IonicContact OE1-CZ 2.68Å; E299-R331 IonicContact OE1-NH1 3.95Å; E299-R331 PolarHBondContact OE1-NH1 2.71Å; E299-R331 IonicContact OE1-NH2 2.72Å; E299-R331 PolarHBondContact OE1-NH2 2.76Å
300	M	98.8	Very high	98.6	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.015	24%	0.243	C	C	.	.	H	α-helix	trans	-69.3	-43.9	173.3	-62.7	-68.4	160.5	0	0	111.4	L152 L156 F255 M256 L259 C293 P297 E298 L304 F325	L152-M300 HydrophobicContact CD1-CE 4.06Å; L156-M300 HydrophobicContact CD2-CE 3.77Å; F255-M300 HydrophobicContact CB-SD 4.47Å; M256-M300 HydrophobicContact SD-CB 3.69Å; M256-M300 HydrophobicContact SD-CG 4.03Å; M256-M300 HydrophobicContact SD-SD 4.29Å; L259-M300 HydrophobicContact CD1-CE 3.94Å; L259-M300 HydrophobicContact CD1-CG 4.05Å; L259-M300 HydrophobicContact CD1-SD 3.85Å; C293-M300 HydrophobicContact CB-CB 4.49Å; P297-M300 WeakPolarHBondContact O-CB 3.31Å; P297-M300 PolarHBondContact O-N 3.08Å; E298-M300 PolarHBondContact O-N 2.98Å; M300-L304 PolarHBondContact O-N 3.17Å; M300-L304 VanDerWaalsContact O-N 3.14Å; M300-F325 HydrophobicContact CE-CD1 4.1Å; M300-F325 HydrophobicContact CE-CE1 3.64Å; M300-F325 HydrophobicContact CE-CZ 4.24Å; M300-F325 HydrophobicContact SD-CE1 3.72Å; M300-F325 HydrophobicContact SD-CZ 3.96Å
301	A	98.8	Very high	98.6	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-67	-40.8	174.3	0	0	0	0	0	110.9	I289 C293 E298 L304 R305	I289-A301 HydrophobicContact CG2-CB 3.94Å; C293-A301 HydrophobicContact CB-CB 3.89Å; E298-A301 PolarHBondContact O-N 3.14Å; E298-A301 WeakPolarHBondContact OE1-CB 3.45Å; A301-L304 PolarHBondContact O-N 2.97Å; A301-R305 VanDerWaalsContact O-CB 3.3Å; A301-R305 WeakPolarHBondContact O-CB 3.3Å; A301-R305 VanDerWaalsContact O-CG 3.29Å; A301-R305 WeakPolarHBondContact O-CG 3.33Å; A301-R305 PolarHBondContact O-N 3.41Å
302	T	98.9	Very high	98.6	Very high	23 Å²	23	49.5 Å²	49.5	14%	0.141	23%	0.227	C	C	.	.	H	α-helix	trans	-61.9	-44.5	175.9	-59.5	0	0	0	0	112	E298 R305 Y306 Y320 L324	E298-T302 WeakPolarHBondContact O-CB 3.45Å; E298-T302 PolarHBondContact O-N 3.1Å; E298-T302 PolarHBondContact O-OG1 3.16Å; T302-R305 PolarHBondContact O-N 3.01Å; T302-R305 PolarHBondContact OG1-NH2 3.42Å; T302-Y306 WeakPolarHBondContact O-CB 3.47Å; T302-Y306 PolarHBondContact O-N 3.41Å; T302-Y320 WeakPolarHBondContact CG2-OH 3.28Å; T302-L324 HydrophobicContact CG2-CD1 3.94Å; T302-L324 HydrophobicContact CG2-CD2 3.97Å
303	Y	98.9	Very high	98.6	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.008	25%	0.251	C	S	.	.	H	α-helix	trans	-55.5	-52.4	172.9	-178.7	-78.5	0	0	0	111	I163 L248 F255 E299 R305 Y306 V307 L321 F325	I163-Y303 HydrophobicContact CD1-CE2 3.87Å; I163-Y303 HydrophobicContact CG1-CE2 4.22Å; L248-Y303 WeakPolarHBondContact O-CE1 3.17Å; L248-Y303 PolarHBondContact O-OH 2.92Å; F255-Y303 HydrophobicContact CE2-CE1 4.31Å; F255-Y303 HydrophobicContact CE2-CE2 4.16Å; F255-Y303 AromaticContact CE2-CZ 3.9Å; E299-Y303 VanDerWaalsContact O-CB 3.29Å; E299-Y303 WeakPolarHBondContact O-CB 3.49Å; E299-Y303 PolarHBondContact O-N 2.81Å; Y303-R305 PolarHBondContact O-N 3.36Å; Y303-Y306 PolarHBondContact O-N 3.46Å; Y303-V307 HydrophobicContact CD1-CG1 4.29Å; Y303-V307 HydrophobicContact CD1-CG2 4.34Å; Y303-V307 HydrophobicContact CE1-CG1 3.92Å; Y303-V307 HydrophobicContact CE1-CG2 4.19Å; Y303-V307 WeakPolarHBondContact O-CG2 3.15Å; Y303-V307 PolarHBondContact O-N 3.48Å; Y303-L321 HydrophobicContact CD2-CB 4.35Å; Y303-L321 HydrophobicContact CD2-CD2 3.66Å; Y303-L321 HydrophobicContact CD2-CG 4.43Å; Y303-L321 HydrophobicContact CE2-CB 4.1Å; Y303-L321 HydrophobicContact CE2-CD1 4.07Å; Y303-L321 HydrophobicContact CE2-CD2 3.95Å; Y303-L321 HydrophobicContact CE2-CG 4.27Å; Y303-L321 HydrophobicContact CG-CD2 4.3Å; Y303-F325 HydrophobicContact CD2-CD2 4.49Å; Y303-F325 AromaticContact CD2-CE2 3.44Å; Y303-F325 HydrophobicContact CD2-CE2 3.44Å; Y303-F325 VanDerWaalsContact CD2-CE2 3.44Å; Y303-F325 AromaticContact CD2-CZ 3.5Å; Y303-F325 HydrophobicContact CD2-CZ 3.5Å; Y303-F325 AromaticContact CE2-CE2 3.81Å; Y303-F325 HydrophobicContact CE2-CE2 3.81Å; Y303-F325 HydrophobicContact CE2-CZ 4.28Å; Y303-F325 HydrophobicContact CG-CE2 4.18Å; Y303-F325 AromaticContact CG-CZ 3.79Å; Y303-F325 HydrophobicContact CG-CZ 3.79Å
304	L	98.9	Very high	98.6	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-65.8	-38.3	-179.7	-79.1	172.7	0	0	0	112.8	M256 I289 L292 M300 A301 Y306 V307 R308	M256-L304 HydrophobicContact CG-CD1 4.06Å; I289-L304 HydrophobicContact CD1-CB 4.38Å; I289-L304 HydrophobicContact CG1-CB 4.44Å; I289-L304 HydrophobicContact CG2-CB 3.67Å; I289-L304 HydrophobicContact CG2-CD1 4.2Å; L292-L304 HydrophobicContact CD2-CD1 3.82Å; M300-L304 PolarHBondContact O-N 3.17Å; M300-L304 VanDerWaalsContact O-N 3.14Å; A301-L304 PolarHBondContact O-N 2.97Å; L304-Y306 VanDerWaalsContact C-N 3.32Å; L304-Y306 PolarHBondContact O-N 3.17Å; L304-V307 HydrophobicContact CD2-CG2 4.44Å; L304-R308 VanDerWaalsContact O-CB 3.3Å; L304-R308 WeakPolarHBondContact O-CB 3.41Å; L304-R308 WeakPolarHBondContact O-CG 3.44Å; L304-R308 PolarHBondContact O-N 3.14Å; L304-R308 VanDerWaalsContact O-N 3.14Å
305	R	98.8	Very high	98.7	Very high	78 Å²	78	59.4 Å²	59.4	29%	0.294	27%	0.269	S	S	.	.	H	α-helix	trans	-64.9	-34	174.7	-77.4	-171.3	-71.2	92.5	-5.5	112.1	I289 E298 A301 T302 Y303 R309	I289-R305 HydrophobicContact CB-CG 4.48Å; I289-R305 HydrophobicContact CD1-CB 4.39Å; I289-R305 HydrophobicContact CD1-CG 3.62Å; I289-R305 HydrophobicContact CG2-CG 4.27Å; E298-R305 IonicContact OE1-CZ 3.6Å; E298-R305 IonicContact OE1-NE 3.77Å; E298-R305 IonicContact OE1-NH2 2.64Å; E298-R305 PolarHBondContact OE1-NH2 3.09Å; A301-R305 VanDerWaalsContact O-CB 3.3Å; A301-R305 WeakPolarHBondContact O-CB 3.3Å; A301-R305 VanDerWaalsContact O-CG 3.29Å; A301-R305 WeakPolarHBondContact O-CG 3.33Å; A301-R305 PolarHBondContact O-N 3.41Å; T302-R305 PolarHBondContact O-N 3.01Å; T302-R305 PolarHBondContact OG1-NH2 3.42Å; Y303-R305 PolarHBondContact O-N 3.36Å; R305-R309 VanDerWaalsContact O-CD 3.25Å; R305-R309 WeakPolarHBondContact O-CD 3.41Å; R305-R309 WeakPolarHBondContact O-CG 3.15Å
306	Y	98.9	Very high	98.7	Very high	53 Å²	53	52.5 Å²	52.5	21%	0.208	23%	0.233	C	C	.	.	H	α-helix	trans	-70.5	-58.8	173.9	178.4	-89.7	0	0	0	111.2	T302 Y303 L304 R308 R309 L310 D317 Y320 L321	T302-Y306 WeakPolarHBondContact O-CB 3.47Å; T302-Y306 PolarHBondContact O-N 3.41Å; Y303-Y306 PolarHBondContact O-N 3.46Å; L304-Y306 VanDerWaalsContact C-N 3.32Å; L304-Y306 PolarHBondContact O-N 3.17Å; Y306-R308 VanDerWaalsContact C-N 3.3Å; Y306-R308 PolarHBondContact O-N 3Å; Y306-R309 PolarHBondContact O-N 3.33Å; Y306-L310 HydrophobicContact CD1-CD1 4.39Å; Y306-L310 HydrophobicContact CD1-CD2 4.46Å; Y306-L310 HydrophobicContact CD1-CG 4.33Å; Y306-L310 HydrophobicContact CE1-CD1 4.01Å; Y306-L310 HydrophobicContact CE1-CD2 3.73Å; Y306-L310 HydrophobicContact CE1-CG 4.01Å; Y306-L310 PolarHBondContact O-N 3.15Å; Y306-D317 WeakPolarHBondContact OH-CB 3.16Å; Y306-D317 PolarHBondContact OH-N 2.98Å; Y306-Y320 AromaticContact CD2-CD1 3.98Å; Y306-Y320 HydrophobicContact CD2-CD1 3.98Å; Y306-Y320 AromaticContact CD2-CE1 3.62Å; Y306-Y320 HydrophobicContact CD2-CE1 3.62Å; Y306-Y320 AromaticContact CE2-CD1 3.98Å; Y306-Y320 HydrophobicContact CE2-CD1 3.98Å; Y306-Y320 HydrophobicContact CE2-CE1 4.09Å; Y306-Y320 HydrophobicContact CG-CD1 4.34Å; Y306-Y320 AromaticContact CG-CE1 3.96Å; Y306-Y320 HydrophobicContact CG-CE1 3.96Å; Y306-L321 HydrophobicContact CD1-CD1 4.03Å; Y306-L321 HydrophobicContact CD1-CD2 3.6Å; Y306-L321 HydrophobicContact CD1-CG 4.05Å; Y306-L321 HydrophobicContact CE1-CD1 3.95Å; Y306-L321 HydrophobicContact CE1-CD2 4.12Å; Y306-L321 HydrophobicContact CE1-CG 4.06Å; Y306-L321 HydrophobicContact CG-CD2 4.12Å
307	V	98.9	Very high	98.8	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-65.8	-30.1	-171	-57.6	0	0	0	0	113.4	L248 E249 Y303 L304 R309 L310 L321	L248-V307 HydrophobicContact CB-CB 4.17Å; L248-V307 HydrophobicContact CB-CG1 3.74Å; L248-V307 HydrophobicContact CD1-CG1 4.41Å; E249-V307 HydrophobicContact CB-CG2 4.01Å; E249-V307 HydrophobicContact CG-CG2 4.31Å; Y303-V307 HydrophobicContact CD1-CG1 4.29Å; Y303-V307 HydrophobicContact CD1-CG2 4.34Å; Y303-V307 HydrophobicContact CE1-CG1 3.92Å; Y303-V307 HydrophobicContact CE1-CG2 4.19Å; Y303-V307 WeakPolarHBondContact O-CG2 3.15Å; Y303-V307 PolarHBondContact O-N 3.48Å; L304-V307 HydrophobicContact CD2-CG2 4.44Å; V307-R309 VanDerWaalsContact C-N 3.31Å; V307-R309 PolarHBondContact O-N 3.04Å; V307-L310 HydrophobicContact CB-CD1 4.38Å; V307-L321 HydrophobicContact CG1-CD1 3.92Å; V307-L321 HydrophobicContact CG1-CD2 4.42Å
308	R	98.6	Very high	98.8	Very high	51 Å²	51	52 Å²	52	19%	0.192	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-17	173.4	-74.9	176.5	168.5	-168.9	3.3	114	E249 H253 L304 Y306	E249-R308 HydrophobicContact CG-CG 3.83Å; E249-R308 IonicContact OE1-CZ 2.75Å; E249-R308 IonicContact OE1-NE 3.51Å; E249-R308 PolarHBondContact OE1-NE 3.07Å; E249-R308 IonicContact OE1-NH2 3.34Å; H253-R308 PolarHBondContact NE2-NH2 2.92Å; L304-R308 VanDerWaalsContact O-CB 3.3Å; L304-R308 WeakPolarHBondContact O-CB 3.41Å; L304-R308 WeakPolarHBondContact O-CG 3.44Å; L304-R308 PolarHBondContact O-N 3.14Å; L304-R308 VanDerWaalsContact O-N 3.14Å; Y306-R308 VanDerWaalsContact C-N 3.3Å; Y306-R308 PolarHBondContact O-N 3Å
309	R	98.6	Very high	98.8	Very high	211 Å²	211	51.7 Å²	51.7	80%	0.796	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-17.2	177.3	-74.8	177.2	-176.6	-120.9	0.1	113.8	R305 Y306 V307 D311	R305-R309 VanDerWaalsContact O-CD 3.25Å; R305-R309 WeakPolarHBondContact O-CD 3.41Å; R305-R309 WeakPolarHBondContact O-CG 3.15Å; Y306-R309 PolarHBondContact O-N 3.33Å; V307-R309 VanDerWaalsContact C-N 3.31Å; V307-R309 PolarHBondContact O-N 3.04Å; R309-D311 PolarHBondContact O-N 3.44Å
310	L	98.8	Very high	98.8	Very high	5 Å²	5	54.8 Å²	54.8	3%	0.026	24%	0.244	C	C	.	.			trans	-54.1	134.9	178.3	-73.6	173.2	0	0	0	112.1	R245 L248 Y306 V307 E314 P316	R245-L310 HydrophobicContact CB-CB 3.69Å; R245-L310 HydrophobicContact CB-CD1 3.77Å; R245-L310 HydrophobicContact CB-CG 4.41Å; R245-L310 WeakPolarHBondContact CD-O 3.49Å; R245-L310 PolarHBondContact NH1-O 2.91Å; L248-L310 HydrophobicContact CD1-CD1 4.46Å; Y306-L310 HydrophobicContact CD1-CD1 4.39Å; Y306-L310 HydrophobicContact CD1-CD2 4.46Å; Y306-L310 HydrophobicContact CD1-CG 4.33Å; Y306-L310 HydrophobicContact CE1-CD1 4.01Å; Y306-L310 HydrophobicContact CE1-CD2 3.73Å; Y306-L310 HydrophobicContact CE1-CG 4.01Å; Y306-L310 PolarHBondContact O-N 3.15Å; V307-L310 HydrophobicContact CB-CD1 4.38Å; L310-E314 VanDerWaalsContact CA-OE2 3.29Å; L310-E314 WeakPolarHBondContact CA-OE2 3.42Å; L310-E314 HydrophobicContact CD2-CB 4.4Å; L310-E314 HydrophobicContact CD2-CG 4.04Å; L310-E314 WeakPolarHBondContact CD2-OE2 3.46Å; L310-P316 HydrophobicContact CD1-CB 4.02Å; L310-P316 HydrophobicContact CD1-CG 3.94Å
311	D	98.8	Very high	98.8	Very high	114 Å²	114	54.6 Å²	54.6	61%	0.61	24%	0.243	S	C	*	.			trans	-71.2	155.4	174.6	-114.8	-36.2	0	0	0	111.8	R309 F313 E314	R309-D311 PolarHBondContact O-N 3.44Å; D311-F313 PolarHBondContact O-N 2.81Å; D311-F313 VanDerWaalsContact O-N 3.17Å; D311-E314 HydrophobicContact CB-CB 4.01Å; D311-E314 PolarHBondContact N-OE2 2.94Å; D311-E314 VanDerWaalsContact O-CB 3.31Å; D311-E314 WeakPolarHBondContact O-CB 3.37Å; D311-E314 PolarHBondContact O-N 2.77Å
312	F	98.8	Very high	98.8	Very high	6 Å²	6	56.3 Å²	56.3	3%	0.026	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-34.6	-173.6	170.8	-104.1	0	0	0	113.1	H216 I217 Y219 E241 S243	H216-F312 AromaticContact CE1-CE1 3.6Å; H216-F312 AromaticContact CE1-CZ 3.76Å; H216-F312 PolarHBondContact CE1-O 3.4Å; H216-F312 AromaticContact ND1-CE1 3.77Å; H216-F312 PolarHBondContact NE2-O 3.08Å; I217-F312 HydrophobicContact CD1-CZ 4.43Å; I217-F312 HydrophobicContact CG1-CZ 4.25Å; I217-F312 WeakPolarHBondContact O-CE1 3.49Å; Y219-F312 VanDerWaalsContact CA-CE1 3.49Å; Y219-F312 HydrophobicContact CD2-CB 4.04Å; Y219-F312 AromaticContact CD2-CD1 3.78Å; Y219-F312 HydrophobicContact CD2-CD1 3.78Å; Y219-F312 AromaticContact CD2-CD2 3.89Å; Y219-F312 HydrophobicContact CD2-CD2 3.89Å; Y219-F312 HydrophobicContact CD2-CE1 4.17Å; Y219-F312 HydrophobicContact CD2-CE2 4.27Å; Y219-F312 AromaticContact CD2-CG 3.61Å; Y219-F312 HydrophobicContact CD2-CG 3.61Å; Y219-F312 HydrophobicContact CD2-CZ 4.39Å; Y219-F312 HydrophobicContact CE2-CB 4.48Å; Y219-F312 HydrophobicContact CE2-CD2 4.4Å; Y219-F312 HydrophobicContact CE2-CG 4.34Å; Y219-F312 HydrophobicContact CG-CD1 4.33Å; E241-F312 HydrophobicContact CB-CE2 4.28Å; E241-F312 HydrophobicContact CB-CZ 4.36Å; E241-F312 HydrophobicContact CG-CZ 4.38Å; E241-F312 WeakPolarHBondContact O-CE2 3.44Å; S243-F312 VanDerWaalsContact CB-O 3.25Å; S243-F312 WeakPolarHBondContact CB-O 3.2Å; S243-F312 PolarHBondContact OG-O 2.79Å
313	F	98.6	Very high	98.8	Very high	115 Å²	115	60.5 Å²	60.5	50%	0.504	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-7	179.8	-56.2	-76.3	0	0	0	113.4	H216 R244 D311	H216-F313 HydrophobicContact CB-CD1 3.98Å; H216-F313 AromaticContact CG-CD1 3.76Å; H216-F313 AromaticContact ND1-CD1 3.51Å; H216-F313 AromaticContact ND1-CE1 3.97Å; R244-F313 PolarHBondContact NH2-O 2.95Å; D311-F313 PolarHBondContact O-N 2.81Å; D311-F313 VanDerWaalsContact O-N 3.17Å
314	E	98.7	Very high	98.8	Very high	81 Å²	81	61.7 Å²	61.7	38%	0.379	27%	0.272	S	S	.	.			trans	-67.1	148	-168.6	-163.7	174.5	168.6	0	0	112	R244 L310 D311 P316	R244-E314 VanDerWaalsContact CZ-O 3.27Å; R244-E314 PolarHBondContact NE-O 2.9Å; R244-E314 PolarHBondContact NH2-O 3.45Å; L310-E314 VanDerWaalsContact CA-OE2 3.29Å; L310-E314 WeakPolarHBondContact CA-OE2 3.42Å; L310-E314 HydrophobicContact CD2-CB 4.4Å; L310-E314 HydrophobicContact CD2-CG 4.04Å; L310-E314 WeakPolarHBondContact CD2-OE2 3.46Å; D311-E314 HydrophobicContact CB-CB 4.01Å; D311-E314 PolarHBondContact N-OE2 2.94Å; D311-E314 VanDerWaalsContact O-CB 3.31Å; D311-E314 WeakPolarHBondContact O-CB 3.37Å; D311-E314 PolarHBondContact O-N 2.77Å; E314-P316 WeakPolarHBondContact O-CD 3.46Å
315	K	98.8	Very high	98.8	Very high	135 Å²	135	61.7 Å²	61.7	59%	0.587	27%	0.272	S	S	*	.			trans	-90.8	114.6	167.7	-174	-150.6	168.6	-165.2	0	107.1	Y318	K315-Y318 HydrophobicContact CG-CE2 4.45Å
316	P	98.8	Very high	98.8	Very high	1 Å²	1	60.1 Å²	60.1	1%	0.006	27%	0.271	C	S	.	.			trans	-56.7	145.9	173.3	-18.5	27.3	0	0	0	111.9	R244 L248 L310 E314 Y318	R244-P316 HydrophobicContact CB-CG 4.01Å; L248-P316 HydrophobicContact CD1-CB 3.41Å; L248-P316 VanDerWaalsContact CD1-CB 3.41Å; L248-P316 HydrophobicContact CD1-CG 3.47Å; L248-P316 VanDerWaalsContact CD1-CG 3.47Å; L310-P316 HydrophobicContact CD1-CB 4.02Å; L310-P316 HydrophobicContact CD1-CG 3.94Å; E314-P316 WeakPolarHBondContact O-CD 3.46Å; P316-Y318 HydrophobicContact CB-CD1 4.29Å; P316-Y318 HydrophobicContact CB-CE1 3.89Å; P316-Y318 HydrophobicContact CB-CE2 4.23Å; P316-Y318 WeakPolarHBondContact CD-OH 3.38Å; P316-Y318 HydrophobicContact CG-CE1 4.02Å; P316-Y318 HydrophobicContact CG-CE2 4.49Å; P316-Y318 WeakPolarHBondContact O-CD2 3.42Å; P316-Y318 WeakPolarHBondContact O-CE2 3.41Å; P316-Y318 PolarHBondContact O-N 3.17Å
317	D	98.9	Very high	98.8	Very high	77 Å²	77	60.3 Å²	60.3	41%	0.412	28%	0.275	S	S	.	.			trans	-84.9	90	166.1	-170.4	-19.1	0	0	0	109.4	Y306 D319 Y320 L321	Y306-D317 WeakPolarHBondContact OH-CB 3.16Å; Y306-D317 PolarHBondContact OH-N 2.98Å; D317-D319 PolarHBondContact O-N 3.08Å; D317-D319 PolarHBondContact OD1-N 3.12Å; D317-D319 VanDerWaalsContact OD1-N 3.11Å; D317-Y320 VanDerWaalsContact CG-CB 3.41Å; D317-Y320 PolarHBondContact OD1-N 3Å; D317-L321 WeakPolarHBondContact O-CG 3.12Å; D317-L321 PolarHBondContact O-N 3.48Å; D317-L321 VanDerWaalsContact O-N 3.12Å
318	Y	98.9	Very high	98.8	Very high	6 Å²	6	60.6 Å²	60.6	2%	0.024	28%	0.277	C	S	.	.	H	α-helix	trans	-68.6	-24.5	179.1	-50.1	-85.9	0	0	0	112.5	I163 E167 H170 L248 K315 P316 R322	I163-Y318 HydrophobicContact CG2-CD1 4.26Å; E167-Y318 HydrophobicContact CB-CD1 3.71Å; E167-Y318 HydrophobicContact CB-CD2 4.01Å; E167-Y318 HydrophobicContact CB-CE1 4Å; E167-Y318 HydrophobicContact CB-CE2 4.29Å; E167-Y318 HydrophobicContact CB-CG 3.71Å; E167-Y318 HydrophobicContact CG-CD1 4.22Å; E167-Y318 HydrophobicContact CG-CD2 3.56Å; E167-Y318 HydrophobicContact CG-CE1 4.44Å; E167-Y318 HydrophobicContact CG-CE2 3.82Å; E167-Y318 HydrophobicContact CG-CG 3.78Å; E167-Y318 WeakPolarHBondContact OE1-CD2 3.24Å; H170-Y318 WeakPolarHBondContact CB-OH 3.41Å; H170-Y318 AromaticContact ND1-CE1 3.69Å; H170-Y318 AromaticContact ND1-CZ 3.64Å; H170-Y318 PolarHBondContact ND1-OH 2.93Å; L248-Y318 HydrophobicContact CD1-CD1 4.35Å; L248-Y318 HydrophobicContact CD1-CE1 3.99Å; L248-Y318 HydrophobicContact CD2-CD1 4.46Å; L248-Y318 HydrophobicContact CD2-CE1 4.3Å; K315-Y318 HydrophobicContact CG-CE2 4.45Å; P316-Y318 HydrophobicContact CB-CD1 4.29Å; P316-Y318 HydrophobicContact CB-CE1 3.89Å; P316-Y318 HydrophobicContact CB-CE2 4.23Å; P316-Y318 WeakPolarHBondContact CD-OH 3.38Å; P316-Y318 HydrophobicContact CG-CE1 4.02Å; P316-Y318 HydrophobicContact CG-CE2 4.49Å; P316-Y318 WeakPolarHBondContact O-CD2 3.42Å; P316-Y318 WeakPolarHBondContact O-CE2 3.41Å; P316-Y318 PolarHBondContact O-N 3.17Å; Y318-R322 WeakPolarHBondContact O-CB 3.13Å; Y318-R322 WeakPolarHBondContact O-CG 3.36Å; Y318-R322 PolarHBondContact O-N 2.95Å; Y318-R322 PolarHBondContact O-NE 2.82Å
319	D	98.9	Very high	98.8	Very high	100 Å²	100	58.4 Å²	58.4	54%	0.535	27%	0.269	S	S	.	.	H	α-helix	trans	-75.6	-42.4	177.7	-73.8	-47	0	0	0	111.1	D317 L321 R322 K323	D317-D319 PolarHBondContact O-N 3.08Å; D317-D319 PolarHBondContact OD1-N 3.12Å; D317-D319 VanDerWaalsContact OD1-N 3.11Å; D319-L321 VanDerWaalsContact C-N 3.35Å; D319-L321 PolarHBondContact O-N 2.83Å; D319-R322 VanDerWaalsContact CG-NH2 3.33Å; D319-R322 PolarHBondContact O-N 2.87Å; D319-R322 IonicContact OD1-CZ 2.74Å; D319-R322 IonicContact OD1-NE 3.93Å; D319-R322 PolarHBondContact OD1-NE 2.88Å; D319-R322 VanDerWaalsContact OD1-NE 3.17Å; D319-R322 IonicContact OD1-NH2 3.2Å; D319-R322 PolarHBondContact OD1-NH2 2.89Å; D319-R322 IonicContact OD2-NH2 3.58Å; D319-K323 WeakPolarHBondContact O-CB 3.35Å; D319-K323 PolarHBondContact O-N 2.85Å
320	Y	98.9	Very high	98.8	Very high	88 Å²	88	53.4 Å²	53.4	35%	0.345	26%	0.258	S	S	.	.	H	α-helix	trans	-56	-48.3	167.2	170.8	-109.7	0	0	0	111.7	T302 Y306 D317 R322 K323 L324	T302-Y320 WeakPolarHBondContact CG2-OH 3.28Å; Y306-Y320 AromaticContact CD2-CD1 3.98Å; Y306-Y320 HydrophobicContact CD2-CD1 3.98Å; Y306-Y320 AromaticContact CD2-CE1 3.62Å; Y306-Y320 HydrophobicContact CD2-CE1 3.62Å; Y306-Y320 AromaticContact CE2-CD1 3.98Å; Y306-Y320 HydrophobicContact CE2-CD1 3.98Å; Y306-Y320 HydrophobicContact CE2-CE1 4.09Å; Y306-Y320 HydrophobicContact CG-CD1 4.34Å; Y306-Y320 AromaticContact CG-CE1 3.96Å; Y306-Y320 HydrophobicContact CG-CE1 3.96Å; D317-Y320 VanDerWaalsContact CG-CB 3.41Å; D317-Y320 PolarHBondContact OD1-N 3Å; Y320-R322 PolarHBondContact O-N 3.01Å; Y320-K323 PolarHBondContact O-N 2.9Å; Y320-K323 VanDerWaalsContact O-N 3.11Å; Y320-L324 HydrophobicContact CD1-CD1 4.47Å; Y320-L324 HydrophobicContact CE1-CD1 3.85Å; Y320-L324 HydrophobicContact CE1-CG 4.36Å; Y320-L324 HydrophobicContact CE2-CD1 4.45Å; Y320-L324 HydrophobicContact CE2-CD2 4.02Å; Y320-L324 HydrophobicContact CE2-CG 4.12Å; Y320-L324 PolarHBondContact O-N 2.85Å
321	L	98.9	Very high	98.8	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-66.6	-34.9	-179.2	-69.1	-179.8	0	0	0	113.5	I163 L248 Y303 Y306 V307 D317 D319 L324	I163-L321 HydrophobicContact CD1-CB 4.24Å; I163-L321 HydrophobicContact CG2-CB 4.46Å; L248-L321 HydrophobicContact CD1-CD1 3.89Å; Y303-L321 HydrophobicContact CD2-CB 4.35Å; Y303-L321 HydrophobicContact CD2-CD2 3.66Å; Y303-L321 HydrophobicContact CD2-CG 4.43Å; Y303-L321 HydrophobicContact CE2-CB 4.1Å; Y303-L321 HydrophobicContact CE2-CD1 4.07Å; Y303-L321 HydrophobicContact CE2-CD2 3.95Å; Y303-L321 HydrophobicContact CE2-CG 4.27Å; Y303-L321 HydrophobicContact CG-CD2 4.3Å; Y306-L321 HydrophobicContact CD1-CD1 4.03Å; Y306-L321 HydrophobicContact CD1-CD2 3.6Å; Y306-L321 HydrophobicContact CD1-CG 4.05Å; Y306-L321 HydrophobicContact CE1-CD1 3.95Å; Y306-L321 HydrophobicContact CE1-CD2 4.12Å; Y306-L321 HydrophobicContact CE1-CG 4.06Å; Y306-L321 HydrophobicContact CG-CD2 4.12Å; V307-L321 HydrophobicContact CG1-CD1 3.92Å; V307-L321 HydrophobicContact CG1-CD2 4.42Å; D317-L321 WeakPolarHBondContact O-CG 3.12Å; D317-L321 PolarHBondContact O-N 3.48Å; D317-L321 VanDerWaalsContact O-N 3.12Å; D319-L321 VanDerWaalsContact C-N 3.35Å; D319-L321 PolarHBondContact O-N 2.83Å; L321-L324 HydrophobicContact CD2-CD1 4.2Å
322	R	98.9	Very high	98.7	Very high	36 Å²	36	58.5 Å²	58.5	14%	0.136	27%	0.274	C	S	.	.	H	α-helix	trans	-64.8	-46.4	167.6	-80.9	-178.5	-78.1	-95	-1.8	110.9	I163 T164 E167 Y318 D319 Y320 L324 F325 T326	I163-R322 HydrophobicContact CB-CG 4.32Å; I163-R322 HydrophobicContact CG2-CG 3.98Å; T164-R322 PolarHBondContact OG1-NH1 3.34Å; E167-R322 IonicContact OE1-NH2 2.67Å; E167-R322 IonicContact OE2-CZ 2.83Å; E167-R322 IonicContact OE2-NH1 3.19Å; E167-R322 PolarHBondContact OE2-NH1 3.43Å; E167-R322 IonicContact OE2-NH2 3.8Å; E167-R322 PolarHBondContact OE2-NH2 3.34Å; Y318-R322 WeakPolarHBondContact O-CB 3.13Å; Y318-R322 WeakPolarHBondContact O-CG 3.36Å; Y318-R322 PolarHBondContact O-N 2.95Å; Y318-R322 PolarHBondContact O-NE 2.82Å; D319-R322 VanDerWaalsContact CG-NH2 3.33Å; D319-R322 PolarHBondContact O-N 2.87Å; D319-R322 IonicContact OD1-CZ 2.74Å; D319-R322 IonicContact OD1-NE 3.93Å; D319-R322 PolarHBondContact OD1-NE 2.88Å; D319-R322 VanDerWaalsContact OD1-NE 3.17Å; D319-R322 IonicContact OD1-NH2 3.2Å; D319-R322 PolarHBondContact OD1-NH2 2.89Å; D319-R322 IonicContact OD2-NH2 3.58Å; Y320-R322 PolarHBondContact O-N 3.01Å; R322-L324 PolarHBondContact O-N 3.49Å; R322-F325 PolarHBondContact O-N 3.21Å; R322-T326 PolarHBondContact O-N 3.26Å
323	K	98.8	Very high	98.7	Very high	111 Å²	111	61.2 Å²	61.2	48%	0.483	30%	0.303	S	S	.	.	H	α-helix	trans	-63.2	-38	-173.7	-174.8	163.7	175.2	53	0	113	D319 Y320 F325 T326 D327	D319-K323 WeakPolarHBondContact O-CB 3.35Å; D319-K323 PolarHBondContact O-N 2.85Å; Y320-K323 PolarHBondContact O-N 2.9Å; Y320-K323 VanDerWaalsContact O-N 3.11Å; K323-F325 PolarHBondContact O-N 2.65Å; K323-T326 WeakPolarHBondContact CA-OG1 3.36Å; K323-T326 PolarHBondContact O-N 3.38Å; K323-T326 PolarHBondContact O-OG1 3.14Å; K323-D327 WeakPolarHBondContact CE-OD2 3.1Å; K323-D327 WeakPolarHBondContact CG-OD1 3.4Å; K323-D327 WeakPolarHBondContact CG-OD2 3.49Å; K323-D327 IonicContact NZ-OD1 3.73Å; K323-D327 PolarHBondContact NZ-OD1 3.4Å; K323-D327 IonicContact NZ-OD2 3.43Å; K323-D327 PolarHBondContact NZ-OD2 3.12Å; K323-D327 VanDerWaalsContact O-CB 3.24Å; K323-D327 WeakPolarHBondContact O-CB 3.22Å; K323-D327 PolarHBondContact O-N 3.43Å
324	L	98.8	Very high	98.7	Very high	26 Å²	26	59.1 Å²	59.1	14%	0.136	29%	0.293	C	S	.	.	H	α-helix	trans	-50.2	-44.7	169.9	-73.8	176.4	0	0	0	111.8	E299 T302 Y320 L321 R322 L328	E299-L324 HydrophobicContact CB-CB 4.45Å; T302-L324 HydrophobicContact CG2-CD1 3.94Å; T302-L324 HydrophobicContact CG2-CD2 3.97Å; Y320-L324 HydrophobicContact CD1-CD1 4.47Å; Y320-L324 HydrophobicContact CE1-CD1 3.85Å; Y320-L324 HydrophobicContact CE1-CG 4.36Å; Y320-L324 HydrophobicContact CE2-CD1 4.45Å; Y320-L324 HydrophobicContact CE2-CD2 4.02Å; Y320-L324 HydrophobicContact CE2-CG 4.12Å; Y320-L324 PolarHBondContact O-N 2.85Å; L321-L324 HydrophobicContact CD2-CD1 4.2Å; R322-L324 PolarHBondContact O-N 3.49Å; L324-L328 WeakPolarHBondContact O-CB 3.31Å; L324-L328 PolarHBondContact O-N 2.91Å
325	F	98.9	Very high	98.7	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-84.2	-31.6	-176.6	-65	-33.6	0	0	0	113.8	L156 A159 I160 I163 F255 E299 M300 Y303 R322 K323 F329	L156-F325 HydrophobicContact CD2-CB 3.69Å; L156-F325 HydrophobicContact CD2-CD1 3.55Å; L156-F325 HydrophobicContact CD2-CE1 4.41Å; L156-F325 HydrophobicContact CD2-CG 3.77Å; A159-F325 HydrophobicContact CB-CD2 3.68Å; A159-F325 HydrophobicContact CB-CE2 3.84Å; A159-F325 HydrophobicContact CB-CG 4.48Å; I160-F325 HydrophobicContact CD1-CB 4.42Å; I160-F325 HydrophobicContact CG1-CB 4.05Å; I163-F325 HydrophobicContact CD1-CD2 3.81Å; I163-F325 HydrophobicContact CD1-CE2 3.96Å; F255-F325 HydrophobicContact CD2-CE2 4.12Å; F255-F325 HydrophobicContact CD2-CZ 4.26Å; F255-F325 AromaticContact CE2-CE2 3.96Å; F255-F325 HydrophobicContact CE2-CE2 3.96Å; E299-F325 HydrophobicContact CB-CD1 4.37Å; E299-F325 HydrophobicContact CB-CE1 4.34Å; M300-F325 HydrophobicContact CE-CD1 4.1Å; M300-F325 HydrophobicContact CE-CE1 3.64Å; M300-F325 HydrophobicContact CE-CZ 4.24Å; M300-F325 HydrophobicContact SD-CE1 3.72Å; M300-F325 HydrophobicContact SD-CZ 3.96Å; Y303-F325 HydrophobicContact CD2-CD2 4.49Å; Y303-F325 AromaticContact CD2-CE2 3.44Å; Y303-F325 HydrophobicContact CD2-CE2 3.44Å; Y303-F325 VanDerWaalsContact CD2-CE2 3.44Å; Y303-F325 AromaticContact CD2-CZ 3.5Å; Y303-F325 HydrophobicContact CD2-CZ 3.5Å; Y303-F325 AromaticContact CE2-CE2 3.81Å; Y303-F325 HydrophobicContact CE2-CE2 3.81Å; Y303-F325 HydrophobicContact CE2-CZ 4.28Å; Y303-F325 HydrophobicContact CG-CE2 4.18Å; Y303-F325 AromaticContact CG-CZ 3.79Å; Y303-F325 HydrophobicContact CG-CZ 3.79Å; R322-F325 PolarHBondContact O-N 3.21Å; K323-F325 PolarHBondContact O-N 2.65Å; F325-F329 VanDerWaalsContact O-CB 3.25Å; F325-F329 WeakPolarHBondContact O-CB 3.3Å; F325-F329 PolarHBondContact O-N 3.07Å
326	T	98.8	Very high	98.6	Very high	46 Å²	46	58.1 Å²	58.1	28%	0.282	29%	0.292	S	S	.	.	H	α-helix	trans	-68.4	-46.8	171	57.6	0	0	0	0	111.4	I160 R322 K323 L328 F329 D330	I160-T326 HydrophobicContact CD1-CG2 3.76Å; I160-T326 HydrophobicContact CG1-CG2 4.25Å; R322-T326 PolarHBondContact O-N 3.26Å; K323-T326 WeakPolarHBondContact CA-OG1 3.36Å; K323-T326 PolarHBondContact O-N 3.38Å; K323-T326 PolarHBondContact O-OG1 3.14Å; T326-L328 PolarHBondContact O-N 2.8Å; T326-F329 WeakPolarHBondContact O-CA 3.11Å; T326-F329 WeakPolarHBondContact O-CB 3.38Å; T326-F329 PolarHBondContact O-N 3.05Å; T326-D330 VanDerWaalsContact O-CG 3.29Å; T326-D330 PolarHBondContact O-N 3.44Å
327	D	98.8	Very high	98.5	Very high	56 Å²	56	60.9 Å²	60.9	30%	0.299	31%	0.306	S	S	.	.	H	α-helix	trans	-65.4	-26	-178.1	-67.5	10.5	0	0	0	111.7	K323 R331	K323-D327 WeakPolarHBondContact CE-OD2 3.1Å; K323-D327 WeakPolarHBondContact CG-OD1 3.4Å; K323-D327 WeakPolarHBondContact CG-OD2 3.49Å; K323-D327 IonicContact NZ-OD1 3.73Å; K323-D327 PolarHBondContact NZ-OD1 3.4Å; K323-D327 IonicContact NZ-OD2 3.43Å; K323-D327 PolarHBondContact NZ-OD2 3.12Å; K323-D327 VanDerWaalsContact O-CB 3.24Å; K323-D327 WeakPolarHBondContact O-CB 3.22Å; K323-D327 PolarHBondContact O-N 3.43Å; D327-R331 WeakPolarHBondContact O-CB 3.5Å; D327-R331 WeakPolarHBondContact O-CG 3.36Å; D327-R331 PolarHBondContact O-N 2.98Å; D327-R331 PolarHBondContact O-NE 2.99Å; D327-R331 PolarHBondContact O-NH2 2.77Å
328	L	98.8	Very high	98.4	Very high	7 Å²	7	62 Å²	62	4%	0.037	31%	0.305	C	S	.	.	H	α-helix	trans	-76.2	-43.2	169.5	175.6	62.7	0	0	0	112.3	L152 L156 P297 E299 L324 T326 R331 N332	L152-L328 HydrophobicContact CD1-CD2 4.45Å; L156-L328 HydrophobicContact CD1-CD2 4.07Å; L156-L328 HydrophobicContact CD1-CG 4.08Å; L156-L328 HydrophobicContact CD2-CD2 3.96Å; P297-L328 HydrophobicContact CB-CD1 3.92Å; P297-L328 HydrophobicContact CB-CD2 3.57Å; P297-L328 HydrophobicContact CB-CG 4.41Å; P297-L328 HydrophobicContact CG-CD1 4.29Å; P297-L328 HydrophobicContact CG-CD2 3.93Å; E299-L328 HydrophobicContact CB-CD2 4.05Å; E299-L328 HydrophobicContact CG-CB 4.14Å; E299-L328 HydrophobicContact CG-CD2 4.24Å; L324-L328 WeakPolarHBondContact O-CB 3.31Å; L324-L328 PolarHBondContact O-N 2.91Å; T326-L328 PolarHBondContact O-N 2.8Å; L328-R331 PolarHBondContact O-N 2.76Å; L328-N332 VanDerWaalsContact CD1-ND2 3.32Å; L328-N332 WeakPolarHBondContact CD1-ND2 3.34Å; L328-N332 PolarHBondContact O-N 2.99Å; L328-N332 VanDerWaalsContact O-N 3.12Å; L328-N332 PolarHBondContact O-ND2 3.33Å
329	F	98.7	Very high	98.3	Very high	5 Å²	5	66.4 Å²	66.4	2%	0.022	33%	0.326	C	S	.	.	H	α-helix	trans	-58.6	-47.6	178.2	-170	-94.9	0	0	0	111.2	K153 L156 M157 F325 T326 N332 G333 Y334 I335 F336	K153-F329 HydrophobicContact CG-CE2 3.72Å; K153-F329 HydrophobicContact CG-CZ 4.22Å; L156-F329 HydrophobicContact CB-CD2 3.79Å; L156-F329 HydrophobicContact CB-CE2 4.49Å; L156-F329 HydrophobicContact CD1-CB 4.13Å; L156-F329 HydrophobicContact CD1-CD2 4.02Å; M157-F329 HydrophobicContact CG-CE2 3.59Å; M157-F329 HydrophobicContact CG-CZ 3.86Å; M157-F329 HydrophobicContact SD-CE2 4.32Å; M157-F329 HydrophobicContact SD-CZ 4.15Å; F325-F329 VanDerWaalsContact O-CB 3.25Å; F325-F329 WeakPolarHBondContact O-CB 3.3Å; F325-F329 PolarHBondContact O-N 3.07Å; T326-F329 WeakPolarHBondContact O-CA 3.11Å; T326-F329 WeakPolarHBondContact O-CB 3.38Å; T326-F329 PolarHBondContact O-N 3.05Å; F329-N332 PolarHBondContact O-N 2.85Å; F329-G333 PolarHBondContact O-N 2.86Å; F329-Y334 AromaticContact CD2-CD2 3.66Å; F329-Y334 HydrophobicContact CD2-CD2 3.66Å; F329-Y334 HydrophobicContact CD2-CG 4.23Å; F329-Y334 VanDerWaalsContact CE1-C 3.48Å; F329-Y334 VanDerWaalsContact CE1-O 3.29Å; F329-Y334 WeakPolarHBondContact CE1-O 3.39Å; F329-Y334 AromaticContact CE2-CD2 3.94Å; F329-Y334 HydrophobicContact CE2-CD2 3.94Å; F329-Y334 HydrophobicContact CE2-CG 4.23Å; F329-Y334 HydrophobicContact CG-CD2 4.19Å; F329-Y334 WeakPolarHBondContact O-CB 3.42Å; F329-Y334 PolarHBondContact O-N 3.06Å; F329-I335 WeakPolarHBondContact CZ-O 3.47Å; F329-F336 HydrophobicContact CE1-CB 4.04Å; F329-F336 HydrophobicContact CE1-CD2 4.08Å; F329-F336 HydrophobicContact CZ-CB 4.28Å; F329-F336 HydrophobicContact CZ-CD2 4.05Å; F329-F336 HydrophobicContact CZ-CG 4.47Å
330	D	98.4	Very high	98.3	Very high	107 Å²	107	62 Å²	62	57%	0.572	30%	0.302	S	S	*	.	H	α-helix	trans	-66.7	-40.6	179.3	-61.8	-16.1	0	0	0	111.6	T326 N332 G333	T326-D330 VanDerWaalsContact O-CG 3.29Å; T326-D330 PolarHBondContact O-N 3.44Å; D330-N332 PolarHBondContact O-N 3.47Å; D330-G333 PolarHBondContact O-N 3.29Å
331	R	98.6	Very high	98.3	Very high	154 Å²	154	60 Å²	60	58%	0.581	30%	0.298	S	S	*	.	H	α-helix	trans	-61.5	-27.8	173.4	-91.4	179.7	-69.3	146.5	1	114	E299 D327 L328 G333	E299-R331 IonicContact OE1-CZ 2.68Å; E299-R331 IonicContact OE1-NH1 3.95Å; E299-R331 PolarHBondContact OE1-NH1 2.71Å; E299-R331 IonicContact OE1-NH2 2.72Å; E299-R331 PolarHBondContact OE1-NH2 2.76Å; D327-R331 WeakPolarHBondContact O-CB 3.5Å; D327-R331 WeakPolarHBondContact O-CG 3.36Å; D327-R331 PolarHBondContact O-N 2.98Å; D327-R331 PolarHBondContact O-NE 2.99Å; D327-R331 PolarHBondContact O-NH2 2.77Å; L328-R331 PolarHBondContact O-N 2.76Å; R331-G333 VanDerWaalsContact C-N 3.26Å
332	N	98.3	Very high	98.2	Very high	71 Å²	71	60.6 Å²	60.6	38%	0.38	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	1.1	174.4	-78.7	-94.3	0	0	0	112.9	L328 F329 D330 Y334	L328-N332 VanDerWaalsContact CD1-ND2 3.32Å; L328-N332 WeakPolarHBondContact CD1-ND2 3.34Å; L328-N332 PolarHBondContact O-N 2.99Å; L328-N332 VanDerWaalsContact O-N 3.12Å; L328-N332 PolarHBondContact O-ND2 3.33Å; F329-N332 PolarHBondContact O-N 2.85Å; D330-N332 PolarHBondContact O-N 3.47Å; N332-Y334 HydrophobicContact CB-CD1 3.93Å; N332-Y334 HydrophobicContact CB-CD2 3.75Å; N332-Y334 HydrophobicContact CB-CE1 3.79Å; N332-Y334 HydrophobicContact CB-CE2 3.61Å; N332-Y334 HydrophobicContact CB-CG 3.92Å; N332-Y334 PolarHBondContact O-N 3.12Å
333	G	98.4	Very high	98	Very high	63 Å²	63	61.9 Å²	61.9	65%	0.649	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	22.1	-176.1	0	0	0	0	0	113.3	F329 D330 R331	F329-G333 PolarHBondContact O-N 2.86Å; D330-G333 PolarHBondContact O-N 3.29Å; R331-G333 VanDerWaalsContact C-N 3.26Å
334	Y	98.7	Very high	97.5	Very high	71 Å²	71	60.5 Å²	60.5	28%	0.278	33%	0.329	S	S	.	.			trans	-76.3	146.3	179.5	-62.8	-23.7	0	0	0	111.3	L152 K153 L156 F329 N332	L152-Y334 HydrophobicContact CB-CE2 4.4Å; L152-Y334 HydrophobicContact CD2-CE2 4.27Å; L152-Y334 HydrophobicContact CG-CE2 4.19Å; K153-Y334 HydrophobicContact CB-CD1 4.36Å; K153-Y334 HydrophobicContact CB-CD2 3.76Å; K153-Y334 HydrophobicContact CB-CE1 4.33Å; K153-Y334 HydrophobicContact CB-CE2 3.72Å; K153-Y334 HydrophobicContact CB-CG 4.09Å; K153-Y334 HydrophobicContact CD-CG 4.39Å; K153-Y334 HydrophobicContact CG-CD1 4.35Å; K153-Y334 HydrophobicContact CG-CD2 3.89Å; K153-Y334 HydrophobicContact CG-CE2 4.36Å; K153-Y334 HydrophobicContact CG-CG 3.88Å; L156-Y334 HydrophobicContact CD1-CD2 4.42Å; L156-Y334 HydrophobicContact CD1-CE2 4.35Å; F329-Y334 AromaticContact CD2-CD2 3.66Å; F329-Y334 HydrophobicContact CD2-CD2 3.66Å; F329-Y334 HydrophobicContact CD2-CG 4.23Å; F329-Y334 VanDerWaalsContact CE1-C 3.48Å; F329-Y334 VanDerWaalsContact CE1-O 3.29Å; F329-Y334 WeakPolarHBondContact CE1-O 3.39Å; F329-Y334 AromaticContact CE2-CD2 3.94Å; F329-Y334 HydrophobicContact CE2-CD2 3.94Å; F329-Y334 HydrophobicContact CE2-CG 4.23Å; F329-Y334 HydrophobicContact CG-CD2 4.19Å; F329-Y334 WeakPolarHBondContact O-CB 3.42Å; F329-Y334 PolarHBondContact O-N 3.06Å; N332-Y334 HydrophobicContact CB-CD1 3.93Å; N332-Y334 HydrophobicContact CB-CD2 3.75Å; N332-Y334 HydrophobicContact CB-CE1 3.79Å; N332-Y334 HydrophobicContact CB-CE2 3.61Å; N332-Y334 HydrophobicContact CB-CG 3.92Å; N332-Y334 PolarHBondContact O-N 3.12Å
335	I	97.6	Very high	97.3	Very high	121 Å²	121	62.6 Å²	62.6	62%	0.621	34%	0.337	S	S	*	.			trans	-107.9	135.5	176.6	-55.3	176.6	0	0	0	108.5	K153 F329 D337	K153-I335 WeakPolarHBondContact CE-O 3.47Å; F329-I335 WeakPolarHBondContact CZ-O 3.47Å; I335-D337 HydrophobicContact CG2-CB 4.13Å; I335-D337 PolarHBondContact O-N 2.82Å
336	F	96.9	Very high	96.9	Very high	75 Å²	75	68.1 Å²	68.1	33%	0.329	37%	0.373	S	S	.	.			trans	-80	62.7	178	-148.1	-72.5	0	0	0	110.6	M157 I160 F329 Y338	M157-F336 HydrophobicContact CB-CE2 4.12Å; M157-F336 HydrophobicContact CB-CZ 4.01Å; M157-F336 HydrophobicContact CG-CD2 3.99Å; M157-F336 HydrophobicContact CG-CE1 4.43Å; M157-F336 HydrophobicContact CG-CE2 3.75Å; M157-F336 HydrophobicContact CG-CG 4.44Å; M157-F336 HydrophobicContact CG-CZ 3.99Å; M157-F336 HydrophobicContact SD-CD1 4.49Å; M157-F336 HydrophobicContact SD-CG 4.49Å; I160-F336 HydrophobicContact CD1-CE2 4.04Å; F329-F336 HydrophobicContact CE1-CB 4.04Å; F329-F336 HydrophobicContact CE1-CD2 4.08Å; F329-F336 HydrophobicContact CZ-CB 4.28Å; F329-F336 HydrophobicContact CZ-CD2 4.05Å; F329-F336 HydrophobicContact CZ-CG 4.47Å; F336-Y338 HydrophobicContact CD1-CD1 4.36Å; F336-Y338 HydrophobicContact CD1-CE1 4.04Å; F336-Y338 HydrophobicContact CD1-CE2 4.37Å; F336-Y338 AromaticContact CE1-CD1 3.99Å; F336-Y338 HydrophobicContact CE1-CD1 3.99Å; F336-Y338 AromaticContact CE1-CE1 3.57Å; F336-Y338 HydrophobicContact CE1-CE1 3.57Å; F336-Y338 AromaticContact CE1-CZ 3.95Å
337	D	97.1	Very high	96.4	Very high	59 Å²	59	68.2 Å²	68.2	32%	0.316	37%	0.371	S	S	.	.	S	Bend	trans	-93.3	2.3	-173.2	58.2	13.8	0	0	0	113.7	K153 I335 Q339	K153-D337 WeakPolarHBondContact CE-OD1 3.21Å; K153-D337 IonicContact NZ-OD1 3.51Å; K153-D337 PolarHBondContact NZ-OD1 2.84Å; K153-D337 IonicContact NZ-OD2 3.18Å; K153-D337 PolarHBondContact NZ-OD2 3.37Å; I335-D337 HydrophobicContact CG2-CB 4.13Å; I335-D337 PolarHBondContact O-N 2.82Å; D337-Q339 HydrophobicContact CB-CG 4.05Å; D337-Q339 VanDerWaalsContact CG-CG 3.4Å; D337-Q339 PolarHBondContact O-N 2.97Å; D337-Q339 VanDerWaalsContact OD1-CB 3.24Å; D337-Q339 WeakPolarHBondContact OD1-CB 3.46Å; D337-Q339 WeakPolarHBondContact OD1-CG 3.41Å; D337-Q339 PolarHBondContact OD1-N 3.46Å
338	Y	97	Very high	95.6	Very high	99 Å²	99	68.4 Å²	68.4	39%	0.388	38%	0.376	S	S	.	.			trans	55.4	22.9	-172.2	-50.7	-88.6	0	0	0	114.7	H195 F336 Y340	H195-Y338 HydrophobicContact CB-CD1 3.47Å; H195-Y338 VanDerWaalsContact CB-CD1 3.47Å; H195-Y338 HydrophobicContact CB-CE1 4.08Å; H195-Y338 HydrophobicContact CB-CG 3.74Å; H195-Y338 AromaticContact CG-CG 3.88Å; H195-Y338 WeakPolarHBondContact ND1-CB 3.44Å; F336-Y338 HydrophobicContact CD1-CD1 4.36Å; F336-Y338 HydrophobicContact CD1-CE1 4.04Å; F336-Y338 HydrophobicContact CD1-CE2 4.37Å; F336-Y338 AromaticContact CE1-CD1 3.99Å; F336-Y338 HydrophobicContact CE1-CD1 3.99Å; F336-Y338 AromaticContact CE1-CE1 3.57Å; F336-Y338 HydrophobicContact CE1-CE1 3.57Å; F336-Y338 AromaticContact CE1-CZ 3.95Å; Y338-Y340 HydrophobicContact CD1-CE2 4.5Å; Y338-Y340 WeakPolarHBondContact O-CD2 3.19Å; Y338-Y340 PolarHBondContact O-N 3.04Å; Y338-Y340 VanDerWaalsContact O-N 3.14Å
339	Q	97.5	Very high	94.7	Very high	99 Å²	99	70.7 Å²	70.7	46%	0.463	39%	0.39	S	S	.	.			trans	-83.2	81.8	171.3	-57.3	-61.5	-38.4	0	0	109.5	D337 T343	D337-Q339 HydrophobicContact CB-CG 4.05Å; D337-Q339 VanDerWaalsContact CG-CG 3.4Å; D337-Q339 PolarHBondContact O-N 2.97Å; D337-Q339 VanDerWaalsContact OD1-CB 3.24Å; D337-Q339 WeakPolarHBondContact OD1-CB 3.46Å; D337-Q339 WeakPolarHBondContact OD1-CG 3.41Å; D337-Q339 PolarHBondContact OD1-N 3.46Å; Q339-T343 VanDerWaalsContact OE1-CG2 3.24Å
340	Y	98.1	Very high	93.6	Very high	8 Å²	8	72.3 Å²	72.3	3%	0.031	40%	0.401	C	S	.	.			trans	-78.1	163.9	171.3	-50.8	-85.8	0	0	0	111.6	T154 M157 I158 Q161 H195 Y338 W342 T343	T154-Y340 HydrophobicContact CG2-CD1 4.25Å; T154-Y340 WeakPolarHBondContact OG1-CA 3.46Å; M157-Y340 HydrophobicContact CB-CD1 4.37Å; M157-Y340 HydrophobicContact CB-CE1 3.8Å; M157-Y340 HydrophobicContact CE-CD1 3.69Å; M157-Y340 HydrophobicContact CE-CE1 4.04Å; M157-Y340 HydrophobicContact CE-CG 4.2Å; I158-Y340 HydrophobicContact CG1-CE1 4.44Å; Q161-Y340 PolarHBondContact NE2-OH 3.37Å; H195-Y340 HydrophobicContact CB-CE2 4.4Å; H195-Y340 PolarHBondContact O-OH 2.65Å; Y338-Y340 HydrophobicContact CD1-CE2 4.5Å; Y338-Y340 WeakPolarHBondContact O-CD2 3.19Å; Y338-Y340 PolarHBondContact O-N 3.04Å; Y338-Y340 VanDerWaalsContact O-N 3.14Å; Y340-W342 VanDerWaalsContact CB-CE2 3.41Å; Y340-W342 VanDerWaalsContact CB-CZ2 3.5Å; Y340-W342 AromaticContact CD1-CH2 3.54Å; Y340-W342 HydrophobicContact CD1-CH2 3.54Å; Y340-W342 AromaticContact CD1-CZ2 3.62Å; Y340-W342 HydrophobicContact CD1-CZ2 3.62Å; Y340-W342 HydrophobicContact CD1-CZ3 4.3Å; Y340-W342 AromaticContact CD2-CE2 3.78Å; Y340-W342 HydrophobicContact CD2-CH2 4.28Å; Y340-W342 AromaticContact CD2-CZ2 3.49Å; Y340-W342 HydrophobicContact CD2-CZ2 3.49Å; Y340-W342 VanDerWaalsContact CD2-CZ2 3.49Å; Y340-W342 AromaticContact CD2-NE1 3.92Å; Y340-W342 HydrophobicContact CE1-CH2 4.11Å; Y340-W342 HydrophobicContact CE1-CZ2 4.11Å; Y340-W342 AromaticContact CE2-CZ2 3.98Å; Y340-W342 HydrophobicContact CE2-CZ2 3.98Å; Y340-W342 HydrophobicContact CG-CD2 4.36Å; Y340-W342 AromaticContact CG-CE2 3.66Å; Y340-W342 AromaticContact CG-CH2 3.63Å; Y340-W342 HydrophobicContact CG-CH2 3.63Å; Y340-W342 AromaticContact CG-CZ2 3.27Å; Y340-W342 HydrophobicContact CG-CZ2 3.27Å; Y340-W342 HydrophobicContact CG-CZ3 4.29Å; Y340-W342 PolarHBondContact O-N 2.83Å; Y340-T343 PolarHBondContact N-OG1 2.81Å; Y340-T343 WeakPolarHBondContact O-CB 3.28Å; Y340-T343 PolarHBondContact O-N 2.96Å; Y340-T343 PolarHBondContact O-OG1 2.89Å
341	D	98.3	Very high	92.5	Very high	47 Å²	47	70 Å²	70	25%	0.251	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-13.3	-176.3	-47.2	-30.5	0	0	0	114.6	C146 F150 S151 T154 K345	C146-D341 VanDerWaalsContact SG-C 3.58Å; C146-D341 PolarHBondContact SG-O 3.28Å; F150-D341 WeakPolarHBondContact CA-OD2 3.39Å; F150-D341 WeakPolarHBondContact CB-OD2 3.49Å; F150-D341 HydrophobicContact CD1-CB 4.45Å; F150-D341 WeakPolarHBondContact CD1-OD2 3.49Å; S151-D341 WeakPolarHBondContact CB-OD1 3.41Å; S151-D341 PolarHBondContact N-OD2 2.7Å; S151-D341 PolarHBondContact OG-OD1 3.21Å; S151-D341 PolarHBondContact OG-OD2 3.01Å; T154-D341 VanDerWaalsContact CB-OD2 3.25Å; T154-D341 WeakPolarHBondContact CB-OD2 3.45Å; T154-D341 WeakPolarHBondContact CG2-OD2 3.42Å; T154-D341 PolarHBondContact OG1-N 3.42Å; T154-D341 PolarHBondContact OG1-OD1 3.09Å; T154-D341 PolarHBondContact OG1-OD2 3.29Å; D341-K345 WeakPolarHBondContact O-CE 2.97Å; D341-K345 PolarHBondContact O-NZ 2.84Å
342	W	96.7	Very high	90.8	Very high	12 Å²	12	63.8 Å²	63.8	5%	0.045	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-5.7	175.5	61.2	79	0	0	0	113.9	L139 L142 F150 T154 I158 V186 Y340 G344 K345 L347	L139-W342 HydrophobicContact CD2-CH2 4.06Å; L142-W342 HydrophobicContact CB-CD2 4.13Å; L142-W342 HydrophobicContact CB-CE3 3.91Å; L142-W342 HydrophobicContact CB-CZ3 4.35Å; L142-W342 HydrophobicContact CD1-CD2 3.93Å; L142-W342 HydrophobicContact CD1-CE3 4.24Å; L142-W342 HydrophobicContact CD1-CG 4.47Å; L142-W342 HydrophobicContact CD1-CH2 4.18Å; L142-W342 HydrophobicContact CD1-CZ2 3.86Å; L142-W342 HydrophobicContact CD1-CZ3 4.36Å; L142-W342 HydrophobicContact CD2-CB 3.96Å; L142-W342 HydrophobicContact CD2-CD2 3.95Å; L142-W342 HydrophobicContact CD2-CG 3.65Å; L142-W342 HydrophobicContact CG-CD2 4.22Å; L142-W342 HydrophobicContact CG-CE3 4.47Å; L142-W342 HydrophobicContact CG-CG 4.44Å; F150-W342 HydrophobicContact CD1-CZ3 4.47Å; F150-W342 AromaticContact CE1-CE3 3.72Å; F150-W342 HydrophobicContact CE1-CE3 3.72Å; F150-W342 AromaticContact CE1-CZ3 3.81Å; F150-W342 HydrophobicContact CE1-CZ3 3.81Å; F150-W342 HydrophobicContact CE2-CZ3 4.06Å; F150-W342 AromaticContact CZ-CE3 3.85Å; F150-W342 HydrophobicContact CZ-CE3 3.85Å; F150-W342 AromaticContact CZ-CZ3 3.58Å; F150-W342 HydrophobicContact CZ-CZ3 3.58Å; T154-W342 HydrophobicContact CG2-CE3 4.37Å; T154-W342 HydrophobicContact CG2-CH2 4.27Å; T154-W342 HydrophobicContact CG2-CZ3 3.67Å; I158-W342 HydrophobicContact CD1-CH2 4.02Å; I158-W342 HydrophobicContact CD1-CZ3 4.13Å; I158-W342 HydrophobicContact CG1-CH2 4.3Å; V186-W342 HydrophobicContact CG1-CZ2 4.04Å; Y340-W342 VanDerWaalsContact CB-CE2 3.41Å; Y340-W342 VanDerWaalsContact CB-CZ2 3.5Å; Y340-W342 AromaticContact CD1-CH2 3.54Å; Y340-W342 HydrophobicContact CD1-CH2 3.54Å; Y340-W342 AromaticContact CD1-CZ2 3.62Å; Y340-W342 HydrophobicContact CD1-CZ2 3.62Å; Y340-W342 HydrophobicContact CD1-CZ3 4.3Å; Y340-W342 AromaticContact CD2-CE2 3.78Å; Y340-W342 HydrophobicContact CD2-CH2 4.28Å; Y340-W342 AromaticContact CD2-CZ2 3.49Å; Y340-W342 HydrophobicContact CD2-CZ2 3.49Å; Y340-W342 VanDerWaalsContact CD2-CZ2 3.49Å; Y340-W342 AromaticContact CD2-NE1 3.92Å; Y340-W342 HydrophobicContact CE1-CH2 4.11Å; Y340-W342 HydrophobicContact CE1-CZ2 4.11Å; Y340-W342 AromaticContact CE2-CZ2 3.98Å; Y340-W342 HydrophobicContact CE2-CZ2 3.98Å; Y340-W342 HydrophobicContact CG-CD2 4.36Å; Y340-W342 AromaticContact CG-CE2 3.66Å; Y340-W342 AromaticContact CG-CH2 3.63Å; Y340-W342 HydrophobicContact CG-CH2 3.63Å; Y340-W342 AromaticContact CG-CZ2 3.27Å; Y340-W342 HydrophobicContact CG-CZ2 3.27Å; Y340-W342 HydrophobicContact CG-CZ3 4.29Å; Y340-W342 PolarHBondContact O-N 2.83Å; W342-G344 PolarHBondContact O-N 3.02Å; W342-K345 WeakPolarHBondContact O-CB 3.17Å; W342-K345 PolarHBondContact O-N 2.9Å; W342-L347 HydrophobicContact CB-CD2 4.34Å
343	T	94.4	Very high	88.7	Confident	62 Å²	62	66.6 Å²	66.6	38%	0.38	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	134.9	177.7	-61.2	0	0	0	0	110.2	Q339 Y340 K345	Q339-T343 VanDerWaalsContact OE1-CG2 3.24Å; Y340-T343 PolarHBondContact N-OG1 2.81Å; Y340-T343 WeakPolarHBondContact O-CB 3.28Å; Y340-T343 PolarHBondContact O-N 2.96Å; Y340-T343 PolarHBondContact O-OG1 2.89Å; T343-K345 VanDerWaalsContact C-N 3.26Å; T343-K345 PolarHBondContact O-N 3.12Å
344	G	89.9	Confident	86.1	Confident	82 Å²	82	69.2 Å²	69.2	85%	0.845	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	-10.4	-172.3	0	0	0	0	0	115.2	W342	W342-G344 PolarHBondContact O-N 3.02Å
345	K	93.3	Very high	83	Confident	70 Å²	70	69.7 Å²	69.7	30%	0.304	42%	0.416	S	S	.	.	S	Bend	trans	-83.2	148.1	174	-58.9	-172.7	-176.7	168.2	0	111.4	L145 C146 D341 W342 T343 L347	L145-K345 HydrophobicContact CD1-CB 4.35Å; L145-K345 HydrophobicContact CD1-CD 4.36Å; L145-K345 HydrophobicContact CD2-CB 3.96Å; L145-K345 HydrophobicContact CG-CB 4.14Å; L145-K345 HydrophobicContact CG-CD 3.92Å; L145-K345 WeakPolarHBondContact O-CD 3.09Å; L145-K345 PolarHBondContact O-NZ 2.88Å; C146-K345 PolarHBondContact SG-NZ 2.71Å; D341-K345 WeakPolarHBondContact O-CE 2.97Å; D341-K345 PolarHBondContact O-NZ 2.84Å; W342-K345 WeakPolarHBondContact O-CB 3.17Å; W342-K345 PolarHBondContact O-N 2.9Å; T343-K345 VanDerWaalsContact C-N 3.26Å; T343-K345 PolarHBondContact O-N 3.12Å; K345-L347 PolarHBondContact O-N 2.82Å; K345-L347 VanDerWaalsContact O-N 3.09Å
346	P	90.9	Very high	79.9	Confident	117 Å²	117	69.6 Å²	69.6	76%	0.76	42%	0.421	S	S	*	.			trans	-70.8	105.1	177.3	28.5	-34.1	0	0	0	110.8
347	L	89.1	Confident	76.8	Confident	47 Å²	47	75 Å²	75	25%	0.246	45%	0.447	C	S	.	.			trans	-73.5	137.5	-176.1	-59.7	-177.5	0	0	0	112.3	L142 L145 P189 W342 K345 T349	L142-L347 HydrophobicContact CD2-CD2 3.59Å; L145-L347 HydrophobicContact CD2-CD2 3.63Å; P189-L347 HydrophobicContact CG-CD1 3.89Å; W342-L347 HydrophobicContact CB-CD2 4.34Å; K345-L347 PolarHBondContact O-N 2.82Å; K345-L347 VanDerWaalsContact O-N 3.09Å; L347-T349 PolarHBondContact O-N 2.71Å
348	P	81.8	Confident	73.6	Confident	60 Å²	60	77.5 Å²	77.5	39%	0.39	47%	0.465	S	S	.	.			trans	-67.8	127.5	175.2	27.6	-31.8	0	0	0	109.9	P137 D141	P137-P348 HydrophobicContact CB-CG 4.13Å; D141-P348 HydrophobicContact CB-CG 4.34Å
349	T	79.8	Confident	70.5	Confident	55 Å²	55	78.3 Å²	78.3	34%	0.337	48%	0.482	S	S	.	.			trans	-132.3	132.2	-177	47.5	0	0	0	0	111.3	L347 I351 G352	L347-T349 PolarHBondContact O-N 2.71Å; T349-I351 PolarHBondContact O-N 2.92Å; T349-G352 PolarHBondContact O-N 3.39Å; T349-G352 VanDerWaalsContact O-N 3.13Å; T349-G352 PolarHBondContact OG1-O 2.88Å
350	P	74.8	Confident	67.3	Low	39 Å²	39	81.7 Å²	81.7	25%	0.253	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-19.7	-177.8	24.8	-33	0	0	0	113.2	K63 I65 L134 G352	K63-P350 WeakPolarHBondContact CE-O 3.19Å; K63-P350 PolarHBondContact NZ-O 3.28Å; I65-P350 HydrophobicContact CB-CB 4.29Å; I65-P350 HydrophobicContact CD1-CB 4.44Å; I65-P350 HydrophobicContact CG2-CB 3.69Å; L134-P350 HydrophobicContact CD1-CG 4.21Å; L134-P350 HydrophobicContact CD2-CG 4.35Å; P350-G352 VanDerWaalsContact C-N 3.3Å
351	I	75.2	Confident	64.1	Low	60 Å²	60	90.2 Å²	90.2	31%	0.308	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-17.6	178.5	-63.5	159.8	0	0	0	111.2	L75 Y84 L134 T349	L75-I351 HydrophobicContact CD1-CG1 4.38Å; L75-I351 HydrophobicContact CD2-CG1 4.43Å; Y84-I351 HydrophobicContact CD1-CG1 4.42Å; Y84-I351 HydrophobicContact CD2-CD1 3.45Å; Y84-I351 VanDerWaalsContact CD2-CD1 3.45Å; Y84-I351 HydrophobicContact CD2-CG1 3.85Å; Y84-I351 HydrophobicContact CD2-CG2 4.41Å; Y84-I351 HydrophobicContact CE2-CD1 4.06Å; Y84-I351 HydrophobicContact CE2-CG1 4.1Å; Y84-I351 HydrophobicContact CE2-CG2 3.89Å; Y84-I351 HydrophobicContact CG-CD1 3.81Å; Y84-I351 HydrophobicContact CG-CG1 4.01Å; L134-I351 HydrophobicContact CD2-CD1 3.93Å; L134-I351 HydrophobicContact CD2-CG1 4.37Å; T349-I351 PolarHBondContact O-N 2.92Å
352	G	63.3	Low	60.8	Low	23 Å²	23	94.5 Å²	94.5	24%	0.237	57%	0.571	C	S	.	*			trans	86	176.2	-164.9	0	0	0	0	0	111.3	T349 P350 V354	T349-G352 PolarHBondContact O-N 3.39Å; T349-G352 VanDerWaalsContact O-N 3.13Å; T349-G352 PolarHBondContact OG1-O 2.88Å; P350-G352 VanDerWaalsContact C-N 3.3Å; G352-V354 PolarHBondContact O-N 3.43Å; G352-V354 VanDerWaalsContact O-N 3.1Å
353	P	53.7	Low	57.7	Low	130 Å²	130	99.5 Å²	99.5	84%	0.844	61%	0.607	S	S	*	*			trans	-58.5	119.3	175.3	25.9	-33.5	0	0	0	109.2	A355	P353-A355 PolarHBondContact O-N 3.46Å; P353-A355 VanDerWaalsContact O-N 3.13Å
354	V	45.1	Very low	54.6	Low	117 Å²	117	104.2 Å²	104.2	71%	0.709	63%	0.631	S	S	*	*			trans	-64.1	115.3	169.2	179.2	0	0	0	0	106.3	G352 T356	G352-V354 PolarHBondContact O-N 3.43Å; G352-V354 VanDerWaalsContact O-N 3.1Å; V354-T356 PolarHBondContact O-N 3.43Å
355	A	32.8	Very low	51.9	Low	82 Å²	82	111.5 Å²	111.5	68%	0.678	63%	0.632	S	S	*	*			trans	-63.2	108.6	171.4	0	0	0	0	0	107.9	P353 E357	P353-A355 PolarHBondContact O-N 3.46Å; P353-A355 VanDerWaalsContact O-N 3.13Å; A355-E357 PolarHBondContact O-N 2.83Å
356	T	33.3	Very low	48.8	Very low	118 Å²	118	116.4 Å²	116.4	72%	0.724	66%	0.657	S	S	*	*			trans	-62.3	112.4	159.5	47.1	0	0	0	0	106.6	V354 T358	V354-T356 PolarHBondContact O-N 3.43Å; T356-T358 PolarHBondContact O-N 3.4Å; T356-T358 PolarHBondContact O-OG1 3.21Å
357	E	31.5	Very low	45.8	Very low	189 Å²	189	120.6 Å²	120.6	88%	0.883	66%	0.663	S	S	*	*			trans	-72	77.3	176.9	-68.3	-169.8	160.3	0	0	110.1	A355	A355-E357 PolarHBondContact O-N 2.83Å
358	T	30	Very low	42.8	Very low	111 Å²	111	122.8 Å²	122.8	68%	0.681	69%	0.688	S	S	*	*			trans	-64.2	127.7	164.1	-30.8	0	0	0	0	107.7	T356 L360	T356-T358 PolarHBondContact O-N 3.4Å; T356-T358 PolarHBondContact O-OG1 3.21Å; T358-L360 PolarHBondContact O-N 2.94Å
359	P	31.1	Very low	40.5	Very low	117 Å²	117	126 Å²	126	76%	0.76	71%	0.708	S	S	*	*			trans	-55.5	128.5	-179.2	-28.5	36.1	0	0	0	112.3	Q361	P359-Q361 PolarHBondContact O-N 3.13Å
360	L	30.1	Very low	38	Very low	170 Å²	170	132.3 Å²	132.3	89%	0.89	73%	0.734	S	S	*	*			trans	-67.1	95.7	-177.6	-77.8	161.6	0	0	0	111.3	T358 T362	T358-L360 PolarHBondContact O-N 2.94Å; L360-T362 PolarHBondContact O-N 3.18Å
361	Q	31	Very low	35.7	Very low	187 Å²	187	137.3 Å²	137.3	87%	0.874	76%	0.764	S	S	*	*			trans	-72.4	107.9	162.8	-75.9	-169.5	-15.7	0	0	109.6	P359 S363	P359-Q361 PolarHBondContact O-N 3.13Å; Q361-S363 PolarHBondContact O-N 3.1Å
362	T	29.6	Very low	33.3	Very low	137 Å²	137	143.3 Å²	143.3	84%	0.84	79%	0.788	S	S	*	*			trans	-66.7	121.4	176.2	50.9	0	0	0	0	111.1	L360	L360-T362 PolarHBondContact O-N 3.18Å
363	S	31.2	Very low	31.6	Very low	116 Å²	116	150.2 Å²	150.2	81%	0.811	82%	0.82	S	S	*	*			trans	-132.1	129.5	161	51.8	0	0	0	0	110.1	Q361	Q361-S363 PolarHBondContact O-N 3.1Å
364	N	30	Very low	30.2	Very low	162 Å²	162	152.2 Å²	152.2	87%	0.866	82%	0.818	S	S	*	*			trans	-80.5	139.9	-179.1	-70.7	-34.1	0	0	0	110.7
365	R	32	Very low	29.3	Very low	234 Å²	234	153.5 Å²	153.5	88%	0.883	83%	0.825	S	S	*	*			trans	-156.7	157.2	145.1	-123.4	169.7	178.7	168.1	0.3	113.1
366	E	28.6	Very low	28.9	Very low	174 Å²	174	157.1 Å²	157.1	81%	0.813	83%	0.83	S	S	*	*			trans	-85	176.1	-158.4	-60.5	113.1	119.2	0	0	116.5
367	K	27.2	Very low	28.5	Very low	205 Å²	205	159.4 Å²	159.4	89%	0.891	84%	0.838	S	S	*	*			trans	-88.6	152.7	-178.3	-58.9	171.1	-180	171.9	0	112
368	A	27.2	Very low	28.2	Very low	93 Å²	93	155.6 Å²	155.6	77%	0.769	83%	0.832	S	S	*	*			trans	139.7	158.8	134.7	0	0	0	0	0	112.7
369	P	33.1	Very low	28.1	Very low	126 Å²	126	157 Å²	157	82%	0.818	84%	0.841	S	S	*	*			cis	-126.4	174.6	-45.8	36.6	-23.8	0	0	0	112.1
370	Q	26.9	Very low	27.9	Very low	188 Å²	188	159 Å²	159	88%	0.879	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-84.4	141.1	177.4	-65.4	172.7	-25.4	0	0	112.3
371	T	25.9	Very low	27.6	Very low	145 Å²	145	154.9 Å²	154.9	89%	0.89	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-103.5	134.1	158.4	41.3	0	0	0	0	110.5
372	K	26.5	Very low	27.4	Very low	186 Å²	186	154.2 Å²	154.2	81%	0.809	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-86.3	150.1	171.3	-66.5	173.7	179	173.5	0	109.3
373	N	26.6	Very low	27.2	Very low	168 Å²	168	154.5 Å²	154.5	90%	0.898	84%	0.836	S	S	*	*			trans	-138.1	121	146.8	-107.5	-18.2	0	0	0	108.9
374	Q	24.4	Very low	26.9	Very low	172 Å²	172	155.5 Å²	155.5	80%	0.804	83%	0.832	S	S	*	*			trans	-90.6	146.2	166.2	-70.4	173	-56.8	0	0	108.2
375	V	26.7	Very low	26.8	Very low	143 Å²	143	153.2 Å²	153.2	87%	0.867	82%	0.824	S	S	*	*			trans	-128.6	117.9	158	178.8	0	0	0	0	106.5
376	M	23.9	Very low	26.7	Very low	159 Å²	159	149.6 Å²	149.6	78%	0.783	82%	0.822	S	S	*	*			trans	-75.9	151.5	169	-71.6	173.5	162.2	0	0	109.7
377	N	25.4	Very low	26.7	Very low	165 Å²	165	147.5 Å²	147.5	88%	0.882	82%	0.817	S	S	*	*				-157.7	132.4	129.5	-104.4	-13.7	0	0	0	109.4
378	S	24.3	Very low	27.1	Very low	109 Å²	109	143.2 Å²	143.2	76%	0.762	81%	0.81	S	S	*	*			trans	-135.8	131.5	174.5	-59.9	0	0	0	0	108.2
379	T	28.5	Very low	27.1	Very low	142 Å²	142	144.1 Å²	144.1	87%	0.871	81%	0.806	S	S	*	*			trans	-146.1	141	160.8	20.4	0	0	0	0	108.4
380	N	26.1	Very low	26.8	Very low	159 Å²	159	143.2 Å²	143.2	85%	0.85	81%	0.809	S	S	*	*			trans	-87.5	159.1	-171.4	-62.1	-7.9	0	0	0	111.9
381	G	25.6	Very low	26.7	Very low	82 Å²	82	137.5 Å²	137.5	85%	0.845	80%	0.801	S	S	*	*			trans	-160.4	119.3	163.5	0	0	0	0	0	107.6
382	E	25.8	Very low	26.8	Very low	173 Å²	173	139.5 Å²	139.5	81%	0.808	80%	0.8	S	S	*	*			trans	-137.5	165.2	-162.5	-158.7	176.7	-143.7	0	0	111.4
383	L	25.5	Very low	26.8	Very low	143 Å²	143	134.9 Å²	134.9	75%	0.749	79%	0.79	S	S	*	*			trans	88.2	153.2	163.8	-60	172.5	0	0	0	120.4
384	N	25	Very low	26.9	Very low	137 Å²	137	134.8 Å²	134.8	73%	0.733	79%	0.79	S	S	*	*			trans	64.7	112.9	176.8	-55.7	1.6	0	0	0	115.3
385	T	27.3	Very low	27	Very low	115 Å²	115	130.8 Å²	130.8	71%	0.706	79%	0.787	S	S	*	*			cis	68.2	119.7	49.1	80	0	0	0	0	114.2
386	D	29.5	Very low	27.3	Very low	157 Å²	157	129.3 Å²	129.3	84%	0.84	78%	0.78	S	S	*	*				-178.4	151.3	108.7	-82	-4.5	0	0	0	111.7
387	D	28.4	Very low	27.5	Very low	130 Å²	130	129.3 Å²	129.3	70%	0.695	78%	0.781	S	S	*	*			trans	-151.9	136.5	172.2	164.6	38.9	0	0	0	108.3	T389	D387-T389 PolarHBondContact OD1-N 3.01Å
388	P	35.8	Very low	27.9	Very low	116 Å²	116	127.8 Å²	127.8	75%	0.753	78%	0.778	S	S	*	*			trans	-142.4	101.7	141.3	32.8	-15	0	0	0	115.3
389	T	28.4	Very low	28	Very low	112 Å²	112	127.3 Å²	127.3	69%	0.687	78%	0.781	S	S	*	*				22.8	139.9	129.1	50.9	0	0	0	0	123.6	D387	D387-T389 PolarHBondContact OD1-N 3.01Å
390	A	25.8	Very low	28	Very low	107 Å²	107	128 Å²	128	88%	0.884	78%	0.779	S	S	*	*			trans	70.5	142.7	156.4	0	0	0	0	0	119.2
391	G	25.4	Very low	28	Very low	68 Å²	68	125.2 Å²	125.2	70%	0.701	78%	0.778	S	S	*	*			cis	-138.9	-144.4	0.3	0	0	0	0	0	112
392	H	27.2	Very low	28.1	Very low	187 Å²	187	129.9 Å²	129.9	87%	0.866	78%	0.778	S	S	*	*			cis	-157.2	-161.7	-2.3	-121.3	-55.1	0	0	0	111.5
393	S	27	Very low	28.5	Very low	88 Å²	88	127.5 Å²	127.5	62%	0.615	78%	0.775	S	S	*	*			trans	-88.9	146.9	-166.4	-43.9	0	0	0	0	116.7
394	N	28.2	Very low	28.7	Very low	166 Å²	166	128.1 Å²	128.1	89%	0.888	77%	0.774	S	S	*	*				176.8	154.3	113	-87.5	-20.6	0	0	0	113.4
395	A	27.7	Very low	29.3	Very low	89 Å²	89	126.1 Å²	126.1	74%	0.736	77%	0.767	S	S	*	*			trans	-113.7	163.7	168	0	0	0	0	0	109.4
396	P	32.5	Very low	29.6	Very low	111 Å²	111	124.8 Å²	124.8	72%	0.721	76%	0.76	S	S	*	*				-155.6	173.3	93.3	42	-24.2	0	0	0	117.7
397	I	27.4	Very low	29.6	Very low	159 Å²	159	123.8 Å²	123.8	82%	0.815	76%	0.755	S	S	*	*			trans	78.7	150.4	153	-72.7	155.5	0	0	0	119.1
398	T	34.9	Very low	30	Very low	134 Å²	134	122.9 Å²	122.9	82%	0.822	75%	0.75	S	S	*	*			trans	-68.9	137.6	-161.5	50.2	0	0	0	0	116.6
399	A	26.4	Very low	29.7	Very low	98 Å²	98	123.8 Å²	123.8	81%	0.81	75%	0.747	S	S	*	*			trans	-132.9	161.5	152	0	0	0	0	0	109.4
400	N	27.3	Very low	29.6	Very low	156 Å²	156	126.2 Å²	126.2	83%	0.834	75%	0.748	S	S	*	*			trans	-66.9	148.2	-175.8	-69.9	-36.1	0	0	0	112.2	E402	N400-E402 PolarHBondContact O-N 3.01Å
401	A	26.8	Very low	29.7	Very low	101 Å²	101	125.4 Å²	125.4	84%	0.835	74%	0.735	S	S	*	*			trans	-73.3	86.9	175.9	0	0	0	0	0	111	V403	A401-V403 PolarHBondContact O-N 2.69Å
402	E	28.3	Very low	29.8	Very low	181 Å²	181	127.5 Å²	127.5	85%	0.846	74%	0.737	S	S	*	*			trans	-61.2	128	161.8	-64.3	-162.6	142.1	0	0	108.9	N400 E404	N400-E402 PolarHBondContact O-N 3.01Å; E402-E404 PolarHBondContact O-N 2.99Å; E402-E404 VanDerWaalsContact O-N 3.13Å
403	V	34.4	Very low	29.8	Very low	123 Å²	123	122 Å²	122	75%	0.745	72%	0.719	S	S	*	*			trans	-79.4	99.9	178.2	178.8	0	0	0	0	107.9	A401 V405	A401-V403 PolarHBondContact O-N 2.69Å; V403-V405 PolarHBondContact O-N 3.13Å
404	E	28.6	Very low	29.8	Very low	155 Å²	155	125.2 Å²	125.2	72%	0.724	72%	0.722	S	S	*	*			trans	-52.3	105.3	164.5	-70.8	-178.3	118.4	0	0	109.1	R95 E402 P406	R95-E404 IonicContact NH1-OE2 2.74Å; E402-E404 PolarHBondContact O-N 2.99Å; E402-E404 VanDerWaalsContact O-N 3.13Å; E404-P406 WeakPolarHBondContact O-CD 3.32Å
405	V	37.6	Very low	29.9	Very low	95 Å²	95	126.1 Å²	126.1	58%	0.576	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-73.7	117.1	165	180	0	0	0	0	106.1	V403	V403-V405 PolarHBondContact O-N 3.13Å
406	P	33.8	Very low	29.9	Very low	87 Å²	87	131.8 Å²	131.8	57%	0.565	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-59.3	150.6	-178.7	-24.2	35.3	0	0	0	112	E404	E404-P406 WeakPolarHBondContact O-CD 3.32Å
407	D	30.8	Very low	29.9	Very low	137 Å²	137	137.6 Å²	137.6	73%	0.733	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-49.5	162.2	-176.3	-71.4	-66.9	0	0	0	115.3	I409	D407-I409 HydrophobicContact CB-CG1 4.26Å; D407-I409 PolarHBondContact O-N 2.75Å
408	D	36.4	Very low	30.1	Very low	110 Å²	110	141.8 Å²	141.8	59%	0.588	74%	0.74	S	S	*	*			trans	-60.2	67.9	156.9	-84.1	-26.7	0	0	0	110.2	R276 K410	R276-D408 IonicContact CZ-OD2 3.61Å; R276-D408 IonicContact NH1-OD2 2.65Å; R276-D408 PolarHBondContact NH1-OD2 3.43Å; R276-D408 IonicContact NH2-OD2 2.73Å; R276-D408 PolarHBondContact NH2-OD2 2.81Å; D408-K410 PolarHBondContact O-N 3.17Å
409	I	29	Very low	29.9	Very low	136 Å²	136	145.2 Å²	145.2	70%	0.697	74%	0.743	S	S	*	*			trans	-65.6	99	172.1	-61.3	-179.3	0	0	0	106.9	D407 C411	D407-I409 HydrophobicContact CB-CG1 4.26Å; D407-I409 PolarHBondContact O-N 2.75Å; I409-C411 PolarHBondContact O-N 3.27Å; I409-C411 VanDerWaalsContact O-N 3.08Å
410	K	27.3	Very low	30.5	Very low	163 Å²	163	152.1 Å²	152.1	71%	0.709	75%	0.749	S	S	*	*			trans	-33.1	114.1	176.2	-67.9	167.1	-177.9	162.4	0	110.9	D408 C412	D408-K410 PolarHBondContact O-N 3.17Å; K410-C412 PolarHBondContact O-N 2.81Å; K410-C412 VanDerWaalsContact O-N 3.12Å
411	C	27.8	Very low	30.7	Very low	89 Å²	89	154.2 Å²	154.2	60%	0.601	75%	0.75	S	S	*	*			trans	-54.3	123	173.7	-173.4	0	0	0	0	109	I409 C413	I409-C411 PolarHBondContact O-N 3.27Å; I409-C411 VanDerWaalsContact O-N 3.08Å; C411-C413 PolarHBondContact O-N 2.96Å
412	C	26.3	Very low	31	Very low	112 Å²	112	153.9 Å²	153.9	76%	0.757	75%	0.747	S	S	*	*	S	Bend	trans	-79.5	40.2	-173.5	-70.6	0	0	0	0	113.5	K410 F414	K410-C412 PolarHBondContact O-N 2.81Å; K410-C412 VanDerWaalsContact O-N 3.12Å; C412-F414 PolarHBondContact O-N 2.73Å
413	C	27.8	Very low	31.2	Very low	72 Å²	72	153.3 Å²	153.3	49%	0.486	75%	0.749	S	S	.	*			trans	-75.1	7.4	163.7	-65.4	0	0	0	0	112.8	C411 F415	C411-C413 PolarHBondContact O-N 2.96Å; C413-F415 PolarHBondContact O-N 2.88Å
414	F	27.2	Very low	31.2	Very low	155 Å²	155	155.7 Å²	155.7	68%	0.68	75%	0.752	S	S	*	*			trans	-64.7	75.3	171.7	-86.5	-77.9	0	0	0	112.9	C412 K416	C412-F414 PolarHBondContact O-N 2.73Å; F414-K416 PolarHBondContact O-N 2.77Å
415	F	30.6	Very low	31.4	Very low	186 Å²	186	160.2 Å²	160.2	82%	0.816	76%	0.763	S	S	*	*			trans	-55.1	135.9	151.3	-82.1	-86.9	0	0	0	109	C413 R417	C413-F415 PolarHBondContact O-N 2.88Å; F415-R417 PolarHBondContact O-N 3.39Å
416	K	27.6	Very low	31.4	Very low	207 Å²	207	163.9 Å²	163.9	90%	0.9	77%	0.773	S	S	*	*			trans	-56.3	111.3	-172.1	-70.3	180	177	178.5	0	111	F414 R418	F414-K416 PolarHBondContact O-N 2.77Å; K416-R418 PolarHBondContact O-N 2.85Å
417	R	31.4	Very low	31.5	Very low	234 Å²	234	173 Å²	173	88%	0.883	80%	0.804	S	S	*	*			trans	-52.3	103.4	170.1	-100.9	-174.6	170.5	-176.1	-3.1	109.7	F415 K419	F415-R417 PolarHBondContact O-N 3.39Å; R417-K419 PolarHBondContact O-N 3.23Å; R417-K419 VanDerWaalsContact O-N 3.12Å
418	R	33	Very low	31.6	Very low	247 Å²	247	174.9 Å²	174.9	93%	0.932	81%	0.807	S	S	*	*			trans	-71.9	103.7	172.6	-146.7	176.5	-172	-175.9	1.6	106.9	K416 R420	K416-R418 PolarHBondContact O-N 2.85Å; R418-R420 PolarHBondContact O-N 2.82Å
419	K	30.8	Very low	31.3	Very low	205 Å²	205	178.3 Å²	178.3	89%	0.891	82%	0.819	S	S	*	*			trans	-54.9	105.9	174.8	-87.5	-173	173.4	-178.5	0	109	R417 K421	R417-K419 PolarHBondContact O-N 3.23Å; R417-K419 VanDerWaalsContact O-N 3.12Å; K419-K421 PolarHBondContact O-N 3.09Å
420	R	37.1	Very low	31.5	Very low	244 Å²	244	180.6 Å²	180.6	92%	0.921	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-64.3	124.3	159	-81.1	-177.5	168	168.7	-3.2	106.7	R418 A422	R418-R420 PolarHBondContact O-N 2.82Å; R420-A422 PolarHBondContact O-N 3.08Å
421	K	32.9	Very low	31.7	Very low	200 Å²	200	181.6 Å²	181.6	87%	0.87	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-65.6	128.8	163.9	-74.4	-175.1	174.4	-175.8	0	107	K419	K419-K421 PolarHBondContact O-N 3.09Å
422	A	32.4	Very low	31.9	Very low	93 Å²	93	187.4 Å²	187.4	77%	0.769	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-68.5	134.5	164.8	0	0	0	0	0	108.4	R420	R420-A422 PolarHBondContact O-N 3.08Å
423	L	33.7	Very low	32.3	Very low	169 Å²	169	192.5 Å²	192.5	89%	0.885	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-75.3	125.8	163.4	-80.1	83.8	0	0	0	107.6	R425	L423-R425 PolarHBondContact O-N 2.91Å
424	Q	32.9	Very low	32.6	Very low	173 Å²	173	201.1 Å²	201.1	81%	0.808	88%	0.879	S	S	*	*	P	Polyproline II helix	trans	-72.9	120.3	163.9	-71.9	170.6	-57.6	0	0	108	H426	Q424-H426 PolarHBondContact O-N 3.47Å
425	R	33.9	Very low	33.1	Very low	251 Å²	251	204.6 Å²	204.6	95%	0.947	90%	0.895	S	S	*	*	P	Polyproline II helix	trans	-69.2	120.3	157	-89.7	176.6	147.9	173	-8.9	107.1	L423	L423-R425 PolarHBondContact O-N 2.91Å
426	H	36.4	Very low	33.3	Very low	171 Å²	171	206.2 Å²	206.2	79%	0.792	90%	0.901	S	S	*	*	P	Polyproline II helix	trans	-69.8	160.7	159.1	-89.5	-105.5	0	0	0	109.9	Q424	Q424-H426 PolarHBondContact O-N 3.47Å
427	K	37.3	Very low	33.8	Very low	280 Å²	280	206.1 Å²	206.1	100%	1.217	90%	0.901	S	S	*	*			trans	-69.2	0	166.6	-68.4	-177.1	175.5	-176.9	0	110.2

Retrieved 427 of 427 residues in 200.3 ms (Link to these results)

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