A0A093HLA4_STRCA Loading...

MBT domain-containing protein 1

AlphaFold DB , UniProt , Accession A0A093HLA4, Species STRCA (Struthio camelus australis), Gene n/a, Length 628 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	33.7	Very low	32.3	Very low	252 Å²	252	154.4 Å²	154.4	100%	1.241	84%	0.839	S	S	*	*				0	177.4	0	-80.6	160.1	167.6	0	0	107.7
2	F	30.6	Very low	32.1	Very low	191 Å²	191	154.2 Å²	154.2	84%	0.838	85%	0.847	S	S	*	*			trans	-92.2	-171	-165.9	-137.5	-105.4	0	0	0	112.4
3	D	33.3	Very low	32	Very low	152 Å²	152	150.8 Å²	150.8	81%	0.813	84%	0.842	S	S	*	*			trans	80.1	140	170.2	-44.4	-33.7	0	0	0	115.7
4	G	32.6	Very low	31.9	Very low	76 Å²	76	148.9 Å²	148.9	78%	0.784	84%	0.843	S	S	*	*			cis	-144.9	-176.9	1.8	0	0	0	0	0	113.2
5	Y	35.2	Very low	31.7	Very low	220 Å²	220	147 Å²	147	86%	0.863	84%	0.843	S	S	*	*			trans	-105.8	-178.5	-169.8	-133.2	-105.7	0	0	0	113.3
6	D	32.6	Very low	31.6	Very low	135 Å²	135	145.8 Å²	145.8	72%	0.722	85%	0.846	S	S	*	*			trans	73	150.1	163.7	-74.2	-38	0	0	0	119.4
7	S	34.7	Very low	31.5	Very low	93 Å²	93	143.2 Å²	143.2	65%	0.65	84%	0.838	S	S	*	*			cis	-169.6	173.4	-27.6	-115	0	0	0	0	111.4
8	C	30.2	Very low	31.6	Very low	126 Å²	126	141.1 Å²	141.1	85%	0.851	83%	0.833	S	S	*	*			trans	71.8	127.3	160.3	-66.6	0	0	0	0	121.3
9	S	31.3	Very low	31.6	Very low	108 Å²	108	141.4 Å²	141.4	76%	0.755	83%	0.83	S	S	*	*			trans	-51.7	158.4	162.5	-34.5	0	0	0	0	115.6
10	E	29.9	Very low	31.7	Very low	193 Å²	193	143.5 Å²	143.5	90%	0.902	83%	0.832	S	S	*	*				-170.9	160.4	95.6	-95.8	-172.3	151.1	0	0	111.6
11	D	31.7	Very low	31.7	Very low	152 Å²	152	142.6 Å²	142.6	81%	0.813	83%	0.833	S	S	*	*			trans	-87.1	152.4	-176.8	-63.2	-81.5	0	0	0	113.4
12	T	29.4	Very low	31.6	Very low	152 Å²	152	139.7 Å²	139.7	93%	0.933	82%	0.817	S	S	*	*			trans	-163.4	157.6	133.9	4.8	0	0	0	0	112.3
13	S	31	Very low	31.6	Very low	111 Å²	111	139.8 Å²	139.8	78%	0.776	82%	0.82	S	S	*	*			trans	-101	160.3	-167.2	51.7	0	0	0	0	114.5
14	S	29.8	Very low	31.4	Very low	123 Å²	123	142 Å²	142	86%	0.86	83%	0.825	S	S	*	*			trans	-144.1	146.5	154.2	62.3	0	0	0	0	110.1
15	S	30.3	Very low	31.4	Very low	121 Å²	121	145 Å²	145	85%	0.846	83%	0.828	S	S	*	*			trans	-108.7	157.2	-158.5	-47	0	0	0	0	113.8
16	S	29.8	Very low	31.3	Very low	127 Å²	127	138.7 Å²	138.7	89%	0.888	82%	0.821	S	S	*	*			trans	-148.3	141.2	157.4	-170.6	0	0	0	0	109.3
17	S	30.2	Very low	31.2	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	83%	0.826	S	S	*	*			trans	-134.9	140.4	-165.3	54	0	0	0	0	112.9
18	S	32.2	Very low	31.1	Very low	106 Å²	106	141.6 Å²	141.6	74%	0.741	84%	0.836	S	S	*	*			trans	-171.1	100.4	156.3	56.7	0	0	0	0	111.3
19	D	32.2	Very low	31.2	Very low	146 Å²	146	141.3 Å²	141.3	78%	0.781	83%	0.832	S	S	*	*				40.6	130.9	106.2	-51.5	-12.5	0	0	0	117.8
20	E	32.6	Very low	31.6	Very low	184 Å²	184	142.1 Å²	142.1	86%	0.86	84%	0.838	S	S	*	*			cis	-150.1	157.7	-4.9	-54.6	-173.6	109.6	0	0	110.3
21	S	33	Very low	31.9	Very low	124 Å²	124	138.2 Å²	138.2	87%	0.867	83%	0.832	S	S	*	*				172.7	135.5	123.4	62.4	0	0	0	0	111.8
22	E	31.6	Very low	32	Very low	191 Å²	191	137.3 Å²	137.3	89%	0.893	83%	0.826	S	S	*	*			trans	-108.6	136.4	-174.4	-59.6	-178.9	135.9	0	0	113
23	E	30.5	Very low	32.3	Very low	194 Å²	194	134.9 Å²	134.9	91%	0.907	81%	0.813	S	S	*	*			trans	-138	118.8	146.3	-80.6	-163.4	140.2	0	0	108
24	E	28.9	Very low	32.5	Very low	198 Å²	198	135 Å²	135	93%	0.925	80%	0.804	S	S	*	*			trans	-75.1	136.5	-179.9	-77.3	-159.2	120.5	0	0	112.7
25	V	31.9	Very low	32.9	Very low	138 Å²	138	134.2 Å²	134.2	84%	0.836	79%	0.789	S	S	*	*			trans	-120.6	114.2	163.9	179.8	0	0	0	0	108.9
26	A	32.8	Very low	32.9	Very low	88 Å²	88	136.9 Å²	136.9	73%	0.727	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-61.4	145.7	179.1	0	0	0	0	0	112.2
27	P	31.8	Very low	33.1	Very low	127 Å²	127	136.3 Å²	136.3	83%	0.825	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-74.7	138.9	-162.2	27.7	-35.9	0	0	0	114.7
28	L	31.6	Very low	33.4	Very low	163 Å²	163	139 Å²	139	85%	0.853	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-72.4	140	169.4	-71.9	166.6	0	0	0	111.5	S30	L28-S30 PolarHBondContact O-N 3.07Å
29	P	32.4	Very low	33.7	Very low	119 Å²	119	138 Å²	138	77%	0.773	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-69.9	126.6	176	28.3	-33.9	0	0	0	111.7	S31	P29-S31 PolarHBondContact O-N 2.66Å
30	S	39.4	Very low	33.7	Very low	125 Å²	125	136.9 Å²	136.9	87%	0.874	78%	0.775	S	S	*	*			trans	-88.9	94.3	-171.8	46.6	0	0	0	0	113.8	L28	L28-S30 PolarHBondContact O-N 3.07Å
31	S	37.7	Very low	33.7	Very low	111 Å²	111	132.8 Å²	132.8	78%	0.776	76%	0.762	S	S	*	*			trans	-150.4	94.7	162.8	51.2	0	0	0	0	113.5	P29	P29-S31 PolarHBondContact O-N 2.66Å
32	L	33.1	Very low	33.9	Very low	134 Å²	134	134 Å²	134	70%	0.702	75%	0.749	S	S	*	*			trans	-75.2	145.4	163.9	-70.5	172.2	0	0	0	110.2	I34	L32-I34 PolarHBondContact O-N 2.65Å; L32-I34 VanDerWaalsContact O-N 3.12Å
33	P	35.2	Very low	34.1	Very low	100 Å²	100	129.6 Å²	129.6	65%	0.649	74%	0.735	S	S	*	*			trans	-68.6	110.4	-177.7	26.5	-34.1	0	0	0	112	I35	P33-I35 PolarHBondContact O-N 3.37Å
34	I	35.2	Very low	34.5	Very low	115 Å²	115	127.9 Å²	127.9	59%	0.59	72%	0.721	S	S	*	*			trans	-81.9	110.8	179	-57.9	174.8	0	0	0	110.1	L32 K36 V41	L32-I34 PolarHBondContact O-N 2.65Å; L32-I34 VanDerWaalsContact O-N 3.12Å; I34-K36 HydrophobicContact CG2-CG 4.09Å; I34-V41 HydrophobicContact CG2-CG1 4.28Å
35	I	37.6	Very low	34.9	Very low	106 Å²	106	123 Å²	123	54%	0.544	71%	0.707	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.1	118.6	168.5	-56.6	177.8	0	0	0	108.7	P33	P33-I35 PolarHBondContact O-N 3.37Å
36	K	31.2	Very low	35.6	Very low	177 Å²	177	122.1 Å²	122.1	77%	0.77	70%	0.698	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.6	127	174	-62.1	-175.2	-176.2	180	0	110.1	I34	I34-K36 HydrophobicContact CG2-CG 4.09Å
37	N	34.7	Very low	36.4	Very low	114 Å²	114	121.3 Å²	121.3	61%	0.61	70%	0.698	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-146.2	133.9	170.1	-168.7	3.1	0	0	0	109.7	G39 Q40	N37-G39 PolarHBondContact O-N 3.25Å; N37-Q40 PolarHBondContact O-N 3.44Å
38	N	35.3	Very low	37.3	Very low	160 Å²	160	122.8 Å²	122.8	86%	0.856	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	42.3	40.3	-178.9	-71.4	-5.2	0	0	0	115.8	Q40	N38-Q40 VanDerWaalsContact C-N 3.3Å; N38-Q40 PolarHBondContact O-N 3.17Å
39	G	39.2	Very low	38.5	Very low	84 Å²	84	116.6 Å²	116.6	87%	0.866	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.5	1.5	171.3	0	0	0	0	0	116.6	N37	N37-G39 PolarHBondContact O-N 3.25Å
40	Q	32	Very low	40.2	Very low	123 Å²	123	113 Å²	113	58%	0.575	65%	0.646	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.1	146.1	173.6	-72.1	-173.4	-26	0	0	111.8	N37 N38 Y42	N37-Q40 PolarHBondContact O-N 3.44Å; N38-Q40 VanDerWaalsContact C-N 3.3Å; N38-Q40 PolarHBondContact O-N 3.17Å; Q40-Y42 HydrophobicContact CB-CE2 3.82Å; Q40-Y42 PolarHBondContact OE1-OH 3.16Å
41	V	31.9	Very low	41.8	Very low	97 Å²	97	114.4 Å²	114.4	59%	0.588	64%	0.641	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.2	130.1	-179.6	178.3	0	0	0	0	109	I34	I34-V41 HydrophobicContact CG2-CG1 4.28Å
42	Y	38.2	Very low	43.7	Very low	150 Å²	150	109.9 Å²	109.9	59%	0.588	61%	0.61	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-122.8	104.7	173.8	-65.9	-88.4	0	0	0	109.2	Q40	Q40-Y42 HydrophobicContact CB-CE2 3.82Å; Q40-Y42 PolarHBondContact OE1-OH 3.16Å
43	T	35.3	Very low	45.6	Very low	99 Å²	99	107.4 Å²	107.4	61%	0.607	60%	0.6	S	S	*	*			trans	-71.8	151.8	160.4	32.4	0	0	0	0	109.7	P45	T43-P45 WeakPolarHBondContact O-CD 3.38Å
44	Y	39.6	Very low	47.6	Very low	157 Å²	157	102.7 Å²	102.7	62%	0.616	57%	0.57	S	S	*	*			trans	-77.9	118	171.9	-86.8	-91.3	0	0	0	110.7
45	P	36.6	Very low	49.8	Very low	97 Å²	97	101.2 Å²	101.2	63%	0.63	56%	0.56	S	S	*	*			trans	-100.1	115.5	168.9	8	15.5	0	0	0	109.2	T43 G47	T43-P45 WeakPolarHBondContact O-CD 3.38Å; P45-G47 VanDerWaalsContact C-N 3.29Å; P45-G47 PolarHBondContact O-N 2.73Å
46	D	46.1	Very low	51.5	Low	118 Å²	118	99.3 Å²	99.3	63%	0.631	55%	0.55	S	S	*	.	S	Bend	trans	62.9	18.2	151.6	-166.7	28.1	0	0	0	117.7	K48	D46-K48 WeakPolarHBondContact O-CD 3.45Å; D46-K48 VanDerWaalsContact O-CG 3.31Å; D46-K48 WeakPolarHBondContact O-CG 3.41Å; D46-K48 PolarHBondContact O-N 3.41Å; D46-K48 IonicContact OD1-NZ 3.73Å; D46-K48 PolarHBondContact OD1-NZ 2.86Å; D46-K48 WeakPolarHBondContact OD2-CD 3.12Å; D46-K48 IonicContact OD2-NZ 2.68Å; D46-K48 PolarHBondContact OD2-NZ 2.81Å
47	G	51.4	Low	53.2	Low	71 Å²	71	94.1 Å²	94.1	73%	0.732	54%	0.535	S	S	*	.	S	Bend	trans	61.8	-2.2	159.2	0	0	0	0	0	119.1	P45	P45-G47 VanDerWaalsContact C-N 3.29Å; P45-G47 PolarHBondContact O-N 2.73Å
48	K	50.6	Low	54.4	Low	158 Å²	158	91 Å²	91	69%	0.687	53%	0.53	S	S	*	.			trans	-87.2	-6.1	-171.6	-73.6	145.6	-178.2	153.8	0	114.4	D46 G50	D46-K48 WeakPolarHBondContact O-CD 3.45Å; D46-K48 VanDerWaalsContact O-CG 3.31Å; D46-K48 WeakPolarHBondContact O-CG 3.41Å; D46-K48 PolarHBondContact O-N 3.41Å; D46-K48 IonicContact OD1-NZ 3.73Å; D46-K48 PolarHBondContact OD1-NZ 2.86Å; D46-K48 WeakPolarHBondContact OD2-CD 3.12Å; D46-K48 IonicContact OD2-NZ 2.68Å; D46-K48 PolarHBondContact OD2-NZ 2.81Å; K48-G50 PolarHBondContact O-N 3.03Å
49	S	56.9	Low	55.5	Low	34 Å²	34	88.7 Å²	88.7	24%	0.238	52%	0.515	C	S	.	.			trans	-87.1	89.1	-176.5	43.3	0	0	0	0	112	D64	S49-D64 WeakPolarHBondContact CB-OD2 3.26Å
50	G	67.1	Low	56.6	Low	42 Å²	42	88.6 Å²	88.6	43%	0.433	50%	0.498	S	S	.	.			trans	-58.4	168.1	178.9	0	0	0	0	0	114.6	K48 R63	K48-G50 PolarHBondContact O-N 3.03Å; G50-R63 WeakPolarHBondContact O-CB 3.48Å; G50-R63 PolarHBondContact O-N 2.94Å
51	M	73.4	Confident	58.8	Low	156 Å²	156	84 Å²	84	77%	0.768	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	153.9	177.7	-67.4	-174.5	-74.4	0	0	112.6	V60 G61	M51-V60 HydrophobicContact CB-CG1 4.19Å; M51-V60 HydrophobicContact SD-CG1 4.15Å; M51-G61 CarbonylContact C-O 3.46Å; M51-G61 WeakPolarHBondContact CA-O 3.34Å
52	A	77.8	Confident	61	Low	15 Å²	15	82 Å²	82	12%	0.124	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	154.9	170.2	0	0	0	0	0	110.9	V60 G61 R63 F66	A52-V60 VanDerWaalsContact O-CA 3.29Å; A52-V60 WeakPolarHBondContact O-CA 3.43Å; A52-G61 PolarHBondContact N-O 3.15Å; A52-G61 PolarHBondContact O-N 3.25Å; A52-R63 HydrophobicContact CB-CB 3.89Å; A52-R63 HydrophobicContact CB-CG 3.98Å; A52-F66 HydrophobicContact CB-CD1 3.9Å; A52-F66 HydrophobicContact CB-CD2 4.29Å; A52-F66 HydrophobicContact CB-CE1 3.85Å; A52-F66 HydrophobicContact CB-CE2 4.27Å; A52-F66 HydrophobicContact CB-CG 4.13Å; A52-F66 HydrophobicContact CB-CZ 4.05Å; A52-F66 WeakPolarHBondContact O-CZ 3.21Å
53	T	72.8	Confident	62.8	Low	82 Å²	82	80.7 Å²	80.7	50%	0.503	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	131.9	179.3	-54.3	0	0	0	0	109.4	E55 V60	T53-E55 PolarHBondContact O-N 3.15Å; T53-V60 HydrophobicContact CG2-CG2 4.1Å
54	C	77.6	Confident	64.8	Low	1 Å²	1	80.1 Å²	80.1	1%	0.007	46%	0.458	C	S	.	.			trans	-77	115.3	-177.8	-179.4	0	0	0	0	110.8	M56 C57 G58 M59 F66 C74	C54-M56 PolarHBondContact O-N 3.24Å; C54-C57 PolarHBondContact O-N 3.18Å; C54-C57 PolarHBondContact SG-SG 3.3Å; C54-G58 PolarHBondContact O-N 3.02Å; C54-M59 HydrophobicContact CB-CB 4.17Å; C54-M59 WeakPolarHBondContact CB-O 3.26Å; C54-M59 PolarHBondContact N-O 3.41Å; C54-F66 HydrophobicContact CB-CE1 4Å; C54-C74 HydrophobicContact CB-CB 4.13Å; C54-C74 PolarHBondContact SG-N 3.39Å; C54-C74 VanDerWaalsContact SG-N 3.35Å
55	E	80.1	Confident	66.5	Low	85 Å²	85	76.6 Å²	76.6	40%	0.397	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	5.4	-174.7	-68.1	-176.9	-134.9	0	0	115.7	T53 R72 F73 Y82	T53-E55 PolarHBondContact O-N 3.15Å; E55-R72 VanDerWaalsContact CD-NH2 3.31Å; E55-R72 PolarHBondContact N-O 2.83Å; E55-R72 VanDerWaalsContact N-O 3.12Å; E55-R72 IonicContact OE1-CZ 3.56Å; E55-R72 IonicContact OE1-NE 2.7Å; E55-R72 PolarHBondContact OE1-NE 3.39Å; E55-R72 IonicContact OE1-NH2 2.75Å; E55-R72 PolarHBondContact OE1-NH2 2.75Å; E55-R72 VanDerWaalsContact OE1-NH2 3.13Å; E55-R72 IonicContact OE2-CZ 3.39Å; E55-R72 IonicContact OE2-NE 2.77Å; E55-R72 IonicContact OE2-NH2 3.16Å; E55-R72 PolarHBondContact OE2-NH2 3.1Å; E55-F73 HydrophobicContact CB-CE1 4.04Å; E55-Y82 HydrophobicContact CB-CD2 4.11Å; E55-Y82 HydrophobicContact CB-CE2 3.69Å; E55-Y82 WeakPolarHBondContact OE2-CE2 3.37Å; E55-Y82 PolarHBondContact OE2-OH 3.41Å
56	M	73.9	Confident	68.7	Low	65 Å²	65	72.5 Å²	72.5	32%	0.32	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-30.4	170.9	-82.2	-56.6	-56.2	0	0	115.3	C54 F73 C78 Y82	C54-M56 PolarHBondContact O-N 3.24Å; M56-F73 HydrophobicContact CG-CE1 4.37Å; M56-C78 HydrophobicContact CB-CB 4.11Å; M56-C78 VanDerWaalsContact CG-O 3.29Å; M56-C78 WeakPolarHBondContact CG-O 3.45Å; M56-Y82 HydrophobicContact CG-CD2 3.83Å; M56-Y82 HydrophobicContact CG-CG 4.22Å; M56-Y82 VanDerWaalsContact SD-CA 3.51Å; M56-Y82 HydrophobicContact SD-CD2 3.71Å; M56-Y82 HydrophobicContact SD-CG 4.2Å
57	C	66.6	Low	70.1	Confident	69 Å²	69	71.7 Å²	71.7	47%	0.466	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.7	5.5	-172.8	66.8	0	0	0	0	114	C54 M59	C54-C57 PolarHBondContact O-N 3.18Å; C54-C57 PolarHBondContact SG-SG 3.3Å; C57-M59 PolarHBondContact O-N 3.15Å
58	G	60.3	Low	70.8	Confident	48 Å²	48	70.1 Å²	70.1	50%	0.495	40%	0.4	S	S	.	.			trans	68.5	-6.3	178.7	0	0	0	0	0	115.3	C54 V60	C54-G58 PolarHBondContact O-N 3.02Å; G58-V60 WeakPolarHBondContact O-CG2 3.38Å; G58-V60 PolarHBondContact O-N 3.03Å
59	M	58.7	Low	71.7	Confident	111 Å²	111	72.9 Å²	72.9	55%	0.547	41%	0.412	S	S	.	.			trans	-54.2	123.1	178.6	-179.5	-178.7	-73.2	0	0	110.9	C54 C57 F66 C74	C54-M59 HydrophobicContact CB-CB 4.17Å; C54-M59 WeakPolarHBondContact CB-O 3.26Å; C54-M59 PolarHBondContact N-O 3.41Å; C57-M59 PolarHBondContact O-N 3.15Å; M59-F66 WeakPolarHBondContact O-CZ 3.3Å; M59-C74 HydrophobicContact CG-CB 4.35Å; M59-C74 HydrophobicContact SD-CB 3.58Å; M59-C74 VanDerWaalsContact SD-CB 3.58Å
60	V	62.8	Low	72.7	Confident	83 Å²	83	75.8 Å²	75.8	50%	0.503	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	145.3	176.7	-174.6	0	0	0	0	109.9	M51 A52 T53 G58	M51-V60 HydrophobicContact CB-CG1 4.19Å; M51-V60 HydrophobicContact SD-CG1 4.15Å; A52-V60 VanDerWaalsContact O-CA 3.29Å; A52-V60 WeakPolarHBondContact O-CA 3.43Å; T53-V60 HydrophobicContact CG2-CG2 4.1Å; G58-V60 WeakPolarHBondContact O-CG2 3.38Å; G58-V60 PolarHBondContact O-N 3.03Å
61	G	77.1	Confident	73.5	Confident	25 Å²	25	76.7 Å²	76.7	26%	0.258	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.5	-175.9	171.8	0	0	0	0	0	112.7	M51 A52 R63	M51-G61 CarbonylContact C-O 3.46Å; M51-G61 WeakPolarHBondContact CA-O 3.34Å; A52-G61 PolarHBondContact N-O 3.15Å; A52-G61 PolarHBondContact O-N 3.25Å; G61-R63 PolarHBondContact O-N 3.22Å
62	V	78.9	Confident	74.1	Confident	55 Å²	55	73.8 Å²	73.8	33%	0.333	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	126.1	176.5	-177.1	0	0	0	0	109.5	D64 A65 F66	V62-D64 PolarHBondContact O-N 3.11Å; V62-D64 VanDerWaalsContact O-N 3.08Å; V62-A65 WeakPolarHBondContact O-CB 3.31Å; V62-A65 PolarHBondContact O-N 3.44Å; V62-F66 WeakPolarHBondContact O-CD2 3.22Å
63	R	75.3	Confident	74.5	Confident	124 Å²	124	73.7 Å²	73.7	47%	0.468	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-55.8	-32.4	-173	-179.4	178.3	73.5	-175.1	1.3	113	G50 A52 G61 A65 F66 K71	G50-R63 WeakPolarHBondContact O-CB 3.48Å; G50-R63 PolarHBondContact O-N 2.94Å; A52-R63 HydrophobicContact CB-CB 3.89Å; A52-R63 HydrophobicContact CB-CG 3.98Å; G61-R63 PolarHBondContact O-N 3.22Å; R63-A65 VanDerWaalsContact C-N 3.33Å; R63-A65 PolarHBondContact O-N 3.49Å; R63-F66 WeakPolarHBondContact O-CB 3.36Å; R63-F66 PolarHBondContact O-N 3.21Å; R63-K71 HydrophobicContact CG-CB 3.67Å; R63-K71 HydrophobicContact CG-CG 3.98Å; R63-K71 WeakPolarHBondContact O-CD 3.34Å; R63-K71 WeakPolarHBondContact O-CG 3.38Å
64	D	77.1	Confident	74.9	Confident	87 Å²	87	71.3 Å²	71.3	47%	0.465	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-77.9	-18.9	-177.4	-58	-47	0	0	0	113.5	S49 V62 F66 K71	S49-D64 WeakPolarHBondContact CB-OD2 3.26Å; V62-D64 PolarHBondContact O-N 3.11Å; V62-D64 VanDerWaalsContact O-N 3.08Å; D64-F66 PolarHBondContact O-N 2.98Å; D64-K71 PolarHBondContact O-NZ 3.34Å
65	A	74.8	Confident	75.3	Confident	82 Å²	82	73.1 Å²	73.1	68%	0.678	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-75.1	-8.6	168.7	0	0	0	0	0	113.3	V62 R63	V62-A65 WeakPolarHBondContact O-CB 3.31Å; V62-A65 PolarHBondContact O-N 3.44Å; R63-A65 VanDerWaalsContact C-N 3.33Å; R63-A65 PolarHBondContact O-N 3.49Å
66	F	83.8	Confident	75.3	Confident	12 Å²	12	72 Å²	72	5%	0.053	40%	0.396	C	S	.	.	S	Bend	trans	-77.5	149.2	-178.2	-84.5	-133.6	0	0	0	112.9	A52 C54 M59 V62 R63 D64 K71 F73 C74	A52-F66 HydrophobicContact CB-CD1 3.9Å; A52-F66 HydrophobicContact CB-CD2 4.29Å; A52-F66 HydrophobicContact CB-CE1 3.85Å; A52-F66 HydrophobicContact CB-CE2 4.27Å; A52-F66 HydrophobicContact CB-CG 4.13Å; A52-F66 HydrophobicContact CB-CZ 4.05Å; A52-F66 WeakPolarHBondContact O-CZ 3.21Å; C54-F66 HydrophobicContact CB-CE1 4Å; M59-F66 WeakPolarHBondContact O-CZ 3.3Å; V62-F66 WeakPolarHBondContact O-CD2 3.22Å; R63-F66 WeakPolarHBondContact O-CB 3.36Å; R63-F66 PolarHBondContact O-N 3.21Å; D64-F66 PolarHBondContact O-N 2.98Å; F66-K71 HydrophobicContact CB-CB 4.02Å; F66-K71 HydrophobicContact CB-CD 4.01Å; F66-K71 VanDerWaalsContact CD1-O 3.24Å; F66-K71 WeakPolarHBondContact CD1-O 3.49Å; F66-K71 WeakPolarHBondContact O-CD 3.25Å; F66-K71 PolarHBondContact O-NZ 2.7Å; F66-F73 WeakPolarHBondContact CB-O 3.48Å; F66-F73 VanDerWaalsContact CD1-C 3.47Å; F66-F73 WeakPolarHBondContact CD1-O 3.46Å; F66-C74 HydrophobicContact CE1-CB 4.44Å; F66-C74 HydrophobicContact CZ-CB 4.42Å
67	Y	75.6	Confident	75.6	Confident	100 Å²	100	73 Å²	73	39%	0.392	41%	0.409	S	S	.	.	B	Isolated β-bridge	trans	-74.2	153	178.1	179.5	-101.6	0	0	0	112.1	F73 V76	Y67-F73 WeakPolarHBondContact CA-O 3.44Å; Y67-F73 WeakPolarHBondContact CB-O 3.34Å; Y67-F73 PolarHBondContact N-O 2.98Å; Y67-V76 HydrophobicContact CD2-CG2 4.06Å; Y67-V76 HydrophobicContact CE1-CB 4.37Å; Y67-V76 HydrophobicContact CE1-CG2 4.33Å; Y67-V76 HydrophobicContact CE2-CB 4.47Å; Y67-V76 HydrophobicContact CE2-CG2 3.58Å
68	S	66.1	Low	76.1	Confident	39 Å²	39	70.5 Å²	70.5	27%	0.273	39%	0.392	S	S	.	.	S	Bend	trans	67.4	158	-175.9	80.4	0	0	0	0	115.9	T70 K71	S68-T70 PolarHBondContact O-N 3.11Å; S68-T70 VanDerWaalsContact O-N 3.12Å; S68-T70 PolarHBondContact OG-OG1 3.41Å; S68-K71 WeakPolarHBondContact O-CD 3.19Å; S68-K71 PolarHBondContact O-N 2.86Å; S68-K71 VanDerWaalsContact O-N 3.13Å
69	K	70	Confident	77.3	Confident	216 Å²	216	69.4 Å²	69.4	94%	0.939	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-21.1	178.7	-71.1	-169.9	176.5	-174.3	0	114.1
70	T	77.1	Confident	78.2	Confident	95 Å²	95	73.2 Å²	73.2	58%	0.583	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-5.7	-179.7	54.9	0	0	0	0	113.7	S68 R72	S68-T70 PolarHBondContact O-N 3.11Å; S68-T70 VanDerWaalsContact O-N 3.12Å; S68-T70 PolarHBondContact OG-OG1 3.41Å; T70-R72 PolarHBondContact O-N 3.29Å; T70-R72 VanDerWaalsContact O-N 3.14Å
71	K	84.8	Confident	78.6	Confident	60 Å²	60	72 Å²	72	26%	0.261	38%	0.381	S	S	.	.			trans	55.4	27.4	177.1	-54.7	-59.1	-167	169.5	0	115.3	R63 D64 F66 S68	R63-K71 HydrophobicContact CG-CB 3.67Å; R63-K71 HydrophobicContact CG-CG 3.98Å; R63-K71 WeakPolarHBondContact O-CD 3.34Å; R63-K71 WeakPolarHBondContact O-CG 3.38Å; D64-K71 PolarHBondContact O-NZ 3.34Å; F66-K71 HydrophobicContact CB-CB 4.02Å; F66-K71 HydrophobicContact CB-CD 4.01Å; F66-K71 VanDerWaalsContact CD1-O 3.24Å; F66-K71 WeakPolarHBondContact CD1-O 3.49Å; F66-K71 WeakPolarHBondContact O-CD 3.25Å; F66-K71 PolarHBondContact O-NZ 2.7Å; S68-K71 WeakPolarHBondContact O-CD 3.19Å; S68-K71 PolarHBondContact O-N 2.86Å; S68-K71 VanDerWaalsContact O-N 3.13Å
72	R	84.8	Confident	78.5	Confident	96 Å²	96	74 Å²	74	36%	0.362	38%	0.381	S	S	.	.			trans	-87.4	-10.1	-178.3	-66.3	172	67	-171.2	-2.6	115	E55 T70 Y82	E55-R72 VanDerWaalsContact CD-NH2 3.31Å; E55-R72 PolarHBondContact N-O 2.83Å; E55-R72 VanDerWaalsContact N-O 3.12Å; E55-R72 IonicContact OE1-CZ 3.56Å; E55-R72 IonicContact OE1-NE 2.7Å; E55-R72 PolarHBondContact OE1-NE 3.39Å; E55-R72 IonicContact OE1-NH2 2.75Å; E55-R72 PolarHBondContact OE1-NH2 2.75Å; E55-R72 VanDerWaalsContact OE1-NH2 3.13Å; E55-R72 IonicContact OE2-CZ 3.39Å; E55-R72 IonicContact OE2-NE 2.77Å; E55-R72 IonicContact OE2-NH2 3.16Å; E55-R72 PolarHBondContact OE2-NH2 3.1Å; T70-R72 PolarHBondContact O-N 3.29Å; T70-R72 VanDerWaalsContact O-N 3.14Å; R72-Y82 PolarHBondContact NH2-OH 3.29Å
73	F	86.4	Confident	78	Confident	12 Å²	12	74.6 Å²	74.6	5%	0.053	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	-137.3	142.8	-173.9	-53.7	-67.7	0	0	0	111.3	E55 M56 F66 Y67 S75 C78 Y82	E55-F73 HydrophobicContact CB-CE1 4.04Å; M56-F73 HydrophobicContact CG-CE1 4.37Å; F66-F73 WeakPolarHBondContact CB-O 3.48Å; F66-F73 VanDerWaalsContact CD1-C 3.47Å; F66-F73 WeakPolarHBondContact CD1-O 3.46Å; Y67-F73 WeakPolarHBondContact CA-O 3.44Å; Y67-F73 WeakPolarHBondContact CB-O 3.34Å; Y67-F73 PolarHBondContact N-O 2.98Å; F73-S75 VanDerWaalsContact C-N 3.34Å; F73-C78 HydrophobicContact CB-CB 4.12Å; F73-C78 HydrophobicContact CD1-CB 4.32Å; F73-Y82 HydrophobicContact CE1-CD1 4.27Å; F73-Y82 AromaticContact CE1-CD2 3.59Å; F73-Y82 HydrophobicContact CE1-CD2 3.59Å; F73-Y82 HydrophobicContact CE1-CE2 4.28Å; F73-Y82 AromaticContact CE1-CG 3.54Å; F73-Y82 HydrophobicContact CE1-CG 3.54Å; F73-Y82 AromaticContact CZ-CD1 3.8Å; F73-Y82 HydrophobicContact CZ-CD1 3.8Å; F73-Y82 AromaticContact CZ-CD2 3.95Å; F73-Y82 HydrophobicContact CZ-CD2 3.95Å; F73-Y82 HydrophobicContact CZ-CE1 4.37Å; F73-Y82 HydrophobicContact CZ-CE2 4.48Å; F73-Y82 AromaticContact CZ-CG 3.53Å; F73-Y82 HydrophobicContact CZ-CG 3.53Å
74	C	82.3	Confident	77.4	Confident	32 Å²	32	72.4 Å²	72.4	22%	0.216	39%	0.391	C	S	.	.	S	Bend	trans	-77.8	-15.8	175.5	63.3	0	0	0	0	113.8	C54 M59 F66	C54-C74 HydrophobicContact CB-CB 4.13Å; C54-C74 PolarHBondContact SG-N 3.39Å; C54-C74 VanDerWaalsContact SG-N 3.35Å; M59-C74 HydrophobicContact CG-CB 4.35Å; M59-C74 HydrophobicContact SD-CB 3.58Å; M59-C74 VanDerWaalsContact SD-CB 3.58Å; F66-C74 HydrophobicContact CE1-CB 4.44Å; F66-C74 HydrophobicContact CZ-CB 4.42Å
75	S	85.3	Confident	76.3	Confident	39 Å²	39	72.5 Å²	72.5	27%	0.273	39%	0.392	S	S	.	.	S	Bend	trans	-154.4	164.1	-176.9	64.5	0	0	0	0	114.2	F73 S77 C78 S79	F73-S75 VanDerWaalsContact C-N 3.34Å; S75-S77 VanDerWaalsContact C-N 3.26Å; S75-S77 PolarHBondContact O-N 2.92Å; S75-C78 PolarHBondContact O-N 2.94Å; S75-C78 PolarHBondContact OG-N 2.98Å; S75-C78 PolarHBondContact OG-SG 3.28Å; S75-C78 VanDerWaalsContact OG-SG 3.36Å; S75-S79 PolarHBondContact O-N 3.37Å; S75-S79 VanDerWaalsContact O-N 3.07Å
76	V	80.1	Confident	75.5	Confident	63 Å²	63	71 Å²	71	38%	0.382	38%	0.376	S	S	.	.	H	α-helix	trans	-52.6	-45.9	171	-170.6	0	0	0	0	110.9	Y67 S79 R80	Y67-V76 HydrophobicContact CD2-CG2 4.06Å; Y67-V76 HydrophobicContact CE1-CB 4.37Å; Y67-V76 HydrophobicContact CE1-CG2 4.33Å; Y67-V76 HydrophobicContact CE2-CB 4.47Å; Y67-V76 HydrophobicContact CE2-CG2 3.58Å; V76-S79 WeakPolarHBondContact O-CB 3.27Å; V76-S79 PolarHBondContact O-N 3.14Å; V76-R80 WeakPolarHBondContact O-CG 3.24Å; V76-R80 PolarHBondContact O-N 2.83Å
77	S	79.8	Confident	73.7	Confident	84 Å²	84	77.9 Å²	77.9	59%	0.587	41%	0.406	S	S	*	.	H	α-helix	trans	-63.3	-43.4	-177.7	-49.3	0	0	0	0	111.6	S75 R80 S81	S75-S77 VanDerWaalsContact C-N 3.26Å; S75-S77 PolarHBondContact O-N 2.92Å; S77-R80 PolarHBondContact O-N 3.16Å; S77-S81 WeakPolarHBondContact O-CB 3.49Å; S77-S81 PolarHBondContact O-N 2.91Å; S77-S81 PolarHBondContact O-OG 3.41Å; S77-S81 VanDerWaalsContact O-OG 3.13Å
78	C	78.3	Confident	72.2	Confident	17 Å²	17	80.7 Å²	80.7	12%	0.115	42%	0.42	C	S	.	.	H	α-helix	trans	-62.5	-44.3	174.4	-71.8	0	0	0	0	111.9	M56 F73 S75 R80 S81 Y82	M56-C78 HydrophobicContact CB-CB 4.11Å; M56-C78 VanDerWaalsContact CG-O 3.29Å; M56-C78 WeakPolarHBondContact CG-O 3.45Å; F73-C78 HydrophobicContact CB-CB 4.12Å; F73-C78 HydrophobicContact CD1-CB 4.32Å; S75-C78 PolarHBondContact O-N 2.94Å; S75-C78 PolarHBondContact OG-N 2.98Å; S75-C78 PolarHBondContact OG-SG 3.28Å; S75-C78 VanDerWaalsContact OG-SG 3.36Å; C78-R80 PolarHBondContact O-N 2.84Å; C78-S81 PolarHBondContact O-N 3.35Å; C78-Y82 PolarHBondContact O-N 3Å
79	S	84.3	Confident	71.1	Confident	26 Å²	26	81.4 Å²	81.4	18%	0.182	43%	0.428	C	S	.	.	H	α-helix	trans	-59.2	-44.1	177	-175.7	0	0	0	0	112.2	S75 V76 Y82 S83	S75-S79 PolarHBondContact O-N 3.37Å; S75-S79 VanDerWaalsContact O-N 3.07Å; V76-S79 WeakPolarHBondContact O-CB 3.27Å; V76-S79 PolarHBondContact O-N 3.14Å; S79-Y82 PolarHBondContact O-N 3.13Å; S79-S83 PolarHBondContact O-N 2.69Å; S79-S83 PolarHBondContact O-OG 3.02Å
80	R	78.2	Confident	69.8	Low	191 Å²	191	74.1 Å²	74.1	72%	0.721	41%	0.405	S	S	*	.	H	α-helix	trans	-66.2	-43.1	176.4	-71.3	-177	176.7	-157.8	-0.8	112.8	V76 S77 C78 Y82 S83 S84	V76-R80 WeakPolarHBondContact O-CG 3.24Å; V76-R80 PolarHBondContact O-N 2.83Å; S77-R80 PolarHBondContact O-N 3.16Å; C78-R80 PolarHBondContact O-N 2.84Å; R80-Y82 VanDerWaalsContact C-N 3.32Å; R80-Y82 PolarHBondContact O-N 3.25Å; R80-S83 PolarHBondContact O-N 2.99Å; R80-S84 PolarHBondContact O-N 3.01Å
81	S	70.8	Confident	68.3	Low	57 Å²	57	75.2 Å²	75.2	40%	0.399	41%	0.406	S	S	.	.	H	α-helix	trans	-68	-28.3	179	-62.9	0	0	0	0	113.5	S77 C78 S84 N85	S77-S81 WeakPolarHBondContact O-CB 3.49Å; S77-S81 PolarHBondContact O-N 2.91Å; S77-S81 PolarHBondContact O-OG 3.41Å; S77-S81 VanDerWaalsContact O-OG 3.13Å; C78-S81 PolarHBondContact O-N 3.35Å; S81-S84 PolarHBondContact O-OG 3.35Å; S81-N85 WeakPolarHBondContact O-CB 3.2Å; S81-N85 PolarHBondContact O-N 2.85Å
82	Y	74.1	Confident	66.3	Low	66 Å²	66	77.4 Å²	77.4	26%	0.259	42%	0.42	S	S	.	.	H	α-helix	trans	-66.9	-42.4	171.3	-165.2	-89.8	0	0	0	111.7	E55 M56 R72 F73 C78 S79 R80 S84 N85 S86	E55-Y82 HydrophobicContact CB-CD2 4.11Å; E55-Y82 HydrophobicContact CB-CE2 3.69Å; E55-Y82 WeakPolarHBondContact OE2-CE2 3.37Å; E55-Y82 PolarHBondContact OE2-OH 3.41Å; M56-Y82 HydrophobicContact CG-CD2 3.83Å; M56-Y82 HydrophobicContact CG-CG 4.22Å; M56-Y82 VanDerWaalsContact SD-CA 3.51Å; M56-Y82 HydrophobicContact SD-CD2 3.71Å; M56-Y82 HydrophobicContact SD-CG 4.2Å; R72-Y82 PolarHBondContact NH2-OH 3.29Å; F73-Y82 HydrophobicContact CE1-CD1 4.27Å; F73-Y82 AromaticContact CE1-CD2 3.59Å; F73-Y82 HydrophobicContact CE1-CD2 3.59Å; F73-Y82 HydrophobicContact CE1-CE2 4.28Å; F73-Y82 AromaticContact CE1-CG 3.54Å; F73-Y82 HydrophobicContact CE1-CG 3.54Å; F73-Y82 AromaticContact CZ-CD1 3.8Å; F73-Y82 HydrophobicContact CZ-CD1 3.8Å; F73-Y82 AromaticContact CZ-CD2 3.95Å; F73-Y82 HydrophobicContact CZ-CD2 3.95Å; F73-Y82 HydrophobicContact CZ-CE1 4.37Å; F73-Y82 HydrophobicContact CZ-CE2 4.48Å; F73-Y82 AromaticContact CZ-CG 3.53Å; F73-Y82 HydrophobicContact CZ-CG 3.53Å; C78-Y82 PolarHBondContact O-N 3Å; S79-Y82 PolarHBondContact O-N 3.13Å; R80-Y82 VanDerWaalsContact C-N 3.32Å; R80-Y82 PolarHBondContact O-N 3.25Å; Y82-S84 VanDerWaalsContact C-N 3.27Å; Y82-S84 PolarHBondContact O-N 3.04Å; Y82-N85 PolarHBondContact O-N 3.06Å; Y82-S86 WeakPolarHBondContact O-CB 3.24Å; Y82-S86 PolarHBondContact O-N 2.7Å; Y82-S86 PolarHBondContact O-OG 3.3Å
83	S	68.7	Low	64.3	Low	68 Å²	68	76.4 Å²	76.4	48%	0.476	43%	0.432	S	S	.	.	H	α-helix	trans	-67.8	-21.8	-178.3	-57.4	0	0	0	0	114.4	S79 R80	S79-S83 PolarHBondContact O-N 2.69Å; S79-S83 PolarHBondContact O-OG 3.02Å; R80-S83 PolarHBondContact O-N 2.99Å
84	S	62.8	Low	62.3	Low	79 Å²	79	86.2 Å²	86.2	55%	0.552	47%	0.469	S	S	*	.	H	α-helix	trans	-85.7	-40.9	170.3	55.7	0	0	0	0	112.1	R80 S81 Y82	R80-S84 PolarHBondContact O-N 3.01Å; S81-S84 PolarHBondContact O-OG 3.35Å; Y82-S84 VanDerWaalsContact C-N 3.27Å; Y82-S84 PolarHBondContact O-N 3.04Å
85	N	54.5	Low	60.3	Low	89 Å²	89	91.2 Å²	91.2	48%	0.476	49%	0.493	S	S	.	.	H	α-helix	trans	-73.1	-34.6	-176.3	-154.4	21.3	0	0	0	113.1	S81 Y82 K87 K88 A89	S81-N85 WeakPolarHBondContact O-CB 3.2Å; S81-N85 PolarHBondContact O-N 2.85Å; Y82-N85 PolarHBondContact O-N 3.06Å; N85-K87 VanDerWaalsContact C-N 3.25Å; N85-K87 PolarHBondContact O-N 2.87Å; N85-K88 WeakPolarHBondContact O-CB 3.45Å; N85-K88 PolarHBondContact O-N 3.04Å; N85-A89 PolarHBondContact O-N 2.86Å; N85-A89 VanDerWaalsContact O-N 3.13Å
86	S	56.9	Low	58.4	Low	49 Å²	49	96.8 Å²	96.8	34%	0.343	51%	0.514	S	S	.	.	H	α-helix	trans	-60.8	-31.4	178.4	64.3	0	0	0	0	113.5	Y82 K88 A89 S90	Y82-S86 WeakPolarHBondContact O-CB 3.24Å; Y82-S86 PolarHBondContact O-N 2.7Å; Y82-S86 PolarHBondContact O-OG 3.3Å; S86-K88 VanDerWaalsContact C-N 3.29Å; S86-K88 PolarHBondContact O-N 2.77Å; S86-A89 PolarHBondContact O-N 2.77Å; S86-S90 WeakPolarHBondContact O-CB 3.32Å; S86-S90 PolarHBondContact O-N 2.8Å
87	K	46.3	Very low	56.6	Low	157 Å²	157	97.3 Å²	97.3	68%	0.683	53%	0.533	S	S	*	.	H	α-helix	trans	-64.1	-32	173.8	-66	-175.9	179.4	-176.7	0	112.6	N85	N85-K87 VanDerWaalsContact C-N 3.25Å; N85-K87 PolarHBondContact O-N 2.87Å
88	K	45	Very low	54.3	Low	159 Å²	159	102.9 Å²	102.9	69%	0.691	55%	0.546	S	S	*	.	H	α-helix	trans	-73.1	-48.5	173.4	-117	-179.6	178	-177.1	0	111	N85 S86 S90 I91	N85-K88 WeakPolarHBondContact O-CB 3.45Å; N85-K88 PolarHBondContact O-N 3.04Å; S86-K88 VanDerWaalsContact C-N 3.29Å; S86-K88 PolarHBondContact O-N 2.77Å; K88-S90 VanDerWaalsContact C-N 3.35Å; K88-S90 PolarHBondContact O-N 3.23Å; K88-I91 PolarHBondContact O-N 3.03Å
89	A	42.8	Very low	52	Low	54 Å²	54	107.8 Å²	107.8	45%	0.446	58%	0.578	S	S	.	*	H	α-helix	trans	-62.5	-37.7	-179.7	0	0	0	0	0	113.2	N85 S86 I91 L92 A93	N85-A89 PolarHBondContact O-N 2.86Å; N85-A89 VanDerWaalsContact O-N 3.13Å; S86-A89 PolarHBondContact O-N 2.77Å; A89-I91 PolarHBondContact O-N 3.3Å; A89-L92 PolarHBondContact O-N 3.09Å; A89-A93 WeakPolarHBondContact O-CB 3.49Å; A89-A93 PolarHBondContact O-N 2.86Å
90	S	41.8	Very low	49.5	Very low	64 Å²	64	112.7 Å²	112.7	45%	0.448	61%	0.609	S	S	.	*	H	α-helix	trans	-63.9	-19.7	-180	-175.8	0	0	0	0	114.4	S86 K88	S86-S90 WeakPolarHBondContact O-CB 3.32Å; S86-S90 PolarHBondContact O-N 2.8Å; K88-S90 VanDerWaalsContact C-N 3.35Å; K88-S90 PolarHBondContact O-N 3.23Å
91	I	46.9	Very low	47.3	Very low	117 Å²	117	110.5 Å²	110.5	60%	0.6	62%	0.617	S	S	*	*	H	α-helix	trans	-81.2	-46.9	176.6	-63.7	170	0	0	0	109.4	K88 A89 R94	K88-I91 PolarHBondContact O-N 3.03Å; A89-I91 PolarHBondContact O-N 3.3Å; I91-R94 PolarHBondContact O-N 2.85Å
92	L	42.1	Very low	45.3	Very low	107 Å²	107	117.3 Å²	117.3	56%	0.56	64%	0.639	S	S	*	*	H	α-helix	trans	-63.2	-42.7	178	-74.6	161.7	0	0	0	112.4	A89 R94 L95	A89-L92 PolarHBondContact O-N 3.09Å; L92-R94 PolarHBondContact O-N 3.01Å; L92-R94 VanDerWaalsContact O-N 3.15Å; L92-L95 PolarHBondContact O-N 3.09Å
93	A	43.4	Very low	43	Very low	74 Å²	74	124.3 Å²	124.3	61%	0.612	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-24	-178.1	0	0	0	0	0	114.1	A89 L95	A89-A93 WeakPolarHBondContact O-CB 3.49Å; A89-A93 PolarHBondContact O-N 2.86Å; A93-L95 VanDerWaalsContact C-N 3.31Å
94	R	43.8	Very low	41	Very low	218 Å²	218	126 Å²	126	82%	0.823	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-12.7	176.1	-75.7	-176.8	174.5	-176	-1.4	113.9	I91 L92	I91-R94 PolarHBondContact O-N 2.85Å; L92-R94 PolarHBondContact O-N 3.01Å; L92-R94 VanDerWaalsContact O-N 3.15Å
95	L	41.5	Very low	39.2	Very low	137 Å²	137	132 Å²	132	72%	0.717	71%	0.706	S	S	*	*	S	Bend	trans	-97.8	-10.8	-174.9	-67.3	168.6	0	0	0	114.2	L92 A93	L92-L95 PolarHBondContact O-N 3.09Å; A93-L95 VanDerWaalsContact C-N 3.31Å
96	Q	44.8	Very low	37.8	Very low	157 Å²	157	134.5 Å²	134.5	73%	0.734	72%	0.723	S	S	*	*			trans	-133.6	30.2	-163.9	-62.2	-173.8	-18.5	0	0	114.5	K98	Q96-K98 PolarHBondContact O-N 3.3Å; Q96-K98 VanDerWaalsContact O-N 3.15Å
97	G	41.9	Very low	36.3	Very low	74 Å²	74	139.8 Å²	139.8	76%	0.763	75%	0.747	S	S	*	*			trans	-62.8	112.5	-171.6	0	0	0	0	0	115.3
98	K	31	Very low	35.5	Very low	201 Å²	201	141.5 Å²	141.5	87%	0.874	76%	0.758	S	S	*	*			trans	-154.7	137	164.2	-103.9	165.8	-175.6	175.3	0	110.9	Q96	Q96-K98 PolarHBondContact O-N 3.3Å; Q96-K98 VanDerWaalsContact O-N 3.15Å
99	P	30.7	Very low	35	Very low	120 Å²	120	141 Å²	141	78%	0.779	76%	0.756	S	S	*	*			trans	-94.8	162	179.9	36.9	-35	0	0	0	113.8
100	P	31	Very low	34.5	Very low	128 Å²	128	146.4 Å²	146.4	83%	0.831	77%	0.771	S	S	*	*			trans	-97.8	157.7	-176.9	37.6	-35.3	0	0	0	114.8
101	T	31.9	Very low	34.4	Very low	145 Å²	145	148.2 Å²	148.2	89%	0.89	78%	0.782	S	S	*	*			trans	-125.1	145.8	173.5	49.2	0	0	0	0	112.3
102	K	29.2	Very low	34	Very low	201 Å²	201	148.6 Å²	148.6	87%	0.874	78%	0.784	S	S	*	*			trans	-107.8	141.6	-174.1	-61.8	178	177.6	-177.9	0	113
103	K	26.2	Very low	33.8	Very low	212 Å²	212	149.2 Å²	149.2	92%	0.922	79%	0.792	S	S	*	*				154.7	135.8	127.3	-85.6	166.8	-178.6	-179.4	0	111.3
104	A	25.7	Very low	33.7	Very low	104 Å²	104	148.3 Å²	148.3	86%	0.86	79%	0.785	S	S	*	*			trans	-117.9	163.8	167.3	0	0	0	0	0	110.1
105	K	25	Very low	33.7	Very low	206 Å²	206	142 Å²	142	90%	0.896	76%	0.763	S	S	*	*			trans	-116.2	144.8	172.7	-85.3	-175.6	172.2	-177.8	0	109.9
106	V	25.3	Very low	33.6	Very low	140 Å²	140	141.2 Å²	141.2	85%	0.848	76%	0.759	S	S	*	*			trans	-81.3	141.8	174.1	180	0	0	0	0	110
107	L	26.5	Very low	33.7	Very low	160 Å²	160	136.3 Å²	136.3	84%	0.838	75%	0.745	S	S	*	*			trans	-119.1	144.4	167.3	-131.8	82.5	0	0	0	108.8
108	Q	29.9	Very low	33.9	Very low	194 Å²	194	135.3 Å²	135.3	91%	0.907	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-87.4	138.7	177.4	-70.7	-176.6	-38.6	0	0	111.4
109	K	34	Very low	34.5	Very low	149 Å²	149	128.8 Å²	128.8	65%	0.648	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-97.1	155.1	178.9	-69.3	-177.3	176.9	-173.5	0	112	E532	K109-E532 WeakPolarHBondContact CE-OE1 3.44Å; K109-E532 IonicContact NZ-OE1 2.66Å; K109-E532 PolarHBondContact NZ-OE1 3.4Å
110	Q	32.9	Very low	35.3	Very low	167 Å²	167	125.6 Å²	125.6	78%	0.78	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-92.8	163.7	-179.8	-69.6	-170.3	20.3	0	0	113.1
111	P	39.4	Very low	36.1	Very low	102 Å²	102	126.3 Å²	126.3	66%	0.662	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-67.7	149.9	-171.6	-22.3	35.2	0	0	0	116	V113 A114	P111-V113 VanDerWaalsContact C-N 3.3Å; P111-V113 PolarHBondContact O-N 3.47Å; P111-V113 VanDerWaalsContact O-N 3.15Å; P111-A114 PolarHBondContact O-N 2.84Å
112	L	37.5	Very low	37	Very low	125 Å²	125	123.8 Å²	123.8	65%	0.654	65%	0.651	S	S	*	*	H	α-helix	trans	-52.7	-36.7	-173.1	-171.8	66	0	0	0	115.2	A114 K115	L112-A114 PolarHBondContact O-N 3.29Å; L112-K115 HydrophobicContact CD1-CD 4.49Å; L112-K115 WeakPolarHBondContact O-CB 3.43Å; L112-K115 PolarHBondContact O-N 3.37Å
113	V	38.2	Very low	37.9	Very low	119 Å²	119	118.3 Å²	118.3	72%	0.721	63%	0.629	S	S	*	*	H	α-helix	trans	-60.9	-32.7	-175.9	-175.5	0	0	0	0	112.3	P111 K115 A117	P111-V113 VanDerWaalsContact C-N 3.3Å; P111-V113 PolarHBondContact O-N 3.47Å; P111-V113 VanDerWaalsContact O-N 3.15Å; V113-K115 VanDerWaalsContact C-N 3.32Å; V113-K115 PolarHBondContact O-N 2.99Å; V113-A117 PolarHBondContact O-N 2.7Å
114	A	41.1	Very low	38.9	Very low	55 Å²	55	110.6 Å²	110.6	46%	0.455	60%	0.604	S	S	.	*	H	α-helix	trans	-68.6	-29.7	177.6	0	0	0	0	0	112.9	P111 L112 A118	P111-A114 PolarHBondContact O-N 2.84Å; L112-A114 PolarHBondContact O-N 3.29Å; A114-A118 PolarHBondContact O-N 3.02Å
115	K	43	Very low	40	Very low	87 Å²	87	109.7 Å²	109.7	38%	0.378	59%	0.588	S	S	.	*	H	α-helix	trans	-67.2	-45.9	179.1	-65.6	-170.2	166.4	-163.4	0	111.8	L112 V113 A117 A118 Y119	L112-K115 HydrophobicContact CD1-CD 4.49Å; L112-K115 WeakPolarHBondContact O-CB 3.43Å; L112-K115 PolarHBondContact O-N 3.37Å; V113-K115 VanDerWaalsContact C-N 3.32Å; V113-K115 PolarHBondContact O-N 2.99Å; K115-A117 VanDerWaalsContact C-N 3.3Å; K115-A117 PolarHBondContact O-N 3.46Å; K115-A118 PolarHBondContact O-N 3.21Å; K115-Y119 PolarHBondContact O-N 3.06Å
116	L	41.3	Very low	41.2	Very low	119 Å²	119	104.3 Å²	104.3	62%	0.623	57%	0.569	S	S	*	*	H	α-helix	trans	-60.6	-40.1	178.6	-66.8	169.6	0	0	0	111.7	Y119 A120	L116-Y119 PolarHBondContact O-N 3.16Å; L116-A120 PolarHBondContact O-N 2.95Å
117	A	45.7	Very low	42.1	Very low	54 Å²	54	104.9 Å²	104.9	45%	0.446	56%	0.562	S	S	.	*	H	α-helix	trans	-66.2	-41.4	177.1	0	0	0	0	0	113	V113 K115 Q121	V113-A117 PolarHBondContact O-N 2.7Å; K115-A117 VanDerWaalsContact C-N 3.3Å; K115-A117 PolarHBondContact O-N 3.46Å; A117-Q121 WeakPolarHBondContact O-CG 3.31Å; A117-Q121 PolarHBondContact O-N 3.1Å
118	A	45.7	Very low	42.8	Very low	54 Å²	54	102.9 Å²	102.9	45%	0.446	55%	0.552	S	S	.	*	H	α-helix	trans	-65.3	-41	176.2	0	0	0	0	0	112.1	A114 K115 Q121 Y122	A114-A118 PolarHBondContact O-N 3.02Å; K115-A118 PolarHBondContact O-N 3.21Å; A118-Q121 PolarHBondContact O-N 3.35Å; A118-Y122 PolarHBondContact O-N 2.94Å
119	Y	45	Very low	43.5	Very low	64 Å²	64	100.6 Å²	100.6	25%	0.251	54%	0.542	S	S	.	.	H	α-helix	trans	-63.4	-42.9	176.9	-171.3	-106.3	0	0	0	112.2	K115 L116 Q121 Y122 Q123 Y533	K115-Y119 PolarHBondContact O-N 3.06Å; L116-Y119 PolarHBondContact O-N 3.16Å; Y119-Q121 VanDerWaalsContact C-N 3.33Å; Y119-Q121 PolarHBondContact O-N 3.35Å; Y119-Y122 WeakPolarHBondContact O-CB 3.47Å; Y119-Y122 PolarHBondContact O-N 3.33Å; Y119-Y122 VanDerWaalsContact O-N 3.17Å; Y119-Q123 HydrophobicContact CD1-CG 4.49Å; Y119-Q123 HydrophobicContact CE1-CG 4.35Å; Y119-Q123 PolarHBondContact O-N 3.19Å; Y119-Y533 HydrophobicContact CD2-CE1 4.47Å
120	A	46.7	Very low	43.8	Very low	52 Å²	52	97.8 Å²	97.8	43%	0.43	55%	0.546	S	S	.	.	H	α-helix	trans	-61.9	-36.5	175.4	0	0	0	0	0	113.2	L116 Y122 Q123 A124	L116-A120 PolarHBondContact O-N 2.95Å; A120-Y122 VanDerWaalsContact C-N 3.35Å; A120-Q123 PolarHBondContact O-N 3.13Å; A120-A124 PolarHBondContact O-N 3.13Å; A120-A124 VanDerWaalsContact O-N 3.1Å
121	Q	47.6	Very low	44	Very low	143 Å²	143	98.6 Å²	98.6	67%	0.668	55%	0.547	S	S	*	.	H	α-helix	trans	-66.3	-36.1	175.1	-71.5	176.7	-3.5	0	0	112.3	A117 A118 Y119 T125	A117-Q121 WeakPolarHBondContact O-CG 3.31Å; A117-Q121 PolarHBondContact O-N 3.1Å; A118-Q121 PolarHBondContact O-N 3.35Å; Y119-Q121 VanDerWaalsContact C-N 3.33Å; Y119-Q121 PolarHBondContact O-N 3.35Å; Q121-T125 PolarHBondContact O-N 2.97Å; Q121-T125 PolarHBondContact O-OG1 2.83Å
122	Y	50.9	Low	43.7	Very low	93 Å²	93	99 Å²	99	37%	0.365	55%	0.548	S	S	.	.	H	α-helix	trans	-65.8	-45.6	173	-177.7	-97.4	0	0	0	112	A118 Y119 A120 A124 T125 L126 W529	A118-Y122 PolarHBondContact O-N 2.94Å; Y119-Y122 WeakPolarHBondContact O-CB 3.47Å; Y119-Y122 PolarHBondContact O-N 3.33Å; Y119-Y122 VanDerWaalsContact O-N 3.17Å; A120-Y122 VanDerWaalsContact C-N 3.35Å; Y122-A124 VanDerWaalsContact C-N 3.34Å; Y122-A124 PolarHBondContact O-N 3.29Å; Y122-T125 WeakPolarHBondContact O-CA 3.44Å; Y122-T125 WeakPolarHBondContact O-CB 3.44Å; Y122-T125 PolarHBondContact O-N 2.81Å; Y122-L126 HydrophobicContact CD1-CD1 4.12Å; Y122-L126 HydrophobicContact CE1-CD1 3.46Å; Y122-L126 VanDerWaalsContact CE1-CD1 3.46Å; Y122-L126 HydrophobicContact CE1-CG 4.07Å; Y122-L126 PolarHBondContact O-N 3.2Å; Y122-W529 HydrophobicContact CD1-CH2 4.03Å; Y122-W529 AromaticContact CE1-CH2 3.55Å; Y122-W529 HydrophobicContact CE1-CH2 3.55Å; Y122-W529 HydrophobicContact CE1-CZ2 4.18Å; Y122-W529 HydrophobicContact CE2-CH2 4.49Å; Y122-W529 AromaticContact CZ-CH2 3.81Å
123	Q	49.3	Very low	43.7	Very low	86 Å²	86	103.1 Å²	103.1	40%	0.402	56%	0.56	S	S	.	*	H	α-helix	trans	-57.5	-43.4	176.3	-70.7	-173.9	-18.2	0	0	112.7	Y119 A120 T125 L126 Q127	Y119-Q123 HydrophobicContact CD1-CG 4.49Å; Y119-Q123 HydrophobicContact CE1-CG 4.35Å; Y119-Q123 PolarHBondContact O-N 3.19Å; A120-Q123 PolarHBondContact O-N 3.13Å; Q123-T125 PolarHBondContact O-N 3.25Å; Q123-L126 PolarHBondContact O-N 3.2Å; Q123-Q127 PolarHBondContact O-N 2.96Å
124	A	45.4	Very low	43.5	Very low	50 Å²	50	102 Å²	102	41%	0.413	56%	0.564	S	S	.	*	H	α-helix	trans	-62.6	-26.2	175.8	0	0	0	0	0	113.1	A120 Y122 N128	A120-A124 PolarHBondContact O-N 3.13Å; A120-A124 VanDerWaalsContact O-N 3.1Å; Y122-A124 VanDerWaalsContact C-N 3.34Å; Y122-A124 PolarHBondContact O-N 3.29Å; A124-N128 PolarHBondContact O-ND2 2.71Å
125	T	49.7	Very low	43.3	Very low	85 Å²	85	104.7 Å²	104.7	52%	0.521	59%	0.586	S	S	.	*	H	α-helix	trans	-75.6	-40	177.1	-54.3	0	0	0	0	111.5	Q121 Y122 Q123	Q121-T125 PolarHBondContact O-N 2.97Å; Q121-T125 PolarHBondContact O-OG1 2.83Å; Y122-T125 WeakPolarHBondContact O-CA 3.44Å; Y122-T125 WeakPolarHBondContact O-CB 3.44Å; Y122-T125 PolarHBondContact O-N 2.81Å; Q123-T125 PolarHBondContact O-N 3.25Å
126	L	49.5	Very low	42.7	Very low	93 Å²	93	106.2 Å²	106.2	49%	0.487	60%	0.602	S	S	.	*	H	α-helix	trans	-67.3	-44.4	177.3	-72.3	176.6	0	0	0	112.9	Y122 Q123 N128 Q129	Y122-L126 HydrophobicContact CD1-CD1 4.12Å; Y122-L126 HydrophobicContact CE1-CD1 3.46Å; Y122-L126 VanDerWaalsContact CE1-CD1 3.46Å; Y122-L126 HydrophobicContact CE1-CG 4.07Å; Y122-L126 PolarHBondContact O-N 3.2Å; Q123-L126 PolarHBondContact O-N 3.2Å; L126-N128 PolarHBondContact O-N 2.91Å; L126-Q129 PolarHBondContact O-N 3.16Å
127	Q	43.9	Very low	42.3	Very low	151 Å²	151	106.3 Å²	106.3	71%	0.706	61%	0.61	S	S	*	*	H	α-helix	trans	-61.8	-29.3	-178.9	-74.4	-169.5	-7.6	0	0	113.6	Q123	Q123-Q127 PolarHBondContact O-N 2.96Å
128	N	41.6	Very low	42.1	Very low	119 Å²	119	110 Å²	110	64%	0.636	63%	0.627	S	S	*	*	H	α-helix	trans	-74.8	-27.3	-179.6	-83	-63.9	0	0	0	113.5	A124 L126 A130	A124-N128 PolarHBondContact O-ND2 2.71Å; L126-N128 PolarHBondContact O-N 2.91Å; N128-A130 VanDerWaalsContact C-N 3.25Å; N128-A130 PolarHBondContact O-N 2.89Å
129	Q	44.4	Very low	42.5	Very low	146 Å²	146	116.3 Å²	116.3	68%	0.682	65%	0.647	S	S	*	*	H	α-helix	trans	-69.1	-23.7	177.2	-66.7	-172.8	-1.1	0	0	112.8	L126 K131	L126-Q129 PolarHBondContact O-N 3.16Å; Q129-K131 PolarHBondContact O-N 2.87Å; Q129-K131 VanDerWaalsContact O-N 3.13Å
130	A	40	Very low	44	Very low	89 Å²	89	116.2 Å²	116.2	74%	0.736	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-3.5	-177.8	0	0	0	0	0	115.2	N128	N128-A130 VanDerWaalsContact C-N 3.25Å; N128-A130 PolarHBondContact O-N 2.89Å
131	K	37.2	Very low	46.2	Very low	184 Å²	184	117 Å²	117	80%	0.8	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	2.7	-170.8	-75	-176.7	175.6	175.6	0	116.4	Q129	Q129-K131 PolarHBondContact O-N 2.87Å; Q129-K131 VanDerWaalsContact O-N 3.13Å
132	T	35.1	Very low	48.4	Very low	112 Å²	112	112.4 Å²	112.4	69%	0.687	64%	0.643	S	S	*	*	S	Bend	trans	-129.7	86	-175.1	53.7	0	0	0	0	115.6
133	K	36.6	Very low	50.5	Low	210 Å²	210	108.5 Å²	108.5	91%	0.913	63%	0.628	S	S	*	*			trans	54.7	141	147.6	-68.4	-173.4	175.8	-179.3	0	121.8
134	A	33.2	Very low	52.7	Low	97 Å²	97	104.6 Å²	104.6	80%	0.802	61%	0.611	S	S	*	*			trans	67.8	108.7	156.6	0	0	0	0	0	117.3	V136	A134-V136 PolarHBondContact O-N 3Å; A134-V136 VanDerWaalsContact O-N 3.13Å
135	A	38.3	Very low	55	Low	110 Å²	110	107.3 Å²	107.3	91%	0.909	62%	0.618	S	S	*	*			trans	-75.4	98.9	175.2	0	0	0	0	0	111.7
136	V	29.9	Very low	57.2	Low	119 Å²	119	105.7 Å²	105.7	72%	0.721	60%	0.603	S	S	*	*			trans	-89.8	130.9	147.6	-179.1	0	0	0	0	106.3	A134 V138	A134-V136 PolarHBondContact O-N 3Å; A134-V136 VanDerWaalsContact O-N 3.13Å; V136-V138 PolarHBondContact O-N 2.81Å
137	P	33.7	Very low	59.4	Low	121 Å²	121	101.3 Å²	101.3	79%	0.786	58%	0.58	S	S	*	*			trans	-70	98.2	178	28.3	-33.3	0	0	0	109.9	E139	P137-E139 PolarHBondContact O-N 2.97Å
138	V	40	Very low	61.7	Low	133 Å²	133	97.6 Å²	97.6	81%	0.806	57%	0.565	S	S	*	*			trans	-61.5	129.9	161	-179.4	0	0	0	0	107.1	V136 G140	V136-V138 PolarHBondContact O-N 2.81Å; V138-G140 PolarHBondContact O-N 3.05Å
139	E	54.9	Low	64	Low	186 Å²	186	96.3 Å²	96.3	87%	0.869	57%	0.565	S	S	*	*			trans	-61.6	108.3	175.3	-68	-168.3	147.7	0	0	109.5	P137	P137-E139 PolarHBondContact O-N 2.97Å
140	G	76.9	Confident	66.2	Low	62 Å²	62	93.1 Å²	93.1	64%	0.639	55%	0.553	S	S	*	*			trans	-64	154.7	178.1	0	0	0	0	0	111.7	V138 S142	V138-G140 PolarHBondContact O-N 3.05Å; G140-S142 PolarHBondContact O-N 2.86Å
141	F	91.7	Very high	68.8	Low	67 Å²	67	93.6 Å²	93.6	29%	0.294	55%	0.551	S	S	.	*			trans	-55.7	125.1	178.6	169.8	-91	0	0	0	111.5	W143 Y146 V511 L557 P559 P560	F141-W143 HydrophobicContact CE1-CB 4.4Å; F141-W143 AromaticContact CE1-CD1 3.96Å; F141-W143 AromaticContact CE1-CD2 3.72Å; F141-W143 HydrophobicContact CE1-CD2 3.72Å; F141-W143 AromaticContact CE1-CE2 3.95Å; F141-W143 HydrophobicContact CE1-CE3 4.23Å; F141-W143 AromaticContact CE1-CG 3.76Å; F141-W143 HydrophobicContact CE1-CG 3.76Å; F141-W143 AromaticContact CZ-CD2 3.83Å; F141-W143 HydrophobicContact CZ-CD2 3.83Å; F141-W143 AromaticContact CZ-CE3 3.85Å; F141-W143 HydrophobicContact CZ-CE3 3.85Å; F141-W143 HydrophobicContact CZ-CG 4.22Å; F141-W143 HydrophobicContact CZ-CZ3 4.33Å; F141-Y146 AromaticContact CE2-CD1 3.87Å; F141-Y146 HydrophobicContact CE2-CD1 3.87Å; F141-Y146 HydrophobicContact CE2-CD2 4.05Å; F141-Y146 AromaticContact CE2-CG 3.61Å; F141-Y146 HydrophobicContact CE2-CG 3.61Å; F141-Y146 AromaticContact CZ-CD1 3.87Å; F141-Y146 HydrophobicContact CZ-CD1 3.87Å; F141-Y146 AromaticContact CZ-CG 3.99Å; F141-Y146 HydrophobicContact CZ-CG 3.99Å; F141-V511 HydrophobicContact CD1-CG2 4.12Å; F141-V511 HydrophobicContact CE1-CG2 3.47Å; F141-V511 VanDerWaalsContact CE1-CG2 3.47Å; F141-V511 HydrophobicContact CE2-CG2 4.19Å; F141-V511 HydrophobicContact CZ-CB 4.43Å; F141-V511 HydrophobicContact CZ-CG1 4.08Å; F141-V511 HydrophobicContact CZ-CG2 3.51Å; F141-L557 HydrophobicContact CD1-CD2 3.96Å; F141-L557 HydrophobicContact CE1-CD2 3.83Å; F141-P559 HydrophobicContact CB-CB 3.74Å; F141-P559 HydrophobicContact CD2-CB 4.39Å; F141-P559 HydrophobicContact CG-CB 4.14Å; F141-P560 VanDerWaalsContact CD2-CD 3.44Å; F141-P560 HydrophobicContact CD2-CG 4.23Å; F141-P560 VanDerWaalsContact CE2-CD 3.48Å; F141-P560 HydrophobicContact CE2-CG 3.84Å
142	S	93.8	Very high	71.6	Confident	47 Å²	47	87.3 Å²	87.3	33%	0.329	52%	0.524	S	S	.	.			trans	-116.2	114.2	176.9	171.3	0	0	0	0	109.8	G140 G144 N145 Y146	G140-S142 PolarHBondContact O-N 2.86Å; S142-G144 PolarHBondContact O-N 3.37Å; S142-G144 PolarHBondContact OG-N 2.87Å; S142-N145 PolarHBondContact O-N 3.42Å; S142-Y146 WeakPolarHBondContact O-CB 3.35Å; S142-Y146 PolarHBondContact O-N 2.91Å
143	W	96.6	Very high	74.5	Confident	12 Å²	12	86 Å²	86	5%	0.045	52%	0.515	C	S	.	.	H	α-helix	trans	-50.5	-40.5	172.7	-91	124.7	0	0	0	112.5	F141 N145 Y146 I147 K497 E499 V511 V547 L557	F141-W143 HydrophobicContact CE1-CB 4.4Å; F141-W143 AromaticContact CE1-CD1 3.96Å; F141-W143 AromaticContact CE1-CD2 3.72Å; F141-W143 HydrophobicContact CE1-CD2 3.72Å; F141-W143 AromaticContact CE1-CE2 3.95Å; F141-W143 HydrophobicContact CE1-CE3 4.23Å; F141-W143 AromaticContact CE1-CG 3.76Å; F141-W143 HydrophobicContact CE1-CG 3.76Å; F141-W143 AromaticContact CZ-CD2 3.83Å; F141-W143 HydrophobicContact CZ-CD2 3.83Å; F141-W143 AromaticContact CZ-CE3 3.85Å; F141-W143 HydrophobicContact CZ-CE3 3.85Å; F141-W143 HydrophobicContact CZ-CG 4.22Å; F141-W143 HydrophobicContact CZ-CZ3 4.33Å; W143-N145 PolarHBondContact O-N 2.98Å; W143-Y146 HydrophobicContact CE3-CD1 4.09Å; W143-Y146 AromaticContact CZ3-CD1 3.96Å; W143-Y146 HydrophobicContact CZ3-CD1 3.96Å; W143-Y146 HydrophobicContact CZ3-CE1 4.37Å; W143-Y146 PolarHBondContact O-N 2.87Å; W143-I147 HydrophobicContact CE3-CD1 3.88Å; W143-I147 HydrophobicContact CE3-CG1 4.1Å; W143-I147 VanDerWaalsContact O-CB 3.24Å; W143-I147 WeakPolarHBondContact O-CB 3.34Å; W143-I147 VanDerWaalsContact O-CG1 3.26Å; W143-I147 WeakPolarHBondContact O-CG1 3.38Å; W143-I147 PolarHBondContact O-N 3.4Å; W143-K497 HydrophobicContact CH2-CB 4.04Å; W143-K497 HydrophobicContact CZ3-CB 3.83Å; W143-K497 HydrophobicContact CZ3-CG 4.29Å; W143-E499 HydrophobicContact CZ2-CG 3.68Å; W143-E499 PolarHBondContact NE1-OE1 3.29Å; W143-V511 HydrophobicContact CH2-CB 4.27Å; W143-V511 HydrophobicContact CH2-CG1 3.6Å; W143-V511 HydrophobicContact CH2-CG2 4.16Å; W143-V511 HydrophobicContact CZ2-CB 4.33Å; W143-V511 HydrophobicContact CZ2-CG1 4.12Å; W143-V511 HydrophobicContact CZ2-CG2 3.82Å; W143-V511 HydrophobicContact CZ3-CG1 4.01Å; W143-V547 HydrophobicContact CB-CG1 4.08Å; W143-V547 HydrophobicContact CD2-CB 4.46Å; W143-V547 HydrophobicContact CD2-CG1 3.62Å; W143-V547 HydrophobicContact CD2-CG2 4.18Å; W143-V547 HydrophobicContact CE3-CG1 4.08Å; W143-V547 HydrophobicContact CE3-CG2 4.16Å; W143-V547 HydrophobicContact CG-CG1 3.64Å; W143-V547 HydrophobicContact CH2-CG2 3.75Å; W143-V547 HydrophobicContact CZ2-CG2 3.78Å; W143-V547 HydrophobicContact CZ3-CG2 3.96Å; W143-L557 VanDerWaalsContact NE1-CD2 3.31Å
144	G	94.4	Very high	77.5	Confident	4 Å²	4	76.4 Å²	76.4	4%	0.041	48%	0.475	C	S	.	.	H	α-helix	trans	-63.5	-42.8	-178.4	0	0	0	0	0	113.2	S142 N148 W221	S142-G144 PolarHBondContact O-N 3.37Å; S142-G144 PolarHBondContact OG-N 2.87Å; G144-N148 WeakPolarHBondContact O-CB 3.42Å; G144-N148 PolarHBondContact O-N 2.86Å; G144-W221 VanDerWaalsContact CA-CE2 3.42Å; G144-W221 PolarHBondContact O-NE1 2.9Å
145	N	94.1	Very high	80.6	Confident	107 Å²	107	71.8 Å²	71.8	57%	0.572	44%	0.437	S	S	*	.	H	α-helix	trans	-69.4	-42.4	176.1	-66.9	0.4	0	0	0	110.8	S142 W143 I147 N148 S149	S142-N145 PolarHBondContact O-N 3.42Å; W143-N145 PolarHBondContact O-N 2.98Å; N145-I147 PolarHBondContact O-N 3.48Å; N145-N148 PolarHBondContact O-N 3.34Å; N145-S149 WeakPolarHBondContact O-CB 3.24Å; N145-S149 PolarHBondContact O-N 3.5Å; N145-S149 PolarHBondContact O-OG 3.23Å
146	Y	95.6	Very high	83.4	Confident	50 Å²	50	68.6 Å²	68.6	20%	0.196	41%	0.407	C	S	.	.	H	α-helix	trans	-64.3	-38.5	179.7	-170.8	-118.2	0	0	0	112.7	F141 S142 W143 S149 N150 F152 K497 V511 D527 P560	F141-Y146 AromaticContact CE2-CD1 3.87Å; F141-Y146 HydrophobicContact CE2-CD1 3.87Å; F141-Y146 HydrophobicContact CE2-CD2 4.05Å; F141-Y146 AromaticContact CE2-CG 3.61Å; F141-Y146 HydrophobicContact CE2-CG 3.61Å; F141-Y146 AromaticContact CZ-CD1 3.87Å; F141-Y146 HydrophobicContact CZ-CD1 3.87Å; F141-Y146 AromaticContact CZ-CG 3.99Å; F141-Y146 HydrophobicContact CZ-CG 3.99Å; S142-Y146 WeakPolarHBondContact O-CB 3.35Å; S142-Y146 PolarHBondContact O-N 2.91Å; W143-Y146 HydrophobicContact CE3-CD1 4.09Å; W143-Y146 AromaticContact CZ3-CD1 3.96Å; W143-Y146 HydrophobicContact CZ3-CD1 3.96Å; W143-Y146 HydrophobicContact CZ3-CE1 4.37Å; W143-Y146 PolarHBondContact O-N 2.87Å; Y146-S149 PolarHBondContact O-OG 3.18Å; Y146-N150 PolarHBondContact O-ND2 3.21Å; Y146-F152 HydrophobicContact CD1-CD2 4.11Å; Y146-F152 HydrophobicContact CD1-CE2 4.13Å; Y146-F152 AromaticContact CE1-CD2 3.92Å; Y146-F152 HydrophobicContact CE1-CD2 3.92Å; Y146-F152 AromaticContact CE1-CE2 3.6Å; Y146-F152 HydrophobicContact CE1-CE2 3.6Å; Y146-F152 HydrophobicContact CE2-CE2 4.02Å; Y146-F152 AromaticContact CZ-CE2 3.52Å; Y146-F152 WeakPolarHBondContact O-CD2 3.32Å; Y146-K497 HydrophobicContact CE1-CD 4.4Å; Y146-K497 PolarHBondContact OH-NZ 2.91Å; Y146-V511 HydrophobicContact CD1-CG1 4.47Å; Y146-V511 HydrophobicContact CE1-CG1 3.99Å; Y146-D527 PolarHBondContact OH-OD2 3.07Å; Y146-D527 VanDerWaalsContact OH-OD2 3.07Å; Y146-P560 HydrophobicContact CE1-CG 4.47Å; Y146-P560 HydrophobicContact CE2-CG 4.23Å
147	I	95.5	Very high	86.7	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	37%	0.373	C	S	.	.	H	α-helix	trans	-74.6	-39.7	178	-74.3	171.7	0	0	0	112.1	W143 N145 S151 F152 A154 A201 W221 V547	W143-I147 HydrophobicContact CE3-CD1 3.88Å; W143-I147 HydrophobicContact CE3-CG1 4.1Å; W143-I147 VanDerWaalsContact O-CB 3.24Å; W143-I147 WeakPolarHBondContact O-CB 3.34Å; W143-I147 VanDerWaalsContact O-CG1 3.26Å; W143-I147 WeakPolarHBondContact O-CG1 3.38Å; W143-I147 PolarHBondContact O-N 3.4Å; N145-I147 PolarHBondContact O-N 3.48Å; I147-S151 CarbonylContact O-C 3.57Å; I147-S151 VanDerWaalsContact O-CA 3.32Å; I147-S151 WeakPolarHBondContact O-CA 3.35Å; I147-S151 PolarHBondContact O-N 2.99Å; I147-S151 VanDerWaalsContact O-N 3.09Å; I147-F152 HydrophobicContact CG1-CB 4.41Å; I147-F152 PolarHBondContact O-N 3.09Å; I147-A154 HydrophobicContact CD1-CB 4.5Å; I147-A201 HydrophobicContact CD1-CB 3.76Å; I147-W221 HydrophobicContact CG2-CH2 4.16Å; I147-W221 HydrophobicContact CG2-CZ2 4.07Å; I147-V547 HydrophobicContact CD1-CG1 4.08Å
148	N	92.4	Very high	89.7	Confident	73 Å²	73	60 Å²	60	39%	0.39	35%	0.353	S	S	.	.	H	α-helix	trans	-72.9	-46.3	-179.6	-78.2	-7.3	0	0	0	112.4	G144 N145 N150 S151 W221	G144-N148 WeakPolarHBondContact O-CB 3.42Å; G144-N148 PolarHBondContact O-N 2.86Å; N145-N148 PolarHBondContact O-N 3.34Å; N148-N150 VanDerWaalsContact C-N 3.28Å; N148-N150 PolarHBondContact O-N 3.5Å; N148-S151 PolarHBondContact O-N 3.33Å; N148-W221 PolarHBondContact ND2-NE1 2.99Å; N148-W221 WeakPolarHBondContact OD1-CZ2 3.46Å
149	S	90.6	Very high	92.5	Very high	92 Å²	92	53.9 Å²	53.9	64%	0.643	32%	0.316	S	S	*	.	H	α-helix	trans	-60.9	-33.9	-178.1	51.2	0	0	0	0	114	N145 Y146	N145-S149 WeakPolarHBondContact O-CB 3.24Å; N145-S149 PolarHBondContact O-N 3.5Å; N145-S149 PolarHBondContact O-OG 3.23Å; Y146-S149 PolarHBondContact O-OG 3.18Å
150	N	90.3	Very high	94.6	Very high	80 Å²	80	45.2 Å²	45.2	43%	0.428	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	0.7	-178.4	-60.3	-76.5	0	0	0	113.7	Y146 N148 F152	Y146-N150 PolarHBondContact O-ND2 3.21Å; N148-N150 VanDerWaalsContact C-N 3.28Å; N148-N150 PolarHBondContact O-N 3.5Å; N150-F152 HydrophobicContact CB-CD1 3.99Å; N150-F152 HydrophobicContact CB-CD2 3.49Å; N150-F152 VanDerWaalsContact CB-CD2 3.49Å; N150-F152 HydrophobicContact CB-CE1 3.78Å; N150-F152 HydrophobicContact CB-CE2 3.25Å; N150-F152 HydrophobicContact CB-CG 3.84Å; N150-F152 HydrophobicContact CB-CZ 3.42Å; N150-F152 VanDerWaalsContact CB-CZ 3.42Å; N150-F152 VanDerWaalsContact CG-CE2 3.46Å; N150-F152 WeakPolarHBondContact ND2-CE2 3.35Å; N150-F152 PolarHBondContact O-N 2.76Å
151	S	93.6	Very high	95.5	Very high	99 Å²	99	47.7 Å²	47.7	69%	0.692	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	32.4	-171.8	-61.3	0	0	0	0	114.7	I147 N148	I147-S151 CarbonylContact O-C 3.57Å; I147-S151 VanDerWaalsContact O-CA 3.32Å; I147-S151 WeakPolarHBondContact O-CA 3.35Å; I147-S151 PolarHBondContact O-N 2.99Å; I147-S151 VanDerWaalsContact O-N 3.09Å; N148-S151 PolarHBondContact O-N 3.33Å
152	F	95.9	Very high	95.8	Very high	52 Å²	52	46 Å²	46	23%	0.228	26%	0.261	C	S	.	.			trans	-66.1	159.4	-178.2	-68	-44.8	0	0	0	113.4	Y146 I147 N150 K199 K497	Y146-F152 HydrophobicContact CD1-CD2 4.11Å; Y146-F152 HydrophobicContact CD1-CE2 4.13Å; Y146-F152 AromaticContact CE1-CD2 3.92Å; Y146-F152 HydrophobicContact CE1-CD2 3.92Å; Y146-F152 AromaticContact CE1-CE2 3.6Å; Y146-F152 HydrophobicContact CE1-CE2 3.6Å; Y146-F152 HydrophobicContact CE2-CE2 4.02Å; Y146-F152 AromaticContact CZ-CE2 3.52Å; Y146-F152 WeakPolarHBondContact O-CD2 3.32Å; I147-F152 HydrophobicContact CG1-CB 4.41Å; I147-F152 PolarHBondContact O-N 3.09Å; N150-F152 HydrophobicContact CB-CD1 3.99Å; N150-F152 HydrophobicContact CB-CD2 3.49Å; N150-F152 VanDerWaalsContact CB-CD2 3.49Å; N150-F152 HydrophobicContact CB-CE1 3.78Å; N150-F152 HydrophobicContact CB-CE2 3.25Å; N150-F152 HydrophobicContact CB-CG 3.84Å; N150-F152 HydrophobicContact CB-CZ 3.42Å; N150-F152 VanDerWaalsContact CB-CZ 3.42Å; N150-F152 VanDerWaalsContact CG-CE2 3.46Å; N150-F152 WeakPolarHBondContact ND2-CE2 3.35Å; N150-F152 PolarHBondContact O-N 2.76Å; F152-K199 PolarHBondContact O-NZ 2.93Å; F152-K497 HydrophobicContact CB-CG 3.92Å; F152-K497 HydrophobicContact CD2-CD 4.38Å; F152-K497 HydrophobicContact CD2-CG 4.19Å; F152-K497 HydrophobicContact CG-CD 4.47Å; F152-K497 HydrophobicContact CG-CG 4.06Å
153	T	97.2	Very high	96	Very high	83 Å²	83	44 Å²	44	51%	0.509	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	132.7	170.5	-57.9	0	0	0	0	108.5	M496 K497	T153-M496 HydrophobicContact CG2-CE 4.3Å; T153-M496 HydrophobicContact CG2-CG 4.45Å; T153-M496 WeakPolarHBondContact O-CA 3.42Å; T153-K497 PolarHBondContact O-N 3.32Å
154	A	98.4	Very high	96	Very high	9 Å²	9	43.7 Å²	43.7	7%	0.074	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	154.5	171.1	0	0	0	0	0	111	I147 A201 K497 V547	I147-A154 HydrophobicContact CD1-CB 4.5Å; A154-A201 HydrophobicContact CB-CB 3.77Å; A154-K497 CarbonylContact C-O 3.58Å; A154-K497 VanDerWaalsContact CA-O 3.31Å; A154-K497 WeakPolarHBondContact CA-O 3.43Å; A154-V547 HydrophobicContact CB-CB 4Å; A154-V547 HydrophobicContact CB-CG2 3.57Å
155	A	98.6	Very high	96.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-66.1	131.1	166.6	0	0	0	0	0	109.8	F160 F492 M496 K497 L498	A155-F160 HydrophobicContact CB-CE2 3.59Å; A155-F160 HydrophobicContact CB-CZ 3.63Å; A155-F492 HydrophobicContact CB-CD1 3.96Å; A155-F492 HydrophobicContact CB-CE1 3.8Å; A155-M496 HydrophobicContact CB-CB 4.22Å; A155-M496 HydrophobicContact CB-SD 4.06Å; A155-K497 PolarHBondContact N-O 3.17Å; A155-L498 HydrophobicContact CB-CB 4.48Å
156	P	98	Very high	96.2	Very high	43 Å²	43	38.9 Å²	38.9	28%	0.279	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-71.6	153.3	179.3	30.2	-35.6	0	0	0	111.4	T158 C159 F160	P156-T158 PolarHBondContact O-N 2.96Å; P156-C159 WeakPolarHBondContact O-CB 3.36Å; P156-C159 PolarHBondContact O-N 3.12Å; P156-F160 WeakPolarHBondContact O-CD2 3.43Å; P156-F160 WeakPolarHBondContact O-CE2 3.49Å
157	V	98.4	Very high	96.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-53.8	-31.5	-179.6	178.4	0	0	0	0	112.5	C159 F160 W169 G202 Y203 P546	V157-C159 PolarHBondContact O-N 3.26Å; V157-C159 VanDerWaalsContact O-N 3.14Å; V157-F160 PolarHBondContact O-N 2.96Å; V157-W169 HydrophobicContact CB-CB 4.4Å; V157-W169 HydrophobicContact CB-CD2 3.66Å; V157-W169 HydrophobicContact CB-CE3 4.18Å; V157-W169 HydrophobicContact CB-CG 3.77Å; V157-W169 HydrophobicContact CB-CZ2 4.42Å; V157-W169 HydrophobicContact CG1-CB 4.4Å; V157-W169 HydrophobicContact CG1-CD2 3.94Å; V157-W169 HydrophobicContact CG1-CE3 3.99Å; V157-W169 HydrophobicContact CG1-CG 4.15Å; V157-W169 HydrophobicContact CG2-CD2 3.89Å; V157-W169 HydrophobicContact CG2-CE3 4.25Å; V157-W169 HydrophobicContact CG2-CG 4.45Å; V157-W169 HydrophobicContact CG2-CH2 4.1Å; V157-W169 HydrophobicContact CG2-CZ2 3.71Å; V157-W169 HydrophobicContact CG2-CZ3 4.35Å; V157-G202 VanDerWaalsContact CG2-C 3.44Å; V157-G202 WeakPolarHBondContact CG2-O 3.32Å; V157-Y203 HydrophobicContact CB-CE1 4.5Å; V157-Y203 HydrophobicContact CG1-CE1 3.79Å; V157-Y203 HydrophobicContact CG2-CD1 3.76Å; V157-Y203 HydrophobicContact CG2-CD2 4.43Å; V157-Y203 HydrophobicContact CG2-CE1 3.81Å; V157-Y203 HydrophobicContact CG2-CE2 4.48Å; V157-Y203 HydrophobicContact CG2-CG 4.08Å; V157-P546 HydrophobicContact CB-CG 4.31Å; V157-P546 HydrophobicContact CG1-CG 4.29Å; V157-P546 HydrophobicContact CG2-CB 3.89Å; V157-P546 HydrophobicContact CG2-CG 4.08Å
158	T	97.4	Very high	96	Very high	59 Å²	59	44.7 Å²	44.7	36%	0.362	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-61.6	-17.2	176.7	51.1	0	0	0	0	115.2	P156 F160 K161 W169	P156-T158 PolarHBondContact O-N 2.96Å; T158-F160 VanDerWaalsContact C-N 3.32Å; T158-K161 PolarHBondContact O-NZ 3.5Å; T158-W169 HydrophobicContact CG2-CB 3.85Å; T158-W169 HydrophobicContact CG2-CG 4.39Å
159	C	98.3	Very high	96.1	Very high	5 Å²	5	41.6 Å²	41.6	3%	0.034	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-70.9	-27.5	172	-68.9	0	0	0	0	112.3	P156 V157 H490 F492	P156-C159 WeakPolarHBondContact O-CB 3.36Å; P156-C159 PolarHBondContact O-N 3.12Å; V157-C159 PolarHBondContact O-N 3.26Å; V157-C159 VanDerWaalsContact O-N 3.14Å; C159-H490 PolarHBondContact SG-O 2.86Å; C159-F492 HydrophobicContact CB-CD1 4.42Å; C159-F492 HydrophobicContact CB-CD2 4.24Å; C159-F492 HydrophobicContact CB-CE1 3.99Å; C159-F492 HydrophobicContact CB-CE2 3.78Å; C159-F492 HydrophobicContact CB-CZ 3.65Å
160	F	98.4	Very high	96.1	Very high	5 Å²	5	40.6 Å²	40.6	2%	0.022	25%	0.251	C	S	.	.			trans	-108.9	87.4	-164.5	-54.3	-91.5	0	0	0	111.2	A155 P156 V157 T158 H162 A163 F492 L498 L544 Y545 P546	A155-F160 HydrophobicContact CB-CE2 3.59Å; A155-F160 HydrophobicContact CB-CZ 3.63Å; P156-F160 WeakPolarHBondContact O-CD2 3.43Å; P156-F160 WeakPolarHBondContact O-CE2 3.49Å; V157-F160 PolarHBondContact O-N 2.96Å; T158-F160 VanDerWaalsContact C-N 3.32Å; F160-H162 VanDerWaalsContact C-N 3.27Å; F160-H162 PolarHBondContact O-N 3.43Å; F160-A163 HydrophobicContact CB-CB 3.82Å; F160-A163 PolarHBondContact O-N 3.38Å; F160-A163 VanDerWaalsContact O-N 3.15Å; F160-F492 AromaticContact CD1-CZ 3.99Å; F160-F492 HydrophobicContact CD1-CZ 3.99Å; F160-F492 AromaticContact CE1-CE1 3.77Å; F160-F492 HydrophobicContact CE1-CE1 3.77Å; F160-F492 AromaticContact CE1-CZ 3.58Å; F160-F492 HydrophobicContact CE1-CZ 3.58Å; F160-F492 HydrophobicContact CE2-CE1 4.21Å; F160-F492 HydrophobicContact CE2-CZ 4.35Å; F160-F492 AromaticContact CZ-CE1 3.57Å; F160-F492 HydrophobicContact CZ-CE1 3.57Å; F160-F492 AromaticContact CZ-CZ 3.81Å; F160-F492 HydrophobicContact CZ-CZ 3.81Å; F160-L498 HydrophobicContact CE1-CB 4.45Å; F160-L498 HydrophobicContact CE1-CD2 4.35Å; F160-L498 HydrophobicContact CZ-CB 3.92Å; F160-L498 HydrophobicContact CZ-CD2 4.22Å; F160-L544 HydrophobicContact CD1-CB 4.31Å; F160-L544 WeakPolarHBondContact CD1-O 3.39Å; F160-L544 HydrophobicContact CE1-CB 3.98Å; F160-Y545 VanDerWaalsContact CE1-C 3.44Å; F160-Y545 WeakPolarHBondContact CZ-O 3.34Å; F160-P546 HydrophobicContact CB-CG 4.02Å; F160-P546 HydrophobicContact CD2-CB 3.95Å; F160-P546 HydrophobicContact CD2-CG 3.46Å; F160-P546 VanDerWaalsContact CD2-CG 3.46Å; F160-P546 HydrophobicContact CE2-CB 3.94Å; F160-P546 HydrophobicContact CE2-CG 3.97Å; F160-P546 HydrophobicContact CG-CG 3.81Å
161	K	96.3	Very high	96.2	Very high	114 Å²	114	41.1 Å²	41.1	50%	0.496	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.3	-168.8	-53.1	-51.1	-178.7	-168.5	0	115	T158	T158-K161 PolarHBondContact O-NZ 3.5Å
162	H	97.3	Very high	96.3	Very high	30 Å²	30	37 Å²	37	14%	0.139	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-14	-179.3	64.4	-90.7	0	0	0	113.2	F160 Y334 S541 L544 Y545	F160-H162 VanDerWaalsContact C-N 3.27Å; F160-H162 PolarHBondContact O-N 3.43Å; H162-Y334 HydrophobicContact CB-CD2 3.94Å; H162-Y334 HydrophobicContact CB-CE2 4.24Å; H162-S541 PolarHBondContact CE1-O 2.92Å; H162-S541 PolarHBondContact ND1-O 2.81Å; H162-L544 PolarHBondContact CE1-O 2.81Å; H162-L544 PolarHBondContact NE2-O 2.76Å; H162-L544 VanDerWaalsContact NE2-O 3.14Å; H162-Y545 AromaticContact CD2-CE1 3.82Å; H162-Y545 AromaticContact NE2-CD1 3.34Å; H162-Y545 VanDerWaalsContact NE2-CD1 3.34Å; H162-Y545 WeakPolarHBondContact NE2-CD1 3.26Å; H162-Y545 AromaticContact NE2-CE1 3.27Å; H162-Y545 VanDerWaalsContact NE2-CE1 3.27Å; H162-Y545 WeakPolarHBondContact NE2-CE1 3.24Å
163	A	97.9	Very high	96.3	Very high	7 Å²	7	36.2 Å²	36.2	6%	0.058	23%	0.225	C	C	.	.	S	Bend	trans	-80.6	154	-172.8	0	0	0	0	0	111.3	F160 M165 G166 Y203 P546	F160-A163 HydrophobicContact CB-CB 3.82Å; F160-A163 PolarHBondContact O-N 3.38Å; F160-A163 VanDerWaalsContact O-N 3.15Å; A163-M165 PolarHBondContact O-N 3.36Å; A163-G166 WeakPolarHBondContact O-CA 3.34Å; A163-G166 PolarHBondContact O-N 3.34Å; A163-Y203 WeakPolarHBondContact CB-OH 3.38Å; A163-P546 HydrophobicContact CB-CG 4.13Å
164	P	97.5	Very high	96.2	Very high	5 Å²	5	37.9 Å²	37.9	3%	0.032	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.2	135.3	174.9	-29.8	36.2	0	0	0	112.2	G166 Y203 M281 L552	P164-G166 PolarHBondContact O-N 3.44Å; P164-Y203 WeakPolarHBondContact CD-OH 3.46Å; P164-Y203 VanDerWaalsContact O-CE1 3.26Å; P164-Y203 WeakPolarHBondContact O-CE1 3.49Å; P164-Y203 PolarHBondContact O-OH 2.98Å; P164-M281 HydrophobicContact CB-SD 3.9Å; P164-M281 HydrophobicContact CG-SD 3.61Å; P164-L552 HydrophobicContact CB-CD2 4.21Å
165	M	97.1	Very high	96.1	Very high	5 Å²	5	39.1 Å²	39.1	3%	0.025	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	8.3	-173	-56.9	-65.1	-81.1	0	0	117.2	A163 T167 C168 W169 F273 K276 V277 S280	A163-M165 PolarHBondContact O-N 3.36Å; M165-T167 PolarHBondContact O-N 3.02Å; M165-C168 HydrophobicContact CE-CB 3.86Å; M165-C168 CarbonylContact O-C 3.51Å; M165-C168 PolarHBondContact O-N 3.14Å; M165-C168 HydrophobicContact SD-CB 4.06Å; M165-W169 HydrophobicContact CB-CE3 3.76Å; M165-W169 HydrophobicContact CB-CZ3 4.1Å; M165-W169 PolarHBondContact O-N 2.68Å; M165-F273 HydrophobicContact CE-CD2 3.63Å; M165-F273 HydrophobicContact CE-CE2 3.54Å; M165-F273 HydrophobicContact CE-CZ 4.42Å; M165-K276 HydrophobicContact CE-CB 3.76Å; M165-K276 HydrophobicContact SD-CB 3.64Å; M165-V277 HydrophobicContact CE-CG2 4.04Å; M165-V277 HydrophobicContact CG-CG2 3.79Å; M165-V277 HydrophobicContact SD-CB 4.48Å; M165-V277 HydrophobicContact SD-CG2 3.9Å; M165-V277 PolarHBondContact SD-N 2.96Å; M165-S280 PolarHBondContact N-OG 3.23Å
166	G	95.8	Very high	96.1	Very high	4 Å²	4	39.1 Å²	39.1	4%	0.041	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-29.2	-177.2	0	0	0	0	0	115.7	A163 P164	A163-G166 WeakPolarHBondContact O-CA 3.34Å; A163-G166 PolarHBondContact O-N 3.34Å; P164-G166 PolarHBondContact O-N 3.44Å
167	T	93.1	Very high	96.1	Very high	120 Å²	120	39.8 Å²	39.8	74%	0.736	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-12.9	175.9	51.3	0	0	0	0	114.1	M165	M165-T167 PolarHBondContact O-N 3.02Å
168	C	93	Very high	96.1	Very high	53 Å²	53	39.9 Å²	39.9	36%	0.358	24%	0.239	S	C	.	.	S	Bend	trans	-115.4	19	-169.9	-67.9	0	0	0	0	113.5	M165	M165-C168 HydrophobicContact CE-CB 3.86Å; M165-C168 CarbonylContact O-C 3.51Å; M165-C168 PolarHBondContact O-N 3.14Å; M165-C168 HydrophobicContact SD-CB 4.06Å
169	W	95.5	Very high	96.1	Very high	8 Å²	8	37.2 Å²	37.2	3%	0.03	22%	0.222	C	C	.	.			trans	-91.2	-4.9	-173.2	-156.8	-103.5	0	0	0	115.2	V157 T158 M165 D171 I172 L200 G202 Y203 V224	V157-W169 HydrophobicContact CB-CB 4.4Å; V157-W169 HydrophobicContact CB-CD2 3.66Å; V157-W169 HydrophobicContact CB-CE3 4.18Å; V157-W169 HydrophobicContact CB-CG 3.77Å; V157-W169 HydrophobicContact CB-CZ2 4.42Å; V157-W169 HydrophobicContact CG1-CB 4.4Å; V157-W169 HydrophobicContact CG1-CD2 3.94Å; V157-W169 HydrophobicContact CG1-CE3 3.99Å; V157-W169 HydrophobicContact CG1-CG 4.15Å; V157-W169 HydrophobicContact CG2-CD2 3.89Å; V157-W169 HydrophobicContact CG2-CE3 4.25Å; V157-W169 HydrophobicContact CG2-CG 4.45Å; V157-W169 HydrophobicContact CG2-CH2 4.1Å; V157-W169 HydrophobicContact CG2-CZ2 3.71Å; V157-W169 HydrophobicContact CG2-CZ3 4.35Å; T158-W169 HydrophobicContact CG2-CB 3.85Å; T158-W169 HydrophobicContact CG2-CG 4.39Å; M165-W169 HydrophobicContact CB-CE3 3.76Å; M165-W169 HydrophobicContact CB-CZ3 4.1Å; M165-W169 PolarHBondContact O-N 2.68Å; W169-D171 VanDerWaalsContact C-N 3.25Å; W169-D171 PolarHBondContact O-N 3.01Å; W169-D171 VanDerWaalsContact O-N 3.12Å; W169-I172 HydrophobicContact CD2-CB 4.06Å; W169-I172 HydrophobicContact CD2-CG1 3.9Å; W169-I172 HydrophobicContact CE3-CG1 4.04Å; W169-I172 HydrophobicContact CG-CB 4.29Å; W169-I172 HydrophobicContact CG-CG1 4.3Å; W169-I172 HydrophobicContact CH2-CG2 4.36Å; W169-I172 HydrophobicContact CZ2-CB 4.24Å; W169-I172 HydrophobicContact CZ2-CG1 4.44Å; W169-I172 HydrophobicContact CZ2-CG2 3.77Å; W169-I172 HydrophobicContact CZ3-CG1 4.37Å; W169-I172 WeakPolarHBondContact O-CB 3.5Å; W169-I172 PolarHBondContact O-N 3.37Å; W169-L200 HydrophobicContact CZ2-CD1 4.42Å; W169-L200 HydrophobicContact CZ2-CD2 4.46Å; W169-G202 WeakPolarHBondContact CZ2-O 3.38Å; W169-Y203 AromaticContact CH2-CD1 3.76Å; W169-Y203 HydrophobicContact CH2-CD1 3.76Å; W169-Y203 HydrophobicContact CH2-CE1 4.49Å; W169-Y203 AromaticContact CZ3-CD1 3.88Å; W169-Y203 HydrophobicContact CZ3-CD1 3.88Å; W169-Y203 HydrophobicContact CZ3-CE1 4.2Å; W169-V224 HydrophobicContact CH2-CB 4.1Å; W169-V224 HydrophobicContact CH2-CG1 4.28Å
170	G	90.9	Very high	96.1	Very high	71 Å²	71	37.1 Å²	37.1	73%	0.732	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-25.6	-167	0	0	0	0	0	116.1
171	D	91.1	Very high	96	Very high	91 Å²	91	38.1 Å²	38.1	49%	0.487	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-20	177.9	-60.6	-60	0	0	0	113.1	W169 S173 P270	W169-D171 VanDerWaalsContact C-N 3.25Å; W169-D171 PolarHBondContact O-N 3.01Å; W169-D171 VanDerWaalsContact O-N 3.12Å; D171-S173 PolarHBondContact O-N 3Å; D171-S173 PolarHBondContact O-OG 2.93Å; D171-P270 HydrophobicContact CB-CG 3.97Å
172	I	95.6	Very high	96	Very high	12 Å²	12	33.2 Å²	33.2	6%	0.062	21%	0.207	C	C	.	.			trans	-80.6	114.1	-173.9	-46.6	-56	0	0	0	109.8	W169 I197 L200 V224 L269 F273	W169-I172 HydrophobicContact CD2-CB 4.06Å; W169-I172 HydrophobicContact CD2-CG1 3.9Å; W169-I172 HydrophobicContact CE3-CG1 4.04Å; W169-I172 HydrophobicContact CG-CB 4.29Å; W169-I172 HydrophobicContact CG-CG1 4.3Å; W169-I172 HydrophobicContact CH2-CG2 4.36Å; W169-I172 HydrophobicContact CZ2-CB 4.24Å; W169-I172 HydrophobicContact CZ2-CG1 4.44Å; W169-I172 HydrophobicContact CZ2-CG2 3.77Å; W169-I172 HydrophobicContact CZ3-CG1 4.37Å; W169-I172 WeakPolarHBondContact O-CB 3.5Å; W169-I172 PolarHBondContact O-N 3.37Å; I172-I197 HydrophobicContact CG2-CD1 4.4Å; I172-L200 HydrophobicContact CG2-CD1 4.29Å; I172-L200 HydrophobicContact CG2-CD2 3.98Å; I172-V224 HydrophobicContact CG2-CG1 4.28Å; I172-L269 HydrophobicContact CD1-CD2 3.36Å; I172-F273 HydrophobicContact CD1-CD2 3.99Å; I172-F273 HydrophobicContact CD1-CE2 3.59Å; I172-F273 HydrophobicContact CD1-CZ 4.33Å; I172-F273 HydrophobicContact CG1-CE2 4.14Å
173	S	96.2	Very high	95.8	Very high	36 Å²	36	37 Å²	37	25%	0.252	23%	0.233	S	C	.	.			trans	-152.9	159.2	-172.9	42.4	0	0	0	0	112.1	D171 V176	D171-S173 PolarHBondContact O-N 3Å; D171-S173 PolarHBondContact O-OG 2.93Å; S173-V176 VanDerWaalsContact O-CB 3.32Å; S173-V176 WeakPolarHBondContact O-CB 3.24Å; S173-V176 VanDerWaalsContact O-CG2 3.24Å; S173-V176 WeakPolarHBondContact O-CG2 3.48Å; S173-V176 PolarHBondContact O-N 3.26Å; S173-V176 VanDerWaalsContact O-N 3.16Å; S173-V176 WeakPolarHBondContact OG-CG2 3.49Å
174	E	96.6	Very high	95.6	Very high	118 Å²	118	38.3 Å²	38.3	55%	0.551	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	139.9	170.8	-68.8	171.5	-179	0	0	110.1	I197 K199 L200	E174-I197 HydrophobicContact CG-CG2 4.29Å; E174-K199 WeakPolarHBondContact OE1-CA 3.48Å; E174-L200 HydrophobicContact CG-CB 4.44Å; E174-L200 PolarHBondContact OE1-N 2.89Å
175	G	95.8	Very high	95.2	Very high	35 Å²	35	39.8 Å²	39.8	36%	0.361	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.2	-11.8	-171.8	0	0	0	0	0	115.8	R177 I197	G175-R177 PolarHBondContact O-NH1 3.24Å; G175-I197 PolarHBondContact N-O 2.72Å
176	V	97.7	Very high	94.7	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.006	28%	0.278	C	S	.	.			trans	-60.9	140.8	169.6	172.4	0	0	0	0	110.2	S173 G196 I197 K267 L269	S173-V176 VanDerWaalsContact O-CB 3.32Å; S173-V176 WeakPolarHBondContact O-CB 3.24Å; S173-V176 VanDerWaalsContact O-CG2 3.24Å; S173-V176 WeakPolarHBondContact O-CG2 3.48Å; S173-V176 PolarHBondContact O-N 3.26Å; S173-V176 VanDerWaalsContact O-N 3.16Å; S173-V176 WeakPolarHBondContact OG-CG2 3.49Å; V176-G196 WeakPolarHBondContact O-CA 3.48Å; V176-I197 HydrophobicContact CB-CD1 4.2Å; V176-I197 PolarHBondContact O-N 2.86Å; V176-K267 HydrophobicContact CG2-CB 4.05Å; V176-K267 HydrophobicContact CG2-CD 4.47Å; V176-L269 HydrophobicContact CG1-CD2 4.48Å
177	R	98.1	Very high	94.2	Very high	57 Å²	57	47.9 Å²	47.9	22%	0.215	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	144.5	177.4	-60.2	-49.7	-164.1	-113.9	19.9	111.9	G175 I194 A195 G196 E210 V232 L263 A266 K267 T268	G175-R177 PolarHBondContact O-NH1 3.24Å; R177-I194 HydrophobicContact CB-CG2 4.36Å; R177-A195 WeakPolarHBondContact CA-O 3.5Å; R177-G196 VanDerWaalsContact CD-CA 3.47Å; R177-E210 IonicContact CZ-OE1 3.47Å; R177-E210 IonicContact NE-OE1 2.7Å; R177-E210 PolarHBondContact NE-OE1 3.1Å; R177-E210 IonicContact NH2-OE1 3.57Å; R177-E210 PolarHBondContact NH2-OE1 3.29Å; R177-V232 HydrophobicContact CB-CG2 3.92Å; R177-L263 HydrophobicContact CB-CD2 4.33Å; R177-L263 HydrophobicContact CG-CD2 4.32Å; R177-A266 HydrophobicContact CG-CB 4.16Å; R177-K267 PolarHBondContact N-O 3.36Å; R177-T268 WeakPolarHBondContact O-CA 3.44Å
178	V	98.2	Very high	93.8	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.012	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	150.6	-176.1	-73.8	0	0	0	0	110.8	V180 I194 A195 L207 I229 L269	V178-V180 HydrophobicContact CB-CG1 4.1Å; V178-V180 HydrophobicContact CG2-CG1 3.72Å; V178-I194 CarbonylContact O-C 3.04Å; V178-I194 WeakPolarHBondContact O-CA 3.26Å; V178-A195 HydrophobicContact CG2-CB 4.27Å; V178-A195 WeakPolarHBondContact CG2-O 3.3Å; V178-A195 PolarHBondContact N-O 2.78Å; V178-A195 PolarHBondContact O-N 3.43Å; V178-L207 HydrophobicContact CG2-CD1 3.98Å; V178-L207 HydrophobicContact CG2-CD2 4.09Å; V178-I229 HydrophobicContact CB-CG2 4Å; V178-I229 HydrophobicContact CG1-CG2 3.84Å; V178-L269 HydrophobicContact CG1-CD1 3.66Å; V178-L269 HydrophobicContact CG1-CD2 4.38Å; V178-L269 HydrophobicContact CG1-CG 3.75Å
179	E	98.1	Very high	93.5	Very high	3 Å²	3	50.5 Å²	50.5	1%	0.014	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	127.2	161.9	-81.2	173	-169.9	0	0	109.2	I194 H230 G233 W234 C235 L242	E179-I194 HydrophobicContact CG-CD1 3.5Å; E179-H230 HydrophobicContact CB-CB 4.14Å; E179-H230 PolarHBondContact N-O 2.94Å; E179-H230 PolarHBondContact O-N 3.38Å; E179-G233 PolarHBondContact OE1-N 3.49Å; E179-W234 PolarHBondContact OE2-N 3.27Å; E179-C235 VanDerWaalsContact OE2-CB 3.26Å; E179-C235 WeakPolarHBondContact OE2-CB 3.29Å; E179-C235 PolarHBondContact OE2-N 3.09Å; E179-C235 PolarHBondContact OE2-SG 3.05Å; E179-L242 HydrophobicContact CG-CD2 4.02Å
180	V	97.6	Very high	93.3	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.012	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	159.1	-174.6	-66.9	0	0	0	0	110.9	V178 N182 F192 W193 A195 L207 Y209 F220 I229	V178-V180 HydrophobicContact CB-CG1 4.1Å; V178-V180 HydrophobicContact CG2-CG1 3.72Å; V180-N182 PolarHBondContact O-N 3.35Å; V180-F192 VanDerWaalsContact C-CD1 3.44Å; V180-F192 CarbonylContact O-C 3.51Å; V180-F192 VanDerWaalsContact O-CA 3.24Å; V180-F192 WeakPolarHBondContact O-CA 3.44Å; V180-F192 WeakPolarHBondContact O-CB 3.36Å; V180-W193 PolarHBondContact N-O 2.93Å; V180-W193 PolarHBondContact O-N 3.18Å; V180-A195 HydrophobicContact CG2-CB 3.65Å; V180-L207 HydrophobicContact CB-CD1 4.37Å; V180-L207 HydrophobicContact CG1-CD1 3.7Å; V180-L207 HydrophobicContact CG2-CD1 4.15Å; V180-Y209 HydrophobicContact CG2-CE1 4.22Å; V180-F220 HydrophobicContact CG2-CZ 4Å; V180-I229 HydrophobicContact CG1-CB 4.35Å; V180-I229 HydrophobicContact CG1-CG1 4Å; V180-I229 HydrophobicContact CG1-CG2 4.02Å
181	P	96.8	Very high	93.4	Very high	26 Å²	26	53.1 Å²	53.1	17%	0.169	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	134	-179	-20.7	33.8	0	0	0	110.9	T183 K190 V191 F192 Y209 D228	P181-T183 PolarHBondContact O-N 3.49Å; P181-K190 HydrophobicContact CB-CG 4.39Å; P181-V191 WeakPolarHBondContact CA-O 3.37Å; P181-F192 HydrophobicContact CG-CE1 4.08Å; P181-Y209 PolarHBondContact O-OH 3.2Å; P181-Y209 VanDerWaalsContact O-OH 3.05Å; P181-D228 HydrophobicContact CG-CB 3.72Å
182	N	96.1	Very high	93.7	Very high	12 Å²	12	49 Å²	49	6%	0.064	29%	0.285	C	S	.	.			trans	-85.1	104.3	174.7	178.8	6.6	0	0	0	109.8	V180 D184 V191 W193 V243 P244 P245	V180-N182 PolarHBondContact O-N 3.35Å; N182-D184 PolarHBondContact OD1-N 3.31Å; N182-D184 PolarHBondContact OD1-O 3.37Å; N182-V191 HydrophobicContact CB-CG2 4.41Å; N182-V191 PolarHBondContact N-O 2.79Å; N182-W193 HydrophobicContact CB-CB 4.1Å; N182-V243 PolarHBondContact ND2-O 3.12Å; N182-P244 VanDerWaalsContact ND2-C 3.34Å; N182-P244 PolarHBondContact ND2-O 3.19Å; N182-P245 WeakPolarHBondContact ND2-CA 3.18Å
183	T	93.8	Very high	93.8	Very high	110 Å²	110	48.6 Å²	48.6	68%	0.675	28%	0.283	S	S	*	.	S	Bend	trans	-77.5	-23	176.9	51.7	0	0	0	0	113.9	P181 C185 Y209	P181-T183 PolarHBondContact O-N 3.49Å; T183-C185 VanDerWaalsContact C-N 3.28Å; T183-C185 PolarHBondContact O-N 3.21Å; T183-Y209 PolarHBondContact N-OH 2.97Å; T183-Y209 PolarHBondContact OG1-OH 3.47Å
184	D	94	Very high	93.9	Very high	33 Å²	33	46.9 Å²	46.9	18%	0.176	27%	0.271	C	S	.	.	S	Bend	trans	-92	61.6	175.5	177.3	31	0	0	0	109.9	N182 L218 P245 R246 S247	N182-D184 PolarHBondContact OD1-N 3.31Å; N182-D184 PolarHBondContact OD1-O 3.37Å; D184-L218 HydrophobicContact CB-CD1 4.23Å; D184-P245 HydrophobicContact CB-CB 4.03Å; D184-P245 WeakPolarHBondContact O-CA 3.48Å; D184-P245 WeakPolarHBondContact OD2-CB 3.4Å; D184-R246 WeakPolarHBondContact O-CB 3.33Å; D184-R246 PolarHBondContact O-N 2.9Å; D184-R246 PolarHBondContact OD2-N 3.35Å; D184-R246 VanDerWaalsContact OD2-N 3.16Å; D184-S247 WeakPolarHBondContact OD2-CB 3.39Å; D184-S247 PolarHBondContact OD2-N 3.42Å; D184-S247 PolarHBondContact OD2-OG 3.34Å
185	C	88.9	Confident	94	Very high	37 Å²	37	41.3 Å²	41.3	25%	0.25	25%	0.245	C	C	.	.			trans	-142.7	140	178.3	-160.3	0	0	0	0	110.9	T183 V191	T183-C185 VanDerWaalsContact C-N 3.28Å; T183-C185 PolarHBondContact O-N 3.21Å; C185-V191 HydrophobicContact CB-CG2 4.06Å
186	S	86	Confident	94.1	Very high	91 Å²	91	39.9 Å²	39.9	64%	0.636	23%	0.23	S	C	*	.			trans	-95.7	17.9	177.1	61.2	0	0	0	0	113.5
187	L	86.3	Confident	94.2	Very high	87 Å²	87	40 Å²	40	46%	0.455	23%	0.231	S	C	.	.			trans	-83.8	140.9	173.1	-67.6	175.2	0	0	0	110	T189 V191 V243	L187-T189 PolarHBondContact O-N 2.83Å; L187-V191 HydrophobicContact CD1-CG1 3.95Å; L187-V191 HydrophobicContact CD1-CG2 4.27Å; L187-V243 HydrophobicContact CD1-CG1 4.41Å
188	P	83.4	Confident	94.1	Very high	135 Å²	135	40.1 Å²	40.1	88%	0.877	24%	0.237	S	C	*	.	S	Bend	trans	-74.6	-9.4	176.5	32	-36.3	0	0	0	113
189	T	87.6	Confident	94	Very high	94 Å²	94	42.4 Å²	42.4	58%	0.577	25%	0.247	S	C	*	.	S	Bend	trans	-101.3	142.2	179.5	47.8	0	0	0	0	111.3	L187 V191	L187-T189 PolarHBondContact O-N 2.83Å; T189-V191 PolarHBondContact O-N 2.86Å
190	K	90	Very high	94	Very high	121 Å²	121	44 Å²	44	53%	0.526	26%	0.256	S	S	.	.			trans	-69.5	99.1	179.1	-166.8	176.3	-165.7	174	0	110.9	P181 F192 D228	P181-K190 HydrophobicContact CB-CG 4.39Å; K190-F192 HydrophobicContact CG-CE2 4.34Å; K190-D228 WeakPolarHBondContact CE-OD1 3.47Å; K190-D228 IonicContact NZ-OD1 2.69Å; K190-D228 PolarHBondContact NZ-OD1 3.13Å; K190-D228 IonicContact NZ-OD2 2.75Å; K190-D228 PolarHBondContact NZ-OD2 3.32Å
191	V	94.6	Very high	94	Very high	13 Å²	13	44 Å²	44	8%	0.079	26%	0.256	C	S	.	.			trans	-99.6	164	174.5	-67.7	0	0	0	0	111	P181 N182 C185 L187 T189 V243	P181-V191 WeakPolarHBondContact CA-O 3.37Å; N182-V191 HydrophobicContact CB-CG2 4.41Å; N182-V191 PolarHBondContact N-O 2.79Å; C185-V191 HydrophobicContact CB-CG2 4.06Å; L187-V191 HydrophobicContact CD1-CG1 3.95Å; L187-V191 HydrophobicContact CD1-CG2 4.27Å; T189-V191 PolarHBondContact O-N 2.86Å; V191-V243 HydrophobicContact CB-CB 4.04Å; V191-V243 HydrophobicContact CB-CG2 3.84Å; V191-V243 HydrophobicContact CG1-CG2 3.86Å; V191-V243 HydrophobicContact CG2-CB 3.99Å; V191-V243 HydrophobicContact CG2-CG1 4.39Å; V191-V243 HydrophobicContact CG2-CG2 4.21Å
192	F	97.2	Very high	94.1	Very high	5 Å²	5	42.8 Å²	42.8	2%	0.022	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	156.6	-171.2	-70.6	-106	0	0	0	111.3	V180 P181 K190 H230 W234 C235 K240 L242 V243	V180-F192 VanDerWaalsContact C-CD1 3.44Å; V180-F192 CarbonylContact O-C 3.51Å; V180-F192 VanDerWaalsContact O-CA 3.24Å; V180-F192 WeakPolarHBondContact O-CA 3.44Å; V180-F192 WeakPolarHBondContact O-CB 3.36Å; P181-F192 HydrophobicContact CG-CE1 4.08Å; K190-F192 HydrophobicContact CG-CE2 4.34Å; F192-H230 AromaticContact CE1-CD2 3.66Å; F192-H230 AromaticContact CE1-NE2 3.86Å; F192-W234 HydrophobicContact CD1-CZ3 4.21Å; F192-W234 HydrophobicContact CD2-CZ3 4.42Å; F192-W234 HydrophobicContact CE1-CH2 4.35Å; F192-W234 AromaticContact CE1-CZ3 3.91Å; F192-W234 HydrophobicContact CE1-CZ3 3.91Å; F192-W234 HydrophobicContact CE2-CH2 4.43Å; F192-W234 HydrophobicContact CE2-CZ3 4.15Å; F192-W234 HydrophobicContact CG-CZ3 4.48Å; F192-W234 HydrophobicContact CZ-CH2 4.03Å; F192-W234 AromaticContact CZ-CZ3 3.89Å; F192-W234 HydrophobicContact CZ-CZ3 3.89Å; F192-C235 VanDerWaalsContact CB-SG 3.51Å; F192-K240 HydrophobicContact CD2-CD 4.43Å; F192-K240 HydrophobicContact CE2-CD 4.2Å; F192-L242 HydrophobicContact CB-CD2 4.22Å; F192-L242 CarbonylContact O-C 2.96Å; F192-L242 WeakPolarHBondContact O-CA 3.31Å; F192-V243 PolarHBondContact O-N 2.8Å
193	W	97.9	Very high	94.2	Very high	3 Å²	3	42.2 Å²	42.2	1%	0.011	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	167.6	169.8	-166.2	-117.9	0	0	0	111.2	V180 N182 Y209 E210 L242 P244 P245 W255 L259	V180-W193 PolarHBondContact N-O 2.93Å; V180-W193 PolarHBondContact O-N 3.18Å; N182-W193 HydrophobicContact CB-CB 4.1Å; W193-Y209 HydrophobicContact CB-CD1 4.14Å; W193-Y209 HydrophobicContact CB-CE1 4.35Å; W193-Y209 AromaticContact CD1-CD1 3.85Å; W193-Y209 HydrophobicContact CG-CD1 4.41Å; W193-E210 PolarHBondContact NE1-O 3.13Å; W193-L242 HydrophobicContact CE3-CB 3.89Å; W193-L242 HydrophobicContact CZ3-CB 3.92Å; W193-P244 HydrophobicContact CE3-CG 4.45Å; W193-P244 HydrophobicContact CH2-CB 4.12Å; W193-P244 HydrophobicContact CH2-CG 3.69Å; W193-P244 HydrophobicContact CZ2-CB 4.29Å; W193-P244 HydrophobicContact CZ2-CG 4.34Å; W193-P244 HydrophobicContact CZ3-CB 4.27Å; W193-P244 HydrophobicContact CZ3-CG 3.75Å; W193-P245 VanDerWaalsContact CD1-CD 3.41Å; W193-P245 HydrophobicContact CG-CG 4.13Å; W193-W255 HydrophobicContact CH2-CB 4.48Å; W193-W255 HydrophobicContact CH2-CD2 4.05Å; W193-W255 AromaticContact CH2-CE3 3.56Å; W193-W255 HydrophobicContact CH2-CE3 3.56Å; W193-W255 HydrophobicContact CH2-CG 4.46Å; W193-W255 HydrophobicContact CH2-CZ3 4.13Å; W193-W255 HydrophobicContact CZ2-CD2 4.34Å; W193-W255 AromaticContact CZ2-CE3 3.47Å; W193-W255 HydrophobicContact CZ2-CE3 3.47Å; W193-W255 VanDerWaalsContact CZ2-CE3 3.47Å; W193-W255 AromaticContact CZ2-CZ3 3.57Å; W193-W255 HydrophobicContact CZ2-CZ3 3.57Å; W193-L259 HydrophobicContact CH2-CD1 3.79Å; W193-L259 HydrophobicContact CH2-CD2 4.25Å; W193-L259 HydrophobicContact CH2-CG 4.22Å; W193-L259 HydrophobicContact CZ2-CD1 4.43Å; W193-L259 HydrophobicContact CZ2-CD2 4.07Å; W193-L259 HydrophobicContact CZ2-CG 4.48Å; W193-L259 HydrophobicContact CZ3-CD1 4.16Å
194	I	98.2	Very high	94.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	134.9	173	-50.8	-55.3	0	0	0	109.4	R177 V178 E179 Y209 E210 V232 L242 L259 L263	R177-I194 HydrophobicContact CB-CG2 4.36Å; V178-I194 CarbonylContact O-C 3.04Å; V178-I194 WeakPolarHBondContact O-CA 3.26Å; E179-I194 HydrophobicContact CG-CD1 3.5Å; I194-Y209 WeakPolarHBondContact O-CA 3.48Å; I194-E210 HydrophobicContact CB-CB 4.09Å; I194-E210 HydrophobicContact CB-CG 4.12Å; I194-E210 HydrophobicContact CG2-CB 4.21Å; I194-E210 HydrophobicContact CG2-CG 3.67Å; I194-E210 PolarHBondContact O-N 2.93Å; I194-V232 HydrophobicContact CD1-CG1 4.2Å; I194-V232 HydrophobicContact CD1-CG2 4.36Å; I194-L242 HydrophobicContact CD1-CD1 3.83Å; I194-L242 HydrophobicContact CD1-CD2 4.25Å; I194-L242 HydrophobicContact CG1-CD1 4.23Å; I194-L259 HydrophobicContact CB-CD2 4.47Å; I194-L259 HydrophobicContact CG1-CD2 3.94Å; I194-L263 HydrophobicContact CG1-CD1 4.43Å; I194-L263 HydrophobicContact CG2-CD2 4.14Å
195	A	98.4	Very high	94.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	158.8	165.7	0	0	0	0	0	111.4	R177 V178 V180 L207 R208 Y209	R177-A195 WeakPolarHBondContact CA-O 3.5Å; V178-A195 HydrophobicContact CG2-CB 4.27Å; V178-A195 WeakPolarHBondContact CG2-O 3.3Å; V178-A195 PolarHBondContact N-O 2.78Å; V178-A195 PolarHBondContact O-N 3.43Å; V180-A195 HydrophobicContact CG2-CB 3.65Å; A195-L207 HydrophobicContact CB-CB 4.06Å; A195-L207 HydrophobicContact CB-CD1 4.14Å; A195-R208 CarbonylContact C-O 3.57Å; A195-R208 WeakPolarHBondContact CA-O 3.33Å; A195-R208 WeakPolarHBondContact CB-O 3.37Å; A195-Y209 HydrophobicContact CB-CD1 4.31Å
196	G	98.1	Very high	95	Very high	5 Å²	5	34.7 Å²	34.7	5%	0.052	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	143.3	170.1	0	0	0	0	0	111.8	V176 R177 V198 L207 R208	V176-G196 WeakPolarHBondContact O-CA 3.48Å; R177-G196 VanDerWaalsContact CD-CA 3.47Å; G196-V198 PolarHBondContact O-N 3.04Å; G196-L207 WeakPolarHBondContact O-CA 3.39Å; G196-R208 PolarHBondContact N-O 3.22Å; G196-R208 PolarHBondContact O-N 2.6Å
197	I	98.1	Very high	95.6	Very high	5 Å²	5	30.5 Å²	30.5	3%	0.026	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	115.7	171	-60.1	-178.9	0	0	0	108.9	I172 E174 G175 V176 L200 A205 L207	I172-I197 HydrophobicContact CG2-CD1 4.4Å; E174-I197 HydrophobicContact CG-CG2 4.29Å; G175-I197 PolarHBondContact N-O 2.72Å; V176-I197 HydrophobicContact CB-CD1 4.2Å; V176-I197 PolarHBondContact O-N 2.86Å; I197-L200 HydrophobicContact CG2-CB 4.46Å; I197-A205 HydrophobicContact CD1-CB 4.34Å; I197-A205 HydrophobicContact CG1-CB 4.19Å; I197-A205 HydrophobicContact CG2-CB 4.08Å; I197-L207 HydrophobicContact CB-CD2 4.34Å; I197-L207 HydrophobicContact CG1-CD2 3.67Å
198	V	97.1	Very high	96.2	Very high	58 Å²	58	28.6 Å²	28.6	35%	0.352	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-42.1	177.3	179.7	0	0	0	0	111.4	G196 L206 R208	G196-V198 PolarHBondContact O-N 3.04Å; V198-L206 HydrophobicContact CB-CG 4.4Å; V198-L206 HydrophobicContact CG1-CD2 4.44Å; V198-L206 PolarHBondContact N-O 2.82Å; V198-R208 HydrophobicContact CG2-CB 3.5Å; V198-R208 VanDerWaalsContact CG2-CB 3.5Å
199	K	96.8	Very high	96.9	Very high	50 Å²	50	22.3 Å²	22.3	22%	0.217	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	141.4	176.9	-175.8	176.1	177.8	179.8	0	109.7	F152 E174 A205 L206 W221	F152-K199 PolarHBondContact O-NZ 2.93Å; E174-K199 WeakPolarHBondContact OE1-CA 3.48Å; K199-A205 WeakPolarHBondContact O-CA 3.39Å; K199-L206 HydrophobicContact CB-CB 4.02Å; K199-L206 HydrophobicContact CB-CD2 4.33Å; K199-L206 PolarHBondContact O-N 3.29Å; K199-W221 HydrophobicContact CD-CH2 4.4Å; K199-W221 HydrophobicContact CG-CH2 4.47Å
200	L	97.3	Very high	97.3	Very high	38 Å²	38	18.1 Å²	18.1	20%	0.199	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	139.6	174.1	-164.8	67.1	0	0	0	111.7	W169 I172 E174 I197 A205 V224	W169-L200 HydrophobicContact CZ2-CD1 4.42Å; W169-L200 HydrophobicContact CZ2-CD2 4.46Å; I172-L200 HydrophobicContact CG2-CD1 4.29Å; I172-L200 HydrophobicContact CG2-CD2 3.98Å; E174-L200 HydrophobicContact CG-CB 4.44Å; E174-L200 PolarHBondContact OE1-N 2.89Å; I197-L200 HydrophobicContact CG2-CB 4.46Å; L200-A205 HydrophobicContact CD1-CB 3.99Å; L200-V224 HydrophobicContact CD1-CG2 4.15Å
201	A	98	Very high	97.6	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.008	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	95	-179.6	0	0	0	0	0	111.4	I147 A154 Y203 N204 W221 V547	I147-A201 HydrophobicContact CD1-CB 3.76Å; A154-A201 HydrophobicContact CB-CB 3.77Å; A201-Y203 PolarHBondContact O-N 3.23Å; A201-N204 CarbonylContact C-O 3.53Å; A201-N204 PolarHBondContact N-O 3.22Å; A201-N204 PolarHBondContact O-N 2.83Å; A201-W221 HydrophobicContact CB-CH2 3.93Å; A201-W221 HydrophobicContact CB-CZ3 3.94Å; A201-V547 WeakPolarHBondContact O-CG1 3.44Å
202	G	98.1	Very high	97.6	Very high	1 Å²	1	12.2 Å²	12.2	1%	0.01	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	-129.2	-168.9	0	0	0	0	0	110.4	V157 W169 N204 V547	V157-G202 VanDerWaalsContact CG2-C 3.44Å; V157-G202 WeakPolarHBondContact CG2-O 3.32Å; W169-G202 WeakPolarHBondContact CZ2-O 3.38Å; G202-N204 VanDerWaalsContact C-N 3.31Å; G202-V547 WeakPolarHBondContact CA-O 3.36Å
203	Y	98.4	Very high	97.4	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-17.4	171.3	-62	-73	0	0	0	113.4	V157 A163 P164 W169 A201 N223 V224 P546 V547 W549 L552	V157-Y203 HydrophobicContact CB-CE1 4.5Å; V157-Y203 HydrophobicContact CG1-CE1 3.79Å; V157-Y203 HydrophobicContact CG2-CD1 3.76Å; V157-Y203 HydrophobicContact CG2-CD2 4.43Å; V157-Y203 HydrophobicContact CG2-CE1 3.81Å; V157-Y203 HydrophobicContact CG2-CE2 4.48Å; V157-Y203 HydrophobicContact CG2-CG 4.08Å; A163-Y203 WeakPolarHBondContact CB-OH 3.38Å; P164-Y203 WeakPolarHBondContact CD-OH 3.46Å; P164-Y203 VanDerWaalsContact O-CE1 3.26Å; P164-Y203 WeakPolarHBondContact O-CE1 3.49Å; P164-Y203 PolarHBondContact O-OH 2.98Å; W169-Y203 AromaticContact CH2-CD1 3.76Å; W169-Y203 HydrophobicContact CH2-CD1 3.76Å; W169-Y203 HydrophobicContact CH2-CE1 4.49Å; W169-Y203 AromaticContact CZ3-CD1 3.88Å; W169-Y203 HydrophobicContact CZ3-CD1 3.88Å; W169-Y203 HydrophobicContact CZ3-CE1 4.2Å; A201-Y203 PolarHBondContact O-N 3.23Å; Y203-N223 WeakPolarHBondContact CB-ND2 3.31Å; Y203-V224 WeakPolarHBondContact O-CB 3.46Å; Y203-V224 WeakPolarHBondContact O-CG2 3.39Å; Y203-V224 PolarHBondContact O-N 2.98Å; Y203-P546 HydrophobicContact CD2-CB 3.9Å; Y203-P546 HydrophobicContact CD2-CG 4.22Å; Y203-P546 HydrophobicContact CE2-CB 3.69Å; Y203-P546 HydrophobicContact CE2-CG 3.48Å; Y203-P546 VanDerWaalsContact CE2-CG 3.48Å; Y203-V547 PolarHBondContact N-O 2.87Å; Y203-W549 HydrophobicContact CD2-CB 4.31Å; Y203-W549 HydrophobicContact CE2-CB 3.89Å; Y203-L552 HydrophobicContact CD1-CD2 3.96Å; Y203-L552 HydrophobicContact CD2-CD2 4.34Å; Y203-L552 HydrophobicContact CE1-CD2 3.85Å; Y203-L552 HydrophobicContact CE2-CD2 4.22Å; Y203-L552 HydrophobicContact CG-CD2 4.21Å
204	N	98.1	Very high	97.1	Very high	7 Å²	7	22 Å²	22	4%	0.037	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	132.6	-174.8	-70.3	-14.3	0	0	0	110.8	A201 G202 W221 C222 N223 Q551	A201-N204 CarbonylContact C-O 3.53Å; A201-N204 PolarHBondContact N-O 3.22Å; A201-N204 PolarHBondContact O-N 2.83Å; G202-N204 VanDerWaalsContact C-N 3.31Å; N204-W221 HydrophobicContact CB-CE3 3.98Å; N204-W221 HydrophobicContact CB-CZ3 4.13Å; N204-C222 CarbonylContact C-O 3.53Å; N204-C222 WeakPolarHBondContact CA-O 3.33Å; N204-N223 WeakPolarHBondContact OD1-CA 3.43Å; N204-N223 WeakPolarHBondContact OD1-CB 3.26Å; N204-N223 PolarHBondContact OD1-ND2 3.39Å; N204-Q551 PolarHBondContact OD1-OE1 3.35Å
205	A	97.8	Very high	96.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	140.1	173.1	0	0	0	0	0	110.6	I197 K199 L200 L207 W221 C222 V224	I197-A205 HydrophobicContact CD1-CB 4.34Å; I197-A205 HydrophobicContact CG1-CB 4.19Å; I197-A205 HydrophobicContact CG2-CB 4.08Å; K199-A205 WeakPolarHBondContact O-CA 3.39Å; L200-A205 HydrophobicContact CD1-CB 3.99Å; A205-L207 HydrophobicContact CB-CD2 4.07Å; A205-W221 WeakPolarHBondContact O-CA 3.13Å; A205-C222 PolarHBondContact N-O 3.26Å; A205-C222 PolarHBondContact O-N 2.75Å; A205-V224 HydrophobicContact CB-CG2 3.38Å
206	L	98	Very high	96.7	Very high	15 Å²	15	29.7 Å²	29.7	8%	0.079	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	118.2	162.8	-176.3	61.5	0	0	0	107.5	V198 K199 D219 W221	V198-L206 HydrophobicContact CB-CG 4.4Å; V198-L206 HydrophobicContact CG1-CD2 4.44Å; V198-L206 PolarHBondContact N-O 2.82Å; K199-L206 HydrophobicContact CB-CB 4.02Å; K199-L206 HydrophobicContact CB-CD2 4.33Å; K199-L206 PolarHBondContact O-N 3.29Å; L206-D219 HydrophobicContact CD1-CB 3.89Å; L206-D219 HydrophobicContact CG-CB 4.33Å; L206-W221 HydrophobicContact CB-CD2 4.08Å; L206-W221 HydrophobicContact CB-CE3 4.16Å; L206-W221 HydrophobicContact CB-CH2 4.11Å; L206-W221 HydrophobicContact CB-CZ2 4.03Å; L206-W221 HydrophobicContact CB-CZ3 4.16Å; L206-W221 HydrophobicContact CD1-CD2 4.19Å; L206-W221 HydrophobicContact CD1-CG 4.12Å
207	L	98.1	Very high	96.5	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	143.6	-179.1	-64.4	-168	0	0	0	111.5	V178 V180 A195 G196 I197 A205 D219 F220 C222	V178-L207 HydrophobicContact CG2-CD1 3.98Å; V178-L207 HydrophobicContact CG2-CD2 4.09Å; V180-L207 HydrophobicContact CB-CD1 4.37Å; V180-L207 HydrophobicContact CG1-CD1 3.7Å; V180-L207 HydrophobicContact CG2-CD1 4.15Å; A195-L207 HydrophobicContact CB-CB 4.06Å; A195-L207 HydrophobicContact CB-CD1 4.14Å; G196-L207 WeakPolarHBondContact O-CA 3.39Å; I197-L207 HydrophobicContact CB-CD2 4.34Å; I197-L207 HydrophobicContact CG1-CD2 3.67Å; A205-L207 HydrophobicContact CB-CD2 4.07Å; L207-D219 VanDerWaalsContact O-CA 3.31Å; L207-D219 WeakPolarHBondContact O-CA 3.37Å; L207-F220 HydrophobicContact CB-CD1 4.45Å; L207-F220 HydrophobicContact CB-CE1 4.05Å; L207-F220 HydrophobicContact CB-CE2 4.15Å; L207-F220 HydrophobicContact CB-CZ 3.91Å; L207-F220 HydrophobicContact CD1-CE2 3.99Å; L207-F220 HydrophobicContact CD1-CZ 4.01Å; L207-F220 PolarHBondContact N-O 2.91Å; L207-F220 PolarHBondContact O-N 3.35Å; L207-C222 WeakPolarHBondContact CD1-SG 3.47Å; L207-C222 VanDerWaalsContact CG-SG 3.59Å
208	R	98.3	Very high	96.4	Very high	47 Å²	47	35.3 Å²	35.3	18%	0.177	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.1	167.6	-177	172.9	-59.5	173.8	1.8	110.1	A195 G196 V198 F212 E213 N214 D215 D219	A195-R208 CarbonylContact C-O 3.57Å; A195-R208 WeakPolarHBondContact CA-O 3.33Å; A195-R208 WeakPolarHBondContact CB-O 3.37Å; G196-R208 PolarHBondContact N-O 3.22Å; G196-R208 PolarHBondContact O-N 2.6Å; V198-R208 HydrophobicContact CG2-CB 3.5Å; V198-R208 VanDerWaalsContact CG2-CB 3.5Å; R208-F212 HydrophobicContact CG-CB 3.96Å; R208-E213 VanDerWaalsContact CD-O 3.26Å; R208-E213 WeakPolarHBondContact CD-O 3.47Å; R208-E213 PolarHBondContact NH1-O 3.23Å; R208-N214 VanDerWaalsContact NH1-C 3.29Å; R208-N214 PolarHBondContact NH1-O 3.13Å; R208-D215 VanDerWaalsContact CD-O 3.31Å; R208-D215 WeakPolarHBondContact CD-O 3.38Å; R208-D215 PolarHBondContact NE-O 2.79Å; R208-D215 VanDerWaalsContact NE-O 3.1Å; R208-D219 VanDerWaalsContact CB-OD1 3.24Å; R208-D219 WeakPolarHBondContact CB-OD1 3.47Å; R208-D219 VanDerWaalsContact CG-OD1 3.25Å; R208-D219 WeakPolarHBondContact CG-OD1 3.49Å; R208-D219 IonicContact CZ-OD1 2.65Å; R208-D219 IonicContact CZ-OD2 2.66Å; R208-D219 IonicContact NE-OD1 3.92Å; R208-D219 PolarHBondContact NE-OD1 2.66Å; R208-D219 IonicContact NE-OD2 3.89Å; R208-D219 PolarHBondContact NE-OD2 3.04Å; R208-D219 IonicContact NH2-OD1 3.93Å; R208-D219 IonicContact NH2-OD2 3.31Å; R208-D219 PolarHBondContact NH2-OD2 3.01Å
209	Y	98.1	Very high	96.4	Very high	3 Å²	3	34.4 Å²	34.4	1%	0.012	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	139.7	175	-68.6	-59.9	0	0	0	111.8	V180 P181 T183 W193 I194 A195 G211 F212 F220 P245	V180-Y209 HydrophobicContact CG2-CE1 4.22Å; P181-Y209 PolarHBondContact O-OH 3.2Å; P181-Y209 VanDerWaalsContact O-OH 3.05Å; T183-Y209 PolarHBondContact N-OH 2.97Å; T183-Y209 PolarHBondContact OG1-OH 3.47Å; W193-Y209 HydrophobicContact CB-CD1 4.14Å; W193-Y209 HydrophobicContact CB-CE1 4.35Å; W193-Y209 AromaticContact CD1-CD1 3.85Å; W193-Y209 HydrophobicContact CG-CD1 4.41Å; I194-Y209 WeakPolarHBondContact O-CA 3.48Å; A195-Y209 HydrophobicContact CB-CD1 4.31Å; Y209-G211 PolarHBondContact O-N 3.13Å; Y209-F212 HydrophobicContact CD2-CE2 4.13Å; Y209-F212 HydrophobicContact CG-CE2 4.42Å; Y209-F212 PolarHBondContact O-N 3.26Å; Y209-F220 HydrophobicContact CD1-CE1 4.16Å; Y209-F220 HydrophobicContact CD2-CE1 4.09Å; Y209-F220 AromaticContact CE1-CE1 3.69Å; Y209-F220 HydrophobicContact CE1-CE1 3.69Å; Y209-F220 AromaticContact CE1-CZ 3.91Å; Y209-F220 HydrophobicContact CE1-CZ 3.91Å; Y209-F220 HydrophobicContact CE2-CD1 4.11Å; Y209-F220 AromaticContact CE2-CE1 3.6Å; Y209-F220 HydrophobicContact CE2-CE1 3.6Å; Y209-F220 HydrophobicContact CE2-CZ 4.49Å; Y209-F220 HydrophobicContact CG-CE1 4.35Å; Y209-F220 AromaticContact CZ-CE1 3.38Å; Y209-F220 AromaticContact CZ-CZ 3.84Å; Y209-P245 HydrophobicContact CD1-CG 4.14Å; Y209-P245 HydrophobicContact CD2-CB 4.44Å; Y209-P245 HydrophobicContact CD2-CG 3.88Å; Y209-P245 HydrophobicContact CE2-CG 4.4Å; Y209-P245 HydrophobicContact CG-CG 3.73Å
210	E	97.4	Very high	96.4	Very high	7 Å²	7	34.4 Å²	34.4	3%	0.033	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	131	175.8	-91.1	-63.9	167.8	0	0	111.4	R177 W193 I194 I248 F258 R262	R177-E210 IonicContact CZ-OE1 3.47Å; R177-E210 IonicContact NE-OE1 2.7Å; R177-E210 PolarHBondContact NE-OE1 3.1Å; R177-E210 IonicContact NH2-OE1 3.57Å; R177-E210 PolarHBondContact NH2-OE1 3.29Å; W193-E210 PolarHBondContact NE1-O 3.13Å; I194-E210 HydrophobicContact CB-CB 4.09Å; I194-E210 HydrophobicContact CB-CG 4.12Å; I194-E210 HydrophobicContact CG2-CB 4.21Å; I194-E210 HydrophobicContact CG2-CG 3.67Å; I194-E210 PolarHBondContact O-N 2.93Å; E210-I248 VanDerWaalsContact O-CD1 3.22Å; E210-I248 WeakPolarHBondContact O-CD1 3.43Å; E210-F258 HydrophobicContact CB-CE1 4.26Å; E210-R262 WeakPolarHBondContact OE2-CD 3.26Å; E210-R262 IonicContact OE2-NE 3.07Å
211	G	95.4	Very high	96.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	103	-11.3	-173.7	0	0	0	0	0	115.5	Y209 K251	Y209-G211 PolarHBondContact O-N 3.13Å; G211-K251 WeakPolarHBondContact O-CD 3.2Å; G211-K251 WeakPolarHBondContact O-CE 3.49Å; G211-K251 PolarHBondContact O-NZ 3.04Å
212	F	95.7	Very high	96.3	Very high	9 Å²	9	36.4 Å²	36.4	4%	0.039	20%	0.203	C	C	.	.			trans	-77.9	-23.8	170.8	-77.8	-98.6	0	0	0	113	R208 Y209 N214 D215 L218 P245 I248	R208-F212 HydrophobicContact CG-CB 3.96Å; Y209-F212 HydrophobicContact CD2-CE2 4.13Å; Y209-F212 HydrophobicContact CG-CE2 4.42Å; Y209-F212 PolarHBondContact O-N 3.26Å; F212-N214 PolarHBondContact O-N 3.3Å; F212-N214 VanDerWaalsContact O-N 3.16Å; F212-D215 HydrophobicContact CB-CB 4.32Å; F212-D215 HydrophobicContact CD1-CB 4.27Å; F212-D215 WeakPolarHBondContact O-CB 3.1Å; F212-D215 PolarHBondContact O-N 3.35Å; F212-D215 VanDerWaalsContact O-N 3.17Å; F212-L218 HydrophobicContact CE1-CB 4.15Å; F212-L218 HydrophobicContact CE1-CD1 3.97Å; F212-L218 HydrophobicContact CE1-CG 4.37Å; F212-L218 HydrophobicContact CZ-CB 4.25Å; F212-L218 HydrophobicContact CZ-CD1 3.77Å; F212-P245 HydrophobicContact CE2-CB 3.98Å; F212-P245 HydrophobicContact CE2-CG 4.13Å; F212-P245 HydrophobicContact CZ-CB 4.3Å; F212-I248 HydrophobicContact CD1-CG2 4.09Å; F212-I248 HydrophobicContact CD2-CD1 3.63Å; F212-I248 HydrophobicContact CD2-CG1 4.23Å; F212-I248 HydrophobicContact CD2-CG2 3.97Å; F212-I248 HydrophobicContact CE1-CG2 3.86Å; F212-I248 HydrophobicContact CE2-CB 4.34Å; F212-I248 HydrophobicContact CE2-CD1 3.52Å; F212-I248 HydrophobicContact CE2-CG1 3.68Å; F212-I248 HydrophobicContact CE2-CG2 3.75Å; F212-I248 HydrophobicContact CG-CG2 4.15Å; F212-I248 HydrophobicContact CZ-CD1 4.46Å; F212-I248 HydrophobicContact CZ-CG1 4.19Å; F212-I248 HydrophobicContact CZ-CG2 3.68Å
213	E	91.4	Very high	96.2	Very high	61 Å²	61	36.9 Å²	36.9	29%	0.285	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	-108.5	-180	-48.1	-65.5	163.5	0	0	111.8	R208 Y252 R262	R208-E213 VanDerWaalsContact CD-O 3.26Å; R208-E213 WeakPolarHBondContact CD-O 3.47Å; R208-E213 PolarHBondContact NH1-O 3.23Å; E213-Y252 PolarHBondContact OE1-OH 3.19Å; E213-R262 IonicContact OE1-CZ 2.66Å; E213-R262 VanDerWaalsContact OE1-CZ 3.31Å; E213-R262 IonicContact OE1-NE 3.36Å; E213-R262 IonicContact OE1-NH1 2.75Å; E213-R262 IonicContact OE1-NH2 3.18Å; E213-R262 PolarHBondContact OE1-NH2 2.64Å; E213-R262 IonicContact OE2-CZ 2.69Å; E213-R262 IonicContact OE2-NH1 3.11Å; E213-R262 PolarHBondContact OE2-NH1 3.07Å; E213-R262 IonicContact OE2-NH2 2.77Å; E213-R262 PolarHBondContact OE2-NH2 3.38Å
214	N	92.3	Very high	96.2	Very high	154 Å²	154	37 Å²	37	82%	0.824	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-12.8	-180	-66.1	-17.5	0	0	0	113.1	R208 F212 S216	R208-N214 VanDerWaalsContact NH1-C 3.29Å; R208-N214 PolarHBondContact NH1-O 3.13Å; F212-N214 PolarHBondContact O-N 3.3Å; F212-N214 VanDerWaalsContact O-N 3.16Å; N214-S216 PolarHBondContact O-N 3.26Å
215	D	94.6	Very high	96.1	Very high	88 Å²	88	37.1 Å²	37.1	47%	0.471	21%	0.207	S	C	.	.			trans	-70.1	123.4	179.6	-175.3	1.4	0	0	0	110.6	R208 F212 G217	R208-D215 VanDerWaalsContact CD-O 3.31Å; R208-D215 WeakPolarHBondContact CD-O 3.38Å; R208-D215 PolarHBondContact NE-O 2.79Å; R208-D215 VanDerWaalsContact NE-O 3.1Å; F212-D215 HydrophobicContact CB-CB 4.32Å; F212-D215 HydrophobicContact CD1-CB 4.27Å; F212-D215 WeakPolarHBondContact O-CB 3.1Å; F212-D215 PolarHBondContact O-N 3.35Å; F212-D215 VanDerWaalsContact O-N 3.17Å; D215-G217 PolarHBondContact OD1-N 3.12Å
216	S	94.1	Very high	95.9	Very high	73 Å²	73	38.5 Å²	38.5	51%	0.51	22%	0.221	S	C	.	.			trans	-102.1	5.8	178.4	67	0	0	0	0	113.4	N214 L218 D219	N214-S216 PolarHBondContact O-N 3.26Å; S216-L218 PolarHBondContact O-N 3.45Å; S216-L218 VanDerWaalsContact O-N 3.13Å; S216-D219 VanDerWaalsContact CB-OD2 3.3Å; S216-D219 WeakPolarHBondContact CB-OD2 3.34Å; S216-D219 PolarHBondContact O-N 2.83Å; S216-D219 VanDerWaalsContact O-N 3.09Å
217	G	94.1	Very high	95.5	Very high	58 Å²	58	43 Å²	43	60%	0.598	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.2	-172.2	0	0	0	0	0	115.1	D215	D215-G217 PolarHBondContact OD1-N 3.12Å
218	L	95.2	Very high	95.3	Very high	70 Å²	70	45.7 Å²	45.7	37%	0.366	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.8	33.6	172.4	-68.6	176.1	0	0	0	111.9	D184 F212 S216	D184-L218 HydrophobicContact CB-CD1 4.23Å; F212-L218 HydrophobicContact CE1-CB 4.15Å; F212-L218 HydrophobicContact CE1-CD1 3.97Å; F212-L218 HydrophobicContact CE1-CG 4.37Å; F212-L218 HydrophobicContact CZ-CB 4.25Å; F212-L218 HydrophobicContact CZ-CD1 3.77Å; S216-L218 PolarHBondContact O-N 3.45Å; S216-L218 VanDerWaalsContact O-N 3.13Å
219	D	97	Very high	95.2	Very high	38 Å²	38	44.2 Å²	44.2	20%	0.203	26%	0.264	C	S	.	.			trans	-70.4	135.7	165.5	-74.6	1.3	0	0	0	110	L206 L207 R208 S216	L206-D219 HydrophobicContact CD1-CB 3.89Å; L206-D219 HydrophobicContact CG-CB 4.33Å; L207-D219 VanDerWaalsContact O-CA 3.31Å; L207-D219 WeakPolarHBondContact O-CA 3.37Å; R208-D219 VanDerWaalsContact CB-OD1 3.24Å; R208-D219 WeakPolarHBondContact CB-OD1 3.47Å; R208-D219 VanDerWaalsContact CG-OD1 3.25Å; R208-D219 WeakPolarHBondContact CG-OD1 3.49Å; R208-D219 IonicContact CZ-OD1 2.65Å; R208-D219 IonicContact CZ-OD2 2.66Å; R208-D219 IonicContact NE-OD1 3.92Å; R208-D219 PolarHBondContact NE-OD1 2.66Å; R208-D219 IonicContact NE-OD2 3.89Å; R208-D219 PolarHBondContact NE-OD2 3.04Å; R208-D219 IonicContact NH2-OD1 3.93Å; R208-D219 IonicContact NH2-OD2 3.31Å; R208-D219 PolarHBondContact NH2-OD2 3.01Å; S216-D219 VanDerWaalsContact CB-OD2 3.3Å; S216-D219 WeakPolarHBondContact CB-OD2 3.34Å; S216-D219 PolarHBondContact O-N 2.83Å; S216-D219 VanDerWaalsContact O-N 3.09Å
220	F	96.9	Very high	95.1	Very high	51 Å²	51	45 Å²	45	22%	0.224	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	149.2	-177	64.8	-83.1	0	0	0	112.7	V180 L207 Y209	V180-F220 HydrophobicContact CG2-CZ 4Å; L207-F220 HydrophobicContact CB-CD1 4.45Å; L207-F220 HydrophobicContact CB-CE1 4.05Å; L207-F220 HydrophobicContact CB-CE2 4.15Å; L207-F220 HydrophobicContact CB-CZ 3.91Å; L207-F220 HydrophobicContact CD1-CE2 3.99Å; L207-F220 HydrophobicContact CD1-CZ 4.01Å; L207-F220 PolarHBondContact N-O 2.91Å; L207-F220 PolarHBondContact O-N 3.35Å; Y209-F220 HydrophobicContact CD1-CE1 4.16Å; Y209-F220 HydrophobicContact CD2-CE1 4.09Å; Y209-F220 AromaticContact CE1-CE1 3.69Å; Y209-F220 HydrophobicContact CE1-CE1 3.69Å; Y209-F220 AromaticContact CE1-CZ 3.91Å; Y209-F220 HydrophobicContact CE1-CZ 3.91Å; Y209-F220 HydrophobicContact CE2-CD1 4.11Å; Y209-F220 AromaticContact CE2-CE1 3.6Å; Y209-F220 HydrophobicContact CE2-CE1 3.6Å; Y209-F220 HydrophobicContact CE2-CZ 4.49Å; Y209-F220 HydrophobicContact CG-CE1 4.35Å; Y209-F220 AromaticContact CZ-CE1 3.38Å; Y209-F220 AromaticContact CZ-CZ 3.84Å
221	W	96.7	Very high	95.1	Very high	55 Å²	55	46 Å²	46	21%	0.208	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	137.4	177.3	-76.5	97.8	0	0	0	111.6	G144 I147 N148 K199 A201 N204 A205 L206	G144-W221 VanDerWaalsContact CA-CE2 3.42Å; G144-W221 PolarHBondContact O-NE1 2.9Å; I147-W221 HydrophobicContact CG2-CH2 4.16Å; I147-W221 HydrophobicContact CG2-CZ2 4.07Å; N148-W221 PolarHBondContact ND2-NE1 2.99Å; N148-W221 WeakPolarHBondContact OD1-CZ2 3.46Å; K199-W221 HydrophobicContact CD-CH2 4.4Å; K199-W221 HydrophobicContact CG-CH2 4.47Å; A201-W221 HydrophobicContact CB-CH2 3.93Å; A201-W221 HydrophobicContact CB-CZ3 3.94Å; N204-W221 HydrophobicContact CB-CE3 3.98Å; N204-W221 HydrophobicContact CB-CZ3 4.13Å; A205-W221 WeakPolarHBondContact O-CA 3.13Å; L206-W221 HydrophobicContact CB-CD2 4.08Å; L206-W221 HydrophobicContact CB-CE3 4.16Å; L206-W221 HydrophobicContact CB-CH2 4.11Å; L206-W221 HydrophobicContact CB-CZ2 4.03Å; L206-W221 HydrophobicContact CB-CZ3 4.16Å; L206-W221 HydrophobicContact CD1-CD2 4.19Å; L206-W221 HydrophobicContact CD1-CG 4.12Å
222	C	96.2	Very high	95.2	Very high	25 Å²	25	48.1 Å²	48.1	17%	0.169	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	156.2	170.7	64.5	0	0	0	0	111.5	N204 A205 L207 I229	N204-C222 CarbonylContact C-O 3.53Å; N204-C222 WeakPolarHBondContact CA-O 3.33Å; A205-C222 PolarHBondContact N-O 3.26Å; A205-C222 PolarHBondContact O-N 2.75Å; L207-C222 WeakPolarHBondContact CD1-SG 3.47Å; L207-C222 VanDerWaalsContact CG-SG 3.59Å; C222-I229 HydrophobicContact CB-CD1 4.13Å; C222-I229 VanDerWaalsContact SG-CD1 3.52Å
223	N	97.1	Very high	95.1	Very high	11 Å²	11	49.2 Å²	49.2	6%	0.059	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	120.1	170.6	-170.2	-68.4	0	0	0	109.7	Y203 N204 C225 G226 I229 G548	Y203-N223 WeakPolarHBondContact CB-ND2 3.31Å; N204-N223 WeakPolarHBondContact OD1-CA 3.43Å; N204-N223 WeakPolarHBondContact OD1-CB 3.26Å; N204-N223 PolarHBondContact OD1-ND2 3.39Å; N223-C225 PolarHBondContact O-N 2.91Å; N223-C225 WeakPolarHBondContact OD1-CB 3.45Å; N223-C225 PolarHBondContact OD1-N 3.4Å; N223-C225 VanDerWaalsContact OD1-N 3.12Å; N223-G226 PolarHBondContact O-N 3.12Å; N223-I229 WeakPolarHBondContact O-CD1 3.47Å; N223-G548 PolarHBondContact ND2-O 3.32Å
224	V	96.9	Very high	95.3	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.012	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-26.3	-174.3	178.8	0	0	0	0	112.7	W169 I172 L200 Y203 A205 G226 L269 F273	W169-V224 HydrophobicContact CH2-CB 4.1Å; W169-V224 HydrophobicContact CH2-CG1 4.28Å; I172-V224 HydrophobicContact CG2-CG1 4.28Å; L200-V224 HydrophobicContact CD1-CG2 4.15Å; Y203-V224 WeakPolarHBondContact O-CB 3.46Å; Y203-V224 WeakPolarHBondContact O-CG2 3.39Å; Y203-V224 PolarHBondContact O-N 2.98Å; A205-V224 HydrophobicContact CB-CG2 3.38Å; V224-G226 VanDerWaalsContact C-N 3.29Å; V224-L269 HydrophobicContact CG1-CD2 4.42Å; V224-F273 HydrophobicContact CG1-CE1 4.39Å; V224-F273 HydrophobicContact CG1-CZ 3.94Å; V224-F273 WeakPolarHBondContact O-CE1 3.31Å
225	C	96.7	Very high	95.5	Very high	10 Å²	10	42.1 Å²	42.1	7%	0.068	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	5.6	175.6	-65.3	0	0	0	0	113.5	N223 V277 L552	N223-C225 PolarHBondContact O-N 2.91Å; N223-C225 WeakPolarHBondContact OD1-CB 3.45Å; N223-C225 PolarHBondContact OD1-N 3.4Å; N223-C225 VanDerWaalsContact OD1-N 3.12Å; C225-V277 HydrophobicContact CB-CG1 3.92Å; C225-V277 HydrophobicContact CB-CG2 4.1Å; C225-L552 HydrophobicContact CB-CD1 3.5Å; C225-L552 VanDerWaalsContact CB-CD1 3.5Å; C225-L552 HydrophobicContact CB-CD2 3.83Å; C225-L552 HydrophobicContact CB-CG 4.31Å
226	G	93.1	Very high	95.4	Very high	29 Å²	29	42 Å²	42	30%	0.299	27%	0.271	S	S	.	.	S	Bend	trans	-66.9	147	176.2	0	0	0	0	0	113	N223 V224 D228 I229	N223-G226 PolarHBondContact O-N 3.12Å; V224-G226 VanDerWaalsContact C-N 3.29Å; G226-D228 PolarHBondContact O-N 3.26Å; G226-I229 PolarHBondContact O-N 3.27Å
227	S	91.3	Very high	95.5	Very high	109 Å²	109	44.7 Å²	44.7	76%	0.762	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-9.8	-174.5	52.6	0	0	0	0	116	H230	S227-H230 PolarHBondContact O-CE1 2.72Å
228	D	92.8	Very high	95.4	Very high	60 Å²	60	44.5 Å²	44.5	32%	0.321	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	0.2	-178.1	-81.1	-36.3	0	0	0	114.1	P181 K190 G226	P181-D228 HydrophobicContact CG-CB 3.72Å; K190-D228 WeakPolarHBondContact CE-OD1 3.47Å; K190-D228 IonicContact NZ-OD1 2.69Å; K190-D228 PolarHBondContact NZ-OD1 3.13Å; K190-D228 IonicContact NZ-OD2 2.75Å; K190-D228 PolarHBondContact NZ-OD2 3.32Å; G226-D228 PolarHBondContact O-N 3.26Å
229	I	95.6	Very high	95.3	Very high	16 Å²	16	44.5 Å²	44.5	8%	0.082	29%	0.292	C	S	.	.			trans	-107.1	127.5	-175.2	-55	-178.1	0	0	0	109.4	V178 V180 C222 N223 G226 L269	V178-I229 HydrophobicContact CB-CG2 4Å; V178-I229 HydrophobicContact CG1-CG2 3.84Å; V180-I229 HydrophobicContact CG1-CB 4.35Å; V180-I229 HydrophobicContact CG1-CG1 4Å; V180-I229 HydrophobicContact CG1-CG2 4.02Å; C222-I229 HydrophobicContact CB-CD1 4.13Å; C222-I229 VanDerWaalsContact SG-CD1 3.52Å; N223-I229 WeakPolarHBondContact O-CD1 3.47Å; G226-I229 PolarHBondContact O-N 3.27Å; I229-L269 HydrophobicContact CG2-CD1 3.96Å
230	H	96.5	Very high	95.1	Very high	19 Å²	19	47 Å²	47	9%	0.088	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-134.9	153.4	-167.2	-54.9	-48.6	0	0	0	112.4	E179 F192 S227 W234	E179-H230 HydrophobicContact CB-CB 4.14Å; E179-H230 PolarHBondContact N-O 2.94Å; E179-H230 PolarHBondContact O-N 3.38Å; F192-H230 AromaticContact CE1-CD2 3.66Å; F192-H230 AromaticContact CE1-NE2 3.86Å; S227-H230 PolarHBondContact O-CE1 2.72Å; H230-W234 HydrophobicContact CB-CB 3.78Å; H230-W234 HydrophobicContact CB-CD2 3.82Å; H230-W234 HydrophobicContact CB-CE3 3.96Å; H230-W234 HydrophobicContact CB-CG 3.76Å; H230-W234 AromaticContact CD2-CD2 3.58Å; H230-W234 AromaticContact CD2-CE2 3.82Å; H230-W234 AromaticContact CD2-CE3 3.25Å; H230-W234 AromaticContact CD2-CH2 3.38Å; H230-W234 WeakPolarHBondContact CD2-CH2 3.24Å; H230-W234 AromaticContact CD2-CZ2 3.75Å; H230-W234 AromaticContact CD2-CZ3 3.16Å; H230-W234 WeakPolarHBondContact CD2-CZ3 3.41Å; H230-W234 AromaticContact CE1-CZ2 3.81Å; H230-W234 AromaticContact CG-CD2 3.56Å; H230-W234 AromaticContact CG-CE2 3.87Å; H230-W234 AromaticContact CG-CE3 3.68Å; H230-W234 AromaticContact CG-CG 3.94Å; H230-W234 AromaticContact NE2-CE2 3.9Å; H230-W234 AromaticContact NE2-CE3 4Å; H230-W234 AromaticContact NE2-CH2 3.19Å; H230-W234 WeakPolarHBondContact NE2-CH2 3.43Å; H230-W234 AromaticContact NE2-CZ2 3.45Å; H230-W234 WeakPolarHBondContact NE2-CZ2 3.48Å; H230-W234 AromaticContact NE2-CZ3 3.54Å
231	P	97.3	Very high	94.9	Very high	28 Å²	28	48.5 Å²	48.5	18%	0.182	32%	0.316	C	S	.	.			trans	-65.6	147.6	170	28.8	-34.9	0	0	0	110.9	G233 W234 T268 L269	P231-G233 PolarHBondContact O-N 3.07Å; P231-W234 HydrophobicContact CG-CB 4.43Å; P231-W234 VanDerWaalsContact O-CB 3.3Å; P231-W234 WeakPolarHBondContact O-CB 3.19Å; P231-W234 PolarHBondContact O-N 3.47Å; P231-W234 VanDerWaalsContact O-N 3.1Å; P231-T268 WeakPolarHBondContact CA-OG1 3.45Å; P231-L269 HydrophobicContact CB-CB 4.16Å; P231-L269 WeakPolarHBondContact CB-O 3.46Å
232	V	97.1	Very high	94.9	Very high	45 Å²	45	48.6 Å²	48.6	27%	0.273	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	125.8	175.7	-179.1	0	0	0	0	110.1	R177 I194 L263 T268	R177-V232 HydrophobicContact CB-CG2 3.92Å; I194-V232 HydrophobicContact CD1-CG1 4.2Å; I194-V232 HydrophobicContact CD1-CG2 4.36Å; V232-L263 HydrophobicContact CG1-CD1 3.87Å; V232-L263 HydrophobicContact CG1-CD2 4.07Å; V232-L263 HydrophobicContact CG2-CD2 4.34Å; V232-T268 PolarHBondContact N-OG1 3.39Å
233	G	94.8	Very high	94.9	Very high	31 Å²	31	49 Å²	49	32%	0.32	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	108.5	-17.1	-173.5	0	0	0	0	0	114.2	E179 P231 C235 A236 T237	E179-G233 PolarHBondContact OE1-N 3.49Å; P231-G233 PolarHBondContact O-N 3.07Å; G233-C235 VanDerWaalsContact C-N 3.34Å; G233-C235 PolarHBondContact O-N 3.3Å; G233-A236 PolarHBondContact O-N 2.84Å; G233-T237 PolarHBondContact O-N 3.21Å; G233-T237 VanDerWaalsContact O-N 3.09Å; G233-T237 PolarHBondContact O-OG1 2.81Å
234	W	96.3	Very high	94.8	Very high	67 Å²	67	49.7 Å²	49.7	25%	0.254	33%	0.327	S	S	.	.	H	α-helix	trans	-60.5	-40.1	-178.5	171.9	89.8	0	0	0	113	E179 F192 H230 P231 A236 T237 S238 K240	E179-W234 PolarHBondContact OE2-N 3.27Å; F192-W234 HydrophobicContact CD1-CZ3 4.21Å; F192-W234 HydrophobicContact CD2-CZ3 4.42Å; F192-W234 HydrophobicContact CE1-CH2 4.35Å; F192-W234 AromaticContact CE1-CZ3 3.91Å; F192-W234 HydrophobicContact CE1-CZ3 3.91Å; F192-W234 HydrophobicContact CE2-CH2 4.43Å; F192-W234 HydrophobicContact CE2-CZ3 4.15Å; F192-W234 HydrophobicContact CG-CZ3 4.48Å; F192-W234 HydrophobicContact CZ-CH2 4.03Å; F192-W234 AromaticContact CZ-CZ3 3.89Å; F192-W234 HydrophobicContact CZ-CZ3 3.89Å; H230-W234 HydrophobicContact CB-CB 3.78Å; H230-W234 HydrophobicContact CB-CD2 3.82Å; H230-W234 HydrophobicContact CB-CE3 3.96Å; H230-W234 HydrophobicContact CB-CG 3.76Å; H230-W234 AromaticContact CD2-CD2 3.58Å; H230-W234 AromaticContact CD2-CE2 3.82Å; H230-W234 AromaticContact CD2-CE3 3.25Å; H230-W234 AromaticContact CD2-CH2 3.38Å; H230-W234 WeakPolarHBondContact CD2-CH2 3.24Å; H230-W234 AromaticContact CD2-CZ2 3.75Å; H230-W234 AromaticContact CD2-CZ3 3.16Å; H230-W234 WeakPolarHBondContact CD2-CZ3 3.41Å; H230-W234 AromaticContact CE1-CZ2 3.81Å; H230-W234 AromaticContact CG-CD2 3.56Å; H230-W234 AromaticContact CG-CE2 3.87Å; H230-W234 AromaticContact CG-CE3 3.68Å; H230-W234 AromaticContact CG-CG 3.94Å; H230-W234 AromaticContact NE2-CE2 3.9Å; H230-W234 AromaticContact NE2-CE3 4Å; H230-W234 AromaticContact NE2-CH2 3.19Å; H230-W234 WeakPolarHBondContact NE2-CH2 3.43Å; H230-W234 AromaticContact NE2-CZ2 3.45Å; H230-W234 WeakPolarHBondContact NE2-CZ2 3.48Å; H230-W234 AromaticContact NE2-CZ3 3.54Å; P231-W234 HydrophobicContact CG-CB 4.43Å; P231-W234 VanDerWaalsContact O-CB 3.3Å; P231-W234 WeakPolarHBondContact O-CB 3.19Å; P231-W234 PolarHBondContact O-N 3.47Å; P231-W234 VanDerWaalsContact O-N 3.1Å; W234-A236 VanDerWaalsContact C-N 3.35Å; W234-A236 PolarHBondContact O-N 3.19Å; W234-T237 PolarHBondContact O-N 2.84Å; W234-S238 PolarHBondContact NE1-OG 3.14Å; W234-S238 WeakPolarHBondContact O-CB 3.47Å; W234-S238 PolarHBondContact O-N 2.86Å; W234-S238 PolarHBondContact O-OG 3.03Å; W234-K240 HydrophobicContact CH2-CD 3.99Å; W234-K240 HydrophobicContact CZ3-CD 3.92Å
235	C	95.1	Very high	94.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-61.1	-43.6	176.2	-87.2	0	0	0	0	111.3	E179 F192 G233 S238 G239 K240 L242	E179-C235 VanDerWaalsContact OE2-CB 3.26Å; E179-C235 WeakPolarHBondContact OE2-CB 3.29Å; E179-C235 PolarHBondContact OE2-N 3.09Å; E179-C235 PolarHBondContact OE2-SG 3.05Å; F192-C235 VanDerWaalsContact CB-SG 3.51Å; G233-C235 VanDerWaalsContact C-N 3.34Å; G233-C235 PolarHBondContact O-N 3.3Å; C235-S238 CarbonylContact O-C 3.59Å; C235-S238 PolarHBondContact O-N 2.83Å; C235-G239 PolarHBondContact O-N 2.97Å; C235-K240 CarbonylContact C-O 3.59Å; C235-K240 HydrophobicContact CB-CB 4.19Å; C235-K240 WeakPolarHBondContact CB-O 3.49Å; C235-K240 PolarHBondContact O-N 3.14Å; C235-L242 HydrophobicContact CB-CD2 3.98Å; C235-L242 HydrophobicContact CB-CG 4.33Å
236	A	93.6	Very high	94.8	Very high	84 Å²	84	56.1 Å²	56.1	69%	0.694	35%	0.349	S	S	*	.	H	α-helix	trans	-62.9	-45.3	177.4	0	0	0	0	0	111.6	G233 W234 S238 G239	G233-A236 PolarHBondContact O-N 2.84Å; W234-A236 VanDerWaalsContact C-N 3.35Å; W234-A236 PolarHBondContact O-N 3.19Å; A236-S238 VanDerWaalsContact C-N 3.28Å; A236-S238 PolarHBondContact O-N 2.78Å; A236-G239 PolarHBondContact O-N 2.77Å
237	T	94.6	Very high	94.9	Very high	131 Å²	131	58.5 Å²	58.5	80%	0.804	36%	0.361	S	S	*	.	H	α-helix	trans	-64.5	-32.5	174.5	-55.8	0	0	0	0	112.4	G233 W234	G233-T237 PolarHBondContact O-N 3.21Å; G233-T237 VanDerWaalsContact O-N 3.09Å; G233-T237 PolarHBondContact O-OG1 2.81Å; W234-T237 PolarHBondContact O-N 2.84Å
238	S	92.7	Very high	95.1	Very high	53 Å²	53	53.8 Å²	53.8	37%	0.371	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	5.1	-179.4	-56.1	0	0	0	0	114.3	W234 C235 A236 K240	W234-S238 PolarHBondContact NE1-OG 3.14Å; W234-S238 WeakPolarHBondContact O-CB 3.47Å; W234-S238 PolarHBondContact O-N 2.86Å; W234-S238 PolarHBondContact O-OG 3.03Å; C235-S238 CarbonylContact O-C 3.59Å; C235-S238 PolarHBondContact O-N 2.83Å; A236-S238 VanDerWaalsContact C-N 3.28Å; A236-S238 PolarHBondContact O-N 2.78Å; S238-K240 PolarHBondContact O-N 3.4Å
239	G	93.2	Very high	95.2	Very high	71 Å²	71	54.7 Å²	54.7	73%	0.732	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	18.5	-177.7	0	0	0	0	0	115.2	C235 A236	C235-G239 PolarHBondContact O-N 2.97Å; A236-G239 PolarHBondContact O-N 2.77Å
240	K	93.2	Very high	95.2	Very high	89 Å²	89	61.6 Å²	61.6	39%	0.387	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-98.2	134.6	-178.4	-67.9	177.1	-177.9	170.6	0	111	F192 W234 C235 S238	F192-K240 HydrophobicContact CD2-CD 4.43Å; F192-K240 HydrophobicContact CE2-CD 4.2Å; W234-K240 HydrophobicContact CH2-CD 3.99Å; W234-K240 HydrophobicContact CZ3-CD 3.92Å; C235-K240 CarbonylContact C-O 3.59Å; C235-K240 HydrophobicContact CB-CB 4.19Å; C235-K240 WeakPolarHBondContact CB-O 3.49Å; C235-K240 PolarHBondContact O-N 3.14Å; S238-K240 PolarHBondContact O-N 3.4Å
241	P	92.4	Very high	95.1	Very high	84 Å²	84	65.5 Å²	65.5	55%	0.545	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-76.7	140.8	175.9	31.3	-34.1	0	0	0	111.5	V243	P241-V243 HydrophobicContact CB-CG2 4.39Å; P241-V243 HydrophobicContact CG-CG2 4.35Å
242	L	96.2	Very high	95	Very high	57 Å²	57	67.4 Å²	67.4	30%	0.298	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-79.2	123.6	162.3	-65.2	174.9	0	0	0	108.7	E179 F192 W193 I194 C235 L259	E179-L242 HydrophobicContact CG-CD2 4.02Å; F192-L242 HydrophobicContact CB-CD2 4.22Å; F192-L242 CarbonylContact O-C 2.96Å; F192-L242 WeakPolarHBondContact O-CA 3.31Å; W193-L242 HydrophobicContact CE3-CB 3.89Å; W193-L242 HydrophobicContact CZ3-CB 3.92Å; I194-L242 HydrophobicContact CD1-CD1 3.83Å; I194-L242 HydrophobicContact CD1-CD2 4.25Å; I194-L242 HydrophobicContact CG1-CD1 4.23Å; C235-L242 HydrophobicContact CB-CD2 3.98Å; C235-L242 HydrophobicContact CB-CG 4.33Å; L242-L259 HydrophobicContact CD1-CD1 4.4Å
243	V	96	Very high	94.8	Very high	33 Å²	33	72.4 Å²	72.4	20%	0.2	41%	0.413	C	S	.	.			trans	-117.7	121.1	-176.6	179.4	0	0	0	0	109.5	N182 L187 V191 F192 P241	N182-V243 PolarHBondContact ND2-O 3.12Å; L187-V243 HydrophobicContact CD1-CG1 4.41Å; V191-V243 HydrophobicContact CB-CB 4.04Å; V191-V243 HydrophobicContact CB-CG2 3.84Å; V191-V243 HydrophobicContact CG1-CG2 3.86Å; V191-V243 HydrophobicContact CG2-CB 3.99Å; V191-V243 HydrophobicContact CG2-CG1 4.39Å; V191-V243 HydrophobicContact CG2-CG2 4.21Å; F192-V243 PolarHBondContact O-N 2.8Å; P241-V243 HydrophobicContact CB-CG2 4.39Å; P241-V243 HydrophobicContact CG-CG2 4.35Å
244	P	96.2	Very high	94.8	Very high	26 Å²	26	75.4 Å²	75.4	17%	0.169	42%	0.422	C	S	.	.			trans	-58.9	143.8	179.4	-22.8	31.2	0	0	0	112.9	N182 W193 R246 Q249 W255	N182-P244 VanDerWaalsContact ND2-C 3.34Å; N182-P244 PolarHBondContact ND2-O 3.19Å; W193-P244 HydrophobicContact CE3-CG 4.45Å; W193-P244 HydrophobicContact CH2-CB 4.12Å; W193-P244 HydrophobicContact CH2-CG 3.69Å; W193-P244 HydrophobicContact CZ2-CB 4.29Å; W193-P244 HydrophobicContact CZ2-CG 4.34Å; W193-P244 HydrophobicContact CZ3-CB 4.27Å; W193-P244 HydrophobicContact CZ3-CG 3.75Å; P244-R246 PolarHBondContact O-N 3.16Å; P244-Q249 HydrophobicContact CB-CB 4.31Å; P244-W255 HydrophobicContact CB-CD2 4.24Å; P244-W255 HydrophobicContact CB-CH2 4.16Å; P244-W255 HydrophobicContact CB-CZ2 3.84Å; P244-W255 HydrophobicContact CG-CD2 3.72Å; P244-W255 HydrophobicContact CG-CE3 4.33Å; P244-W255 HydrophobicContact CG-CG 3.9Å; P244-W255 HydrophobicContact CG-CZ2 4.15Å
245	P	96.5	Very high	94.8	Very high	0 Å²	0	74.1 Å²	74.1	0%	0	42%	0.417	C	S	.	.			trans	-56.4	133.6	168.2	-26.1	34.9	0	0	0	111.3	N182 D184 W193 Y209 F212 S247 I248 Q249	N182-P245 WeakPolarHBondContact ND2-CA 3.18Å; D184-P245 HydrophobicContact CB-CB 4.03Å; D184-P245 WeakPolarHBondContact O-CA 3.48Å; D184-P245 WeakPolarHBondContact OD2-CB 3.4Å; W193-P245 VanDerWaalsContact CD1-CD 3.41Å; W193-P245 HydrophobicContact CG-CG 4.13Å; Y209-P245 HydrophobicContact CD1-CG 4.14Å; Y209-P245 HydrophobicContact CD2-CB 4.44Å; Y209-P245 HydrophobicContact CD2-CG 3.88Å; Y209-P245 HydrophobicContact CE2-CG 4.4Å; Y209-P245 HydrophobicContact CG-CG 3.73Å; F212-P245 HydrophobicContact CE2-CB 3.98Å; F212-P245 HydrophobicContact CE2-CG 4.13Å; F212-P245 HydrophobicContact CZ-CB 4.3Å; P245-S247 PolarHBondContact O-N 3.5Å; P245-S247 VanDerWaalsContact O-N 3.14Å; P245-I248 HydrophobicContact CB-CG1 4Å; P245-I248 HydrophobicContact CG-CD1 4.31Å; P245-I248 HydrophobicContact CG-CG1 4.3Å; P245-I248 CarbonylContact O-C 3.54Å; P245-I248 WeakPolarHBondContact O-CG1 3.36Å; P245-I248 PolarHBondContact O-N 2.95Å; P245-Q249 PolarHBondContact O-N 2.93Å
246	R	95.6	Very high	94.7	Very high	146 Å²	146	82.1 Å²	82.1	55%	0.551	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-35.1	-173.3	179.9	-177.5	175.7	170.5	0.2	112.2	D184 P244 I248 Q249	D184-R246 WeakPolarHBondContact O-CB 3.33Å; D184-R246 PolarHBondContact O-N 2.9Å; D184-R246 PolarHBondContact OD2-N 3.35Å; D184-R246 VanDerWaalsContact OD2-N 3.16Å; P244-R246 PolarHBondContact O-N 3.16Å; R246-I248 VanDerWaalsContact C-N 3.28Å; R246-I248 PolarHBondContact O-N 2.86Å; R246-Q249 WeakPolarHBondContact O-CG 3.44Å
247	S	95.6	Very high	94.8	Very high	79 Å²	79	80.6 Å²	80.6	55%	0.552	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-28.1	179.5	-54.2	0	0	0	0	113.4	D184 P245	D184-S247 WeakPolarHBondContact OD2-CB 3.39Å; D184-S247 PolarHBondContact OD2-N 3.42Å; D184-S247 PolarHBondContact OD2-OG 3.34Å; P245-S247 PolarHBondContact O-N 3.5Å; P245-S247 VanDerWaalsContact O-N 3.14Å
248	I	95.9	Very high	94.9	Very high	11 Å²	11	75.3 Å²	75.3	6%	0.056	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-3.5	178	58.9	166.3	0	0	0	114.1	E210 F212 P245 R246 H250 K251 W255	E210-I248 VanDerWaalsContact O-CD1 3.22Å; E210-I248 WeakPolarHBondContact O-CD1 3.43Å; F212-I248 HydrophobicContact CD1-CG2 4.09Å; F212-I248 HydrophobicContact CD2-CD1 3.63Å; F212-I248 HydrophobicContact CD2-CG1 4.23Å; F212-I248 HydrophobicContact CD2-CG2 3.97Å; F212-I248 HydrophobicContact CE1-CG2 3.86Å; F212-I248 HydrophobicContact CE2-CB 4.34Å; F212-I248 HydrophobicContact CE2-CD1 3.52Å; F212-I248 HydrophobicContact CE2-CG1 3.68Å; F212-I248 HydrophobicContact CE2-CG2 3.75Å; F212-I248 HydrophobicContact CG-CG2 4.15Å; F212-I248 HydrophobicContact CZ-CD1 4.46Å; F212-I248 HydrophobicContact CZ-CG1 4.19Å; F212-I248 HydrophobicContact CZ-CG2 3.68Å; P245-I248 HydrophobicContact CB-CG1 4Å; P245-I248 HydrophobicContact CG-CD1 4.31Å; P245-I248 HydrophobicContact CG-CG1 4.3Å; P245-I248 CarbonylContact O-C 3.54Å; P245-I248 WeakPolarHBondContact O-CG1 3.36Å; P245-I248 PolarHBondContact O-N 2.95Å; R246-I248 VanDerWaalsContact C-N 3.28Å; R246-I248 PolarHBondContact O-N 2.86Å; I248-H250 PolarHBondContact O-N 2.86Å; I248-K251 HydrophobicContact CB-CB 4.37Å; I248-K251 HydrophobicContact CB-CD 4.45Å; I248-K251 HydrophobicContact CG2-CD 4.3Å; I248-K251 WeakPolarHBondContact O-CB 3.33Å; I248-K251 PolarHBondContact O-N 3.01Å; I248-W255 HydrophobicContact CB-CH2 4.35Å; I248-W255 HydrophobicContact CD1-CH2 3.89Å; I248-W255 HydrophobicContact CD1-CZ3 4.34Å; I248-W255 HydrophobicContact CG1-CH2 4.04Å; I248-W255 WeakPolarHBondContact O-CZ2 3.46Å
249	Q	94.4	Very high	95.1	Very high	78 Å²	78	73.8 Å²	73.8	36%	0.364	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-29.1	-172.9	76.9	-171.9	-2.2	0	0	114.7	P244 P245 R246 W255	P244-Q249 HydrophobicContact CB-CB 4.31Å; P245-Q249 PolarHBondContact O-N 2.93Å; R246-Q249 WeakPolarHBondContact O-CG 3.44Å; Q249-W255 PolarHBondContact O-NE1 3.37Å
250	H	95.3	Very high	95.2	Very high	161 Å²	161	74.4 Å²	74.4	75%	0.745	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-9.7	178.9	-57.1	-64.8	0	0	0	114.5	I248 Y252	I248-H250 PolarHBondContact O-N 2.86Å; H250-Y252 VanDerWaalsContact C-N 3.31Å; H250-Y252 PolarHBondContact O-N 3.28Å
251	K	95.3	Very high	95.3	Very high	102 Å²	102	78.9 Å²	78.9	44%	0.443	40%	0.401	S	S	.	.	S	Bend	trans	-69.4	-26	-174.3	-169	173.8	178.8	174.6	0	113.2	G211 I248	G211-K251 WeakPolarHBondContact O-CD 3.2Å; G211-K251 WeakPolarHBondContact O-CE 3.49Å; G211-K251 PolarHBondContact O-NZ 3.04Å; I248-K251 HydrophobicContact CB-CB 4.37Å; I248-K251 HydrophobicContact CB-CD 4.45Å; I248-K251 HydrophobicContact CG2-CD 4.3Å; I248-K251 WeakPolarHBondContact O-CB 3.33Å; I248-K251 PolarHBondContact O-N 3.01Å
252	Y	94.6	Very high	95.4	Very high	67 Å²	67	79.3 Å²	79.3	26%	0.263	39%	0.392	S	S	.	.			trans	-137.1	135.3	176.5	-55.2	-77.6	0	0	0	110.6	E213 H250 W255 F258	E213-Y252 PolarHBondContact OE1-OH 3.19Å; H250-Y252 VanDerWaalsContact C-N 3.31Å; H250-Y252 PolarHBondContact O-N 3.28Å; Y252-W255 HydrophobicContact CD2-CE3 4.22Å; Y252-W255 AromaticContact CD2-CH2 3.57Å; Y252-W255 HydrophobicContact CD2-CH2 3.57Å; Y252-W255 HydrophobicContact CD2-CZ2 4.05Å; Y252-W255 AromaticContact CD2-CZ3 3.65Å; Y252-W255 HydrophobicContact CD2-CZ3 3.65Å; Y252-W255 HydrophobicContact CE2-CH2 4.31Å; Y252-W255 HydrophobicContact CE2-CZ3 4.32Å; Y252-W255 PolarHBondContact O-NE1 2.97Å; Y252-F258 HydrophobicContact CD1-CD2 4.04Å; Y252-F258 AromaticContact CD2-CD2 3.96Å; Y252-F258 HydrophobicContact CD2-CD2 3.96Å; Y252-F258 HydrophobicContact CD2-CE2 4.26Å; Y252-F258 HydrophobicContact CD2-CG 4.17Å; Y252-F258 AromaticContact CE1-CD2 3.77Å; Y252-F258 HydrophobicContact CE1-CD2 3.77Å; Y252-F258 HydrophobicContact CE1-CE2 4.13Å; Y252-F258 AromaticContact CE2-CD2 3.69Å; Y252-F258 HydrophobicContact CE2-CD2 3.69Å; Y252-F258 AromaticContact CE2-CE2 3.57Å; Y252-F258 HydrophobicContact CE2-CE2 3.57Å; Y252-F258 HydrophobicContact CE2-CG 4.3Å; Y252-F258 HydrophobicContact CE2-CZ 4.1Å; Y252-F258 HydrophobicContact CG-CB 4.43Å; Y252-F258 HydrophobicContact CG-CD2 4.13Å; Y252-F258 HydrophobicContact CG-CG 4.32Å; Y252-F258 AromaticContact CZ-CD2 3.61Å; Y252-F258 AromaticContact CZ-CE2 3.51Å
253	T	93.4	Very high	95.4	Very high	151 Å²	151	78.6 Å²	78.6	93%	0.926	39%	0.389	S	S	*	.	S	Bend	trans	-82.7	-26.3	175	51.6	0	0	0	0	112.9
254	N	95.3	Very high	95.3	Very high	93 Å²	93	82.5 Å²	82.5	50%	0.497	41%	0.412	S	S	.	.			trans	-122.1	81	-179.7	-172.3	-16	0	0	0	111	K256 A257 F258	N254-K256 PolarHBondContact O-N 2.98Å; N254-K256 PolarHBondContact OD1-N 3Å; N254-A257 HydrophobicContact CB-CB 4.23Å; N254-A257 PolarHBondContact O-N 3.24Å; N254-A257 PolarHBondContact OD1-N 3.03Å; N254-F258 PolarHBondContact O-N 2.91Å; N254-F258 VanDerWaalsContact O-N 3.11Å
255	W	95.5	Very high	95.2	Very high	41 Å²	41	85.1 Å²	85.1	16%	0.155	45%	0.445	C	S	.	.	H	α-helix	trans	-59.3	-30.8	177.3	-71.5	100.2	0	0	0	113.6	W193 P244 I248 Q249 Y252 F258 L259	W193-W255 HydrophobicContact CH2-CB 4.48Å; W193-W255 HydrophobicContact CH2-CD2 4.05Å; W193-W255 AromaticContact CH2-CE3 3.56Å; W193-W255 HydrophobicContact CH2-CE3 3.56Å; W193-W255 HydrophobicContact CH2-CG 4.46Å; W193-W255 HydrophobicContact CH2-CZ3 4.13Å; W193-W255 HydrophobicContact CZ2-CD2 4.34Å; W193-W255 AromaticContact CZ2-CE3 3.47Å; W193-W255 HydrophobicContact CZ2-CE3 3.47Å; W193-W255 VanDerWaalsContact CZ2-CE3 3.47Å; W193-W255 AromaticContact CZ2-CZ3 3.57Å; W193-W255 HydrophobicContact CZ2-CZ3 3.57Å; P244-W255 HydrophobicContact CB-CD2 4.24Å; P244-W255 HydrophobicContact CB-CH2 4.16Å; P244-W255 HydrophobicContact CB-CZ2 3.84Å; P244-W255 HydrophobicContact CG-CD2 3.72Å; P244-W255 HydrophobicContact CG-CE3 4.33Å; P244-W255 HydrophobicContact CG-CG 3.9Å; P244-W255 HydrophobicContact CG-CZ2 4.15Å; I248-W255 HydrophobicContact CB-CH2 4.35Å; I248-W255 HydrophobicContact CD1-CH2 3.89Å; I248-W255 HydrophobicContact CD1-CZ3 4.34Å; I248-W255 HydrophobicContact CG1-CH2 4.04Å; I248-W255 WeakPolarHBondContact O-CZ2 3.46Å; Q249-W255 PolarHBondContact O-NE1 3.37Å; Y252-W255 HydrophobicContact CD2-CE3 4.22Å; Y252-W255 AromaticContact CD2-CH2 3.57Å; Y252-W255 HydrophobicContact CD2-CH2 3.57Å; Y252-W255 HydrophobicContact CD2-CZ2 4.05Å; Y252-W255 AromaticContact CD2-CZ3 3.65Å; Y252-W255 HydrophobicContact CD2-CZ3 3.65Å; Y252-W255 HydrophobicContact CE2-CH2 4.31Å; Y252-W255 HydrophobicContact CE2-CZ3 4.32Å; Y252-W255 PolarHBondContact O-NE1 2.97Å; W255-F258 AromaticContact CE3-CD1 3.89Å; W255-F258 HydrophobicContact CE3-CD1 3.89Å; W255-F258 HydrophobicContact CE3-CE1 4.47Å; W255-F258 HydrophobicContact CE3-CG 4.48Å; W255-F258 HydrophobicContact CZ3-CD1 4.03Å; W255-F258 HydrophobicContact CZ3-CE1 4.19Å; W255-F258 PolarHBondContact O-N 2.65Å; W255-L259 WeakPolarHBondContact O-CB 3.46Å; W255-L259 WeakPolarHBondContact O-CG 3.49Å; W255-L259 PolarHBondContact O-N 3.3Å
256	K	93.9	Very high	95.2	Very high	167 Å²	167	87 Å²	87	73%	0.726	46%	0.46	S	S	*	.	H	α-helix	trans	-62.8	-47	175.3	-178	175.6	178.7	177	0	111.3	N254 V260	N254-K256 PolarHBondContact O-N 2.98Å; N254-K256 PolarHBondContact OD1-N 3Å; K256-V260 WeakPolarHBondContact O-CB 3.16Å; K256-V260 VanDerWaalsContact O-CG2 3.26Å; K256-V260 WeakPolarHBondContact O-CG2 3.45Å; K256-V260 PolarHBondContact O-N 2.79Å
257	A	95.4	Very high	95.3	Very high	53 Å²	53	86.5 Å²	86.5	44%	0.438	46%	0.462	S	S	.	.	H	α-helix	trans	-66.8	-38.5	177.3	0	0	0	0	0	112.4	N254 K261	N254-A257 HydrophobicContact CB-CB 4.23Å; N254-A257 PolarHBondContact O-N 3.24Å; N254-A257 PolarHBondContact OD1-N 3.03Å; A257-K261 WeakPolarHBondContact O-CB 3.38Å; A257-K261 PolarHBondContact O-N 2.89Å; A257-K261 VanDerWaalsContact O-N 3.11Å
258	F	96.4	Very high	95.4	Very high	19 Å²	19	85.4 Å²	85.4	8%	0.083	45%	0.452	C	S	.	.	H	α-helix	trans	-61	-52.4	173.9	172.6	-94.4	0	0	0	111.8	E210 Y252 N254 W255 V260 K261 R262	E210-F258 HydrophobicContact CB-CE1 4.26Å; Y252-F258 HydrophobicContact CD1-CD2 4.04Å; Y252-F258 AromaticContact CD2-CD2 3.96Å; Y252-F258 HydrophobicContact CD2-CD2 3.96Å; Y252-F258 HydrophobicContact CD2-CE2 4.26Å; Y252-F258 HydrophobicContact CD2-CG 4.17Å; Y252-F258 AromaticContact CE1-CD2 3.77Å; Y252-F258 HydrophobicContact CE1-CD2 3.77Å; Y252-F258 HydrophobicContact CE1-CE2 4.13Å; Y252-F258 AromaticContact CE2-CD2 3.69Å; Y252-F258 HydrophobicContact CE2-CD2 3.69Å; Y252-F258 AromaticContact CE2-CE2 3.57Å; Y252-F258 HydrophobicContact CE2-CE2 3.57Å; Y252-F258 HydrophobicContact CE2-CG 4.3Å; Y252-F258 HydrophobicContact CE2-CZ 4.1Å; Y252-F258 HydrophobicContact CG-CB 4.43Å; Y252-F258 HydrophobicContact CG-CD2 4.13Å; Y252-F258 HydrophobicContact CG-CG 4.32Å; Y252-F258 AromaticContact CZ-CD2 3.61Å; Y252-F258 AromaticContact CZ-CE2 3.51Å; N254-F258 PolarHBondContact O-N 2.91Å; N254-F258 VanDerWaalsContact O-N 3.11Å; W255-F258 AromaticContact CE3-CD1 3.89Å; W255-F258 HydrophobicContact CE3-CD1 3.89Å; W255-F258 HydrophobicContact CE3-CE1 4.47Å; W255-F258 HydrophobicContact CE3-CG 4.48Å; W255-F258 HydrophobicContact CZ3-CD1 4.03Å; W255-F258 HydrophobicContact CZ3-CE1 4.19Å; W255-F258 PolarHBondContact O-N 2.65Å; F258-V260 PolarHBondContact O-N 3.23Å; F258-K261 PolarHBondContact O-N 3.41Å; F258-R262 HydrophobicContact CD1-CG 4.39Å; F258-R262 HydrophobicContact CD2-CG 4.47Å; F258-R262 HydrophobicContact CE1-CG 3.91Å; F258-R262 HydrophobicContact CE2-CG 3.99Å; F258-R262 HydrophobicContact CZ-CG 3.66Å; F258-R262 WeakPolarHBondContact O-CG 3.19Å; F258-R262 PolarHBondContact O-N 3.17Å
259	L	96.3	Very high	95.4	Very high	22 Å²	22	85.1 Å²	85.1	12%	0.115	45%	0.451	C	S	.	.	H	α-helix	trans	-64.3	-40.9	-179	-72.5	178.4	0	0	0	112.1	W193 I194 L242 W255 K261 R262 L263	W193-L259 HydrophobicContact CH2-CD1 3.79Å; W193-L259 HydrophobicContact CH2-CD2 4.25Å; W193-L259 HydrophobicContact CH2-CG 4.22Å; W193-L259 HydrophobicContact CZ2-CD1 4.43Å; W193-L259 HydrophobicContact CZ2-CD2 4.07Å; W193-L259 HydrophobicContact CZ2-CG 4.48Å; W193-L259 HydrophobicContact CZ3-CD1 4.16Å; I194-L259 HydrophobicContact CB-CD2 4.47Å; I194-L259 HydrophobicContact CG1-CD2 3.94Å; L242-L259 HydrophobicContact CD1-CD1 4.4Å; W255-L259 WeakPolarHBondContact O-CB 3.46Å; W255-L259 WeakPolarHBondContact O-CG 3.49Å; W255-L259 PolarHBondContact O-N 3.3Å; L259-K261 VanDerWaalsContact C-N 3.35Å; L259-K261 PolarHBondContact O-N 2.97Å; L259-R262 PolarHBondContact O-N 2.91Å; L259-R262 VanDerWaalsContact O-N 3.15Å; L259-L263 HydrophobicContact CB-CD1 4.18Å; L259-L263 HydrophobicContact CD2-CD1 4.47Å; L259-L263 VanDerWaalsContact O-CB 3.24Å; L259-L263 WeakPolarHBondContact O-CB 3.46Å; L259-L263 VanDerWaalsContact O-CG 3.27Å; L259-L263 WeakPolarHBondContact O-CG 3.49Å; L259-L263 PolarHBondContact O-N 2.64Å
260	V	95.9	Very high	95.4	Very high	83 Å²	83	82.5 Å²	82.5	50%	0.503	44%	0.44	S	S	.	.	H	α-helix	trans	-56.6	-49.3	172.8	167.5	0	0	0	0	110.6	K256 F258 R262 L263 T264	K256-V260 WeakPolarHBondContact O-CB 3.16Å; K256-V260 VanDerWaalsContact O-CG2 3.26Å; K256-V260 WeakPolarHBondContact O-CG2 3.45Å; K256-V260 PolarHBondContact O-N 2.79Å; F258-V260 PolarHBondContact O-N 3.23Å; V260-R262 PolarHBondContact O-N 2.72Å; V260-L263 PolarHBondContact O-N 2.95Å; V260-T264 WeakPolarHBondContact O-CB 3.48Å; V260-T264 PolarHBondContact O-N 2.87Å; V260-T264 PolarHBondContact O-OG1 2.82Å; V260-T264 VanDerWaalsContact O-OG1 3.04Å
261	K	95.4	Very high	95.1	Very high	183 Å²	183	80.7 Å²	80.7	80%	0.796	44%	0.443	S	S	*	.	H	α-helix	trans	-61.5	-29.9	178.3	-174.4	178.8	177.3	-176.5	0	113.4	A257 F258 L259	A257-K261 WeakPolarHBondContact O-CB 3.38Å; A257-K261 PolarHBondContact O-N 2.89Å; A257-K261 VanDerWaalsContact O-N 3.11Å; F258-K261 PolarHBondContact O-N 3.41Å; L259-K261 VanDerWaalsContact C-N 3.35Å; L259-K261 PolarHBondContact O-N 2.97Å
262	R	94.1	Very high	95	Very high	93 Å²	93	78.7 Å²	78.7	35%	0.351	44%	0.437	S	S	.	.	H	α-helix	trans	-85.1	-32.3	179.5	-71.6	-72.7	168.5	171.1	-5.3	114.1	E210 E213 F258 L259 V260	E210-R262 WeakPolarHBondContact OE2-CD 3.26Å; E210-R262 IonicContact OE2-NE 3.07Å; E213-R262 IonicContact OE1-CZ 2.66Å; E213-R262 VanDerWaalsContact OE1-CZ 3.31Å; E213-R262 IonicContact OE1-NE 3.36Å; E213-R262 IonicContact OE1-NH1 2.75Å; E213-R262 IonicContact OE1-NH2 3.18Å; E213-R262 PolarHBondContact OE1-NH2 2.64Å; E213-R262 IonicContact OE2-CZ 2.69Å; E213-R262 IonicContact OE2-NH1 3.11Å; E213-R262 PolarHBondContact OE2-NH1 3.07Å; E213-R262 IonicContact OE2-NH2 2.77Å; E213-R262 PolarHBondContact OE2-NH2 3.38Å; F258-R262 HydrophobicContact CD1-CG 4.39Å; F258-R262 HydrophobicContact CD2-CG 4.47Å; F258-R262 HydrophobicContact CE1-CG 3.91Å; F258-R262 HydrophobicContact CE2-CG 3.99Å; F258-R262 HydrophobicContact CZ-CG 3.66Å; F258-R262 WeakPolarHBondContact O-CG 3.19Å; F258-R262 PolarHBondContact O-N 3.17Å; L259-R262 PolarHBondContact O-N 2.91Å; L259-R262 VanDerWaalsContact O-N 3.15Å; V260-R262 PolarHBondContact O-N 2.72Å
263	L	95.9	Very high	95	Very high	43 Å²	43	76 Å²	76	23%	0.225	43%	0.427	C	S	.	.	H	α-helix	trans	-99.5	-23.3	-169.9	-65.7	173.2	0	0	0	113.8	R177 I194 V232 L259 V260 G265 A266	R177-L263 HydrophobicContact CB-CD2 4.33Å; R177-L263 HydrophobicContact CG-CD2 4.32Å; I194-L263 HydrophobicContact CG1-CD1 4.43Å; I194-L263 HydrophobicContact CG2-CD2 4.14Å; V232-L263 HydrophobicContact CG1-CD1 3.87Å; V232-L263 HydrophobicContact CG1-CD2 4.07Å; V232-L263 HydrophobicContact CG2-CD2 4.34Å; L259-L263 HydrophobicContact CB-CD1 4.18Å; L259-L263 HydrophobicContact CD2-CD1 4.47Å; L259-L263 VanDerWaalsContact O-CB 3.24Å; L259-L263 WeakPolarHBondContact O-CB 3.46Å; L259-L263 VanDerWaalsContact O-CG 3.27Å; L259-L263 WeakPolarHBondContact O-CG 3.49Å; L259-L263 PolarHBondContact O-N 2.64Å; V260-L263 PolarHBondContact O-N 2.95Å; L263-G265 PolarHBondContact O-N 2.72Å; L263-A266 WeakPolarHBondContact O-CB 3.25Å; L263-A266 PolarHBondContact O-N 2.78Å
264	T	95.4	Very high	95.1	Very high	114 Å²	114	72.4 Å²	72.4	70%	0.699	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	110.5	175.8	-65.8	0	0	0	0	110.7	V260	V260-T264 WeakPolarHBondContact O-CB 3.48Å; V260-T264 PolarHBondContact O-N 2.87Å; V260-T264 PolarHBondContact O-OG1 2.82Å; V260-T264 VanDerWaalsContact O-OG1 3.04Å
265	G	94.1	Very high	95.1	Very high	82 Å²	82	73.5 Å²	73.5	85%	0.845	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	1.6	-177.5	0	0	0	0	0	115.3	L263	L263-G265 PolarHBondContact O-N 2.72Å
266	A	95.7	Very high	95.1	Very high	40 Å²	40	74.5 Å²	74.5	33%	0.331	42%	0.415	S	S	.	.			trans	-74.5	146.5	174.3	0	0	0	0	0	111.6	R177 L263	R177-A266 HydrophobicContact CG-CB 4.16Å; L263-A266 WeakPolarHBondContact O-CB 3.25Å; L263-A266 PolarHBondContact O-N 2.78Å
267	K	97	Very high	95.2	Very high	134 Å²	134	67.3 Å²	67.3	58%	0.583	39%	0.385	S	S	*	.			trans	-75	143.7	170.3	-68.7	-171.3	176.5	-171.4	0	110.8	V176 R177	V176-K267 HydrophobicContact CG2-CB 4.05Å; V176-K267 HydrophobicContact CG2-CD 4.47Å; R177-K267 PolarHBondContact N-O 3.36Å
268	T	97.8	Very high	95.2	Very high	57 Å²	57	68.1 Å²	68.1	35%	0.35	39%	0.388	S	S	.	.	B	Isolated β-bridge	trans	-128.3	167.8	171.1	172.8	0	0	0	0	109.2	R177 P231 V232	R177-T268 WeakPolarHBondContact O-CA 3.44Å; P231-T268 WeakPolarHBondContact CA-OG1 3.45Å; V232-T268 PolarHBondContact N-OG1 3.39Å
269	L	96.1	Very high	95.2	Very high	4 Å²	4	71.8 Å²	71.8	2%	0.021	41%	0.406	C	S	.	.			trans	-54.2	147.5	166.9	-62.8	173.4	0	0	0	111.3	I172 V176 V178 V224 I229 P231 F273	I172-L269 HydrophobicContact CD1-CD2 3.36Å; V176-L269 HydrophobicContact CG1-CD2 4.48Å; V178-L269 HydrophobicContact CG1-CD1 3.66Å; V178-L269 HydrophobicContact CG1-CD2 4.38Å; V178-L269 HydrophobicContact CG1-CG 3.75Å; V224-L269 HydrophobicContact CG1-CD2 4.42Å; I229-L269 HydrophobicContact CG2-CD1 3.96Å; P231-L269 HydrophobicContact CB-CB 4.16Å; P231-L269 WeakPolarHBondContact CB-O 3.46Å; L269-F273 HydrophobicContact CB-CB 4.31Å; L269-F273 HydrophobicContact CB-CG 4.4Å; L269-F273 HydrophobicContact CD1-CD1 3.96Å; L269-F273 HydrophobicContact CD1-CE1 4.23Å; L269-F273 HydrophobicContact CD2-CD1 4.37Å; L269-F273 HydrophobicContact CD2-CD2 4.36Å; L269-F273 HydrophobicContact CD2-CE1 4.41Å; L269-F273 HydrophobicContact CD2-CE2 4.41Å; L269-F273 HydrophobicContact CD2-CG 4.34Å; L269-F273 HydrophobicContact CD2-CZ 4.45Å
270	P	94.3	Very high	95.2	Very high	23 Å²	23	72.5 Å²	72.5	15%	0.149	41%	0.412	C	S	.	.			trans	-55.6	148.2	168.4	-26.5	35.4	0	0	0	112.7	D171 D272 F273	D171-P270 HydrophobicContact CB-CG 3.97Å; P270-D272 VanDerWaalsContact CB-OD1 3.31Å; P270-D272 WeakPolarHBondContact CB-OD1 3.36Å; P270-D272 PolarHBondContact O-N 3.18Å; P270-F273 HydrophobicContact CB-CB 4.36Å; P270-F273 WeakPolarHBondContact O-CB 3.45Å; P270-F273 PolarHBondContact O-N 3.47Å; P270-F273 VanDerWaalsContact O-N 3.13Å
271	P	89.9	Confident	95.1	Very high	123 Å²	123	71.1 Å²	71.1	80%	0.799	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-23.6	-179.5	28.6	-35.5	0	0	0	113.1
272	D	93.3	Very high	95.1	Very high	60 Å²	60	68.8 Å²	68.8	32%	0.321	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	7.7	177.2	65.9	-5.7	0	0	0	113.3	P270 S274 Q275 K276	P270-D272 VanDerWaalsContact CB-OD1 3.31Å; P270-D272 WeakPolarHBondContact CB-OD1 3.36Å; P270-D272 PolarHBondContact O-N 3.18Å; D272-S274 PolarHBondContact O-N 3.01Å; D272-Q275 WeakPolarHBondContact O-CB 3.46Å; D272-Q275 PolarHBondContact O-N 3.08Å; D272-K276 PolarHBondContact O-N 2.62Å; D272-K276 IonicContact OD1-NZ 2.75Å; D272-K276 PolarHBondContact OD1-NZ 3.15Å; D272-K276 WeakPolarHBondContact OD2-CE 3.45Å; D272-K276 IonicContact OD2-NZ 3.93Å; D272-K276 PolarHBondContact OD2-NZ 2.76Å
273	F	95	Very high	95.2	Very high	10 Å²	10	65.9 Å²	65.9	4%	0.044	38%	0.382	C	S	.	.	H	α-helix	trans	-58.8	-47.1	-175.1	178.3	-98	0	0	0	112.9	M165 I172 V224 L269 P270 Q275 K276 V277	M165-F273 HydrophobicContact CE-CD2 3.63Å; M165-F273 HydrophobicContact CE-CE2 3.54Å; M165-F273 HydrophobicContact CE-CZ 4.42Å; I172-F273 HydrophobicContact CD1-CD2 3.99Å; I172-F273 HydrophobicContact CD1-CE2 3.59Å; I172-F273 HydrophobicContact CD1-CZ 4.33Å; I172-F273 HydrophobicContact CG1-CE2 4.14Å; V224-F273 HydrophobicContact CG1-CE1 4.39Å; V224-F273 HydrophobicContact CG1-CZ 3.94Å; V224-F273 WeakPolarHBondContact O-CE1 3.31Å; L269-F273 HydrophobicContact CB-CB 4.31Å; L269-F273 HydrophobicContact CB-CG 4.4Å; L269-F273 HydrophobicContact CD1-CD1 3.96Å; L269-F273 HydrophobicContact CD1-CE1 4.23Å; L269-F273 HydrophobicContact CD2-CD1 4.37Å; L269-F273 HydrophobicContact CD2-CD2 4.36Å; L269-F273 HydrophobicContact CD2-CE1 4.41Å; L269-F273 HydrophobicContact CD2-CE2 4.41Å; L269-F273 HydrophobicContact CD2-CG 4.34Å; L269-F273 HydrophobicContact CD2-CZ 4.45Å; P270-F273 HydrophobicContact CB-CB 4.36Å; P270-F273 WeakPolarHBondContact O-CB 3.45Å; P270-F273 PolarHBondContact O-N 3.47Å; P270-F273 VanDerWaalsContact O-N 3.13Å; F273-Q275 VanDerWaalsContact C-N 3.32Å; F273-Q275 PolarHBondContact O-N 2.72Å; F273-K276 PolarHBondContact O-N 3.27Å; F273-V277 HydrophobicContact CD1-CG2 4.22Å; F273-V277 HydrophobicContact CE1-CG2 3.78Å; F273-V277 HydrophobicContact CE2-CG2 4.26Å; F273-V277 HydrophobicContact CZ-CG2 3.79Å; F273-V277 WeakPolarHBondContact O-CG2 3.31Å; F273-V277 PolarHBondContact O-N 2.87Å
274	S	93.8	Very high	95.3	Very high	77 Å²	77	66.4 Å²	66.4	54%	0.538	39%	0.388	S	S	.	.	H	α-helix	trans	-67.2	-32	179.5	53.1	0	0	0	0	113	D272 S278	D272-S274 PolarHBondContact O-N 3.01Å; S274-S278 WeakPolarHBondContact O-CB 3.42Å; S274-S278 PolarHBondContact O-N 2.94Å; S274-S278 VanDerWaalsContact O-N 3.08Å
275	Q	95.1	Very high	95.4	Very high	115 Å²	115	61.1 Å²	61.1	54%	0.537	36%	0.355	S	S	.	.	H	α-helix	trans	-65.6	-51.5	171.7	175.4	176.4	-13.6	0	0	110.4	D272 F273 V277 S278 E279	D272-Q275 WeakPolarHBondContact O-CB 3.46Å; D272-Q275 PolarHBondContact O-N 3.08Å; F273-Q275 VanDerWaalsContact C-N 3.32Å; F273-Q275 PolarHBondContact O-N 2.72Å; Q275-V277 VanDerWaalsContact C-N 3.3Å; Q275-V277 PolarHBondContact O-N 2.68Å; Q275-S278 WeakPolarHBondContact O-CB 3.12Å; Q275-S278 PolarHBondContact O-N 3.32Å; Q275-S278 VanDerWaalsContact O-N 3.08Å; Q275-E279 HydrophobicContact CG-CG 4.29Å; Q275-E279 VanDerWaalsContact CG-OE1 3.27Å; Q275-E279 WeakPolarHBondContact CG-OE1 3.1Å; Q275-E279 PolarHBondContact NE2-OE1 3.05Å; Q275-E279 WeakPolarHBondContact O-CG 3.15Å; Q275-E279 PolarHBondContact O-N 2.87Å
276	K	96.1	Very high	95.5	Very high	62 Å²	62	62.3 Å²	62.3	27%	0.27	34%	0.338	S	S	.	.	H	α-helix	trans	-58.2	-39.7	177.2	-74.9	167.5	170.2	155.4	0	112.6	M165 D272 F273 S280	M165-K276 HydrophobicContact CE-CB 3.76Å; M165-K276 HydrophobicContact SD-CB 3.64Å; D272-K276 PolarHBondContact O-N 2.62Å; D272-K276 IonicContact OD1-NZ 2.75Å; D272-K276 PolarHBondContact OD1-NZ 3.15Å; D272-K276 WeakPolarHBondContact OD2-CE 3.45Å; D272-K276 IonicContact OD2-NZ 3.93Å; D272-K276 PolarHBondContact OD2-NZ 2.76Å; F273-K276 PolarHBondContact O-N 3.27Å; K276-S280 VanDerWaalsContact O-CB 3.28Å; K276-S280 WeakPolarHBondContact O-CB 3.41Å; K276-S280 PolarHBondContact O-N 3.22Å; K276-S280 PolarHBondContact O-OG 2.95Å
277	V	96.3	Very high	95.6	Very high	16 Å²	16	64.1 Å²	64.1	10%	0.097	34%	0.344	C	S	.	.	H	α-helix	trans	-59.3	-52.2	173.2	169.6	0	0	0	0	110	M165 C225 F273 Q275 E279 S280 M281	M165-V277 HydrophobicContact CE-CG2 4.04Å; M165-V277 HydrophobicContact CG-CG2 3.79Å; M165-V277 HydrophobicContact SD-CB 4.48Å; M165-V277 HydrophobicContact SD-CG2 3.9Å; M165-V277 PolarHBondContact SD-N 2.96Å; C225-V277 HydrophobicContact CB-CG1 3.92Å; C225-V277 HydrophobicContact CB-CG2 4.1Å; F273-V277 HydrophobicContact CD1-CG2 4.22Å; F273-V277 HydrophobicContact CE1-CG2 3.78Å; F273-V277 HydrophobicContact CE2-CG2 4.26Å; F273-V277 HydrophobicContact CZ-CG2 3.79Å; F273-V277 WeakPolarHBondContact O-CG2 3.31Å; F273-V277 PolarHBondContact O-N 2.87Å; Q275-V277 VanDerWaalsContact C-N 3.3Å; Q275-V277 PolarHBondContact O-N 2.68Å; V277-E279 PolarHBondContact O-N 2.89Å; V277-S280 PolarHBondContact O-N 3Å; V277-S280 PolarHBondContact O-OG 3.3Å; V277-M281 VanDerWaalsContact O-CG 3.29Å; V277-M281 WeakPolarHBondContact O-CG 3.39Å; V277-M281 PolarHBondContact O-N 3.39Å
278	S	95.9	Very high	95.5	Very high	71 Å²	71	59.7 Å²	59.7	50%	0.497	33%	0.331	S	S	.	.	H	α-helix	trans	-58.3	-45.9	178.7	-174.1	0	0	0	0	112.7	S274 Q275 M281	S274-S278 WeakPolarHBondContact O-CB 3.42Å; S274-S278 PolarHBondContact O-N 2.94Å; S274-S278 VanDerWaalsContact O-N 3.08Å; Q275-S278 WeakPolarHBondContact O-CB 3.12Å; Q275-S278 PolarHBondContact O-N 3.32Å; Q275-S278 VanDerWaalsContact O-N 3.08Å; S278-M281 PolarHBondContact O-N 2.85Å
279	E	96.1	Very high	95.5	Very high	96 Å²	96	57.6 Å²	57.6	45%	0.449	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-44.5	176.2	-71.5	170	173.5	0	0	111.9	Q275 V277 M281 Q282	Q275-E279 HydrophobicContact CG-CG 4.29Å; Q275-E279 VanDerWaalsContact CG-OE1 3.27Å; Q275-E279 WeakPolarHBondContact CG-OE1 3.1Å; Q275-E279 PolarHBondContact NE2-OE1 3.05Å; Q275-E279 WeakPolarHBondContact O-CG 3.15Å; Q275-E279 PolarHBondContact O-N 2.87Å; V277-E279 PolarHBondContact O-N 2.89Å; E279-M281 PolarHBondContact O-N 2.77Å; E279-M281 VanDerWaalsContact O-N 3.13Å; E279-Q282 WeakPolarHBondContact O-CB 2.98Å; E279-Q282 PolarHBondContact O-N 2.92Å
280	S	96	Very high	95.6	Very high	37 Å²	37	58 Å²	58	26%	0.259	32%	0.318	S	S	.	.	H	α-helix	trans	-68.1	-10.4	179.1	75.2	0	0	0	0	114.5	M165 K276 V277	M165-S280 PolarHBondContact N-OG 3.23Å; K276-S280 VanDerWaalsContact O-CB 3.28Å; K276-S280 WeakPolarHBondContact O-CB 3.41Å; K276-S280 PolarHBondContact O-N 3.22Å; K276-S280 PolarHBondContact O-OG 2.95Å; V277-S280 PolarHBondContact O-N 3Å; V277-S280 PolarHBondContact O-OG 3.3Å
281	M	94.8	Very high	95.7	Very high	53 Å²	53	57 Å²	57	26%	0.261	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	5.7	174.2	-64.6	-75.5	-74.7	0	0	112.8	P164 V277 S278 E279 Y283 L552 T553	P164-M281 HydrophobicContact CB-SD 3.9Å; P164-M281 HydrophobicContact CG-SD 3.61Å; V277-M281 VanDerWaalsContact O-CG 3.29Å; V277-M281 WeakPolarHBondContact O-CG 3.39Å; V277-M281 PolarHBondContact O-N 3.39Å; S278-M281 PolarHBondContact O-N 2.85Å; E279-M281 PolarHBondContact O-N 2.77Å; E279-M281 VanDerWaalsContact O-N 3.13Å; M281-Y283 WeakPolarHBondContact O-CD2 3.13Å; M281-Y283 WeakPolarHBondContact O-CE2 3.01Å; M281-Y283 PolarHBondContact O-N 3.34Å; M281-Y283 PolarHBondContact SD-OH 3.22Å; M281-L552 HydrophobicContact CE-CD1 4.5Å; M281-L552 HydrophobicContact CE-CG 4.25Å; M281-L552 WeakPolarHBondContact CE-O 3.32Å; M281-L552 HydrophobicContact SD-CD2 4.44Å; M281-L552 HydrophobicContact SD-CG 4.2Å; M281-T553 HydrophobicContact CE-CG2 4.19Å; M281-T553 HydrophobicContact SD-CG2 4.43Å
282	Q	95.1	Very high	96.1	Very high	135 Å²	135	51.9 Å²	51.9	63%	0.631	28%	0.277	S	S	*	.			trans	-93.4	95.8	178.5	-65.8	178.6	40.5	0	0	111.9	E279	E279-Q282 WeakPolarHBondContact O-CB 2.98Å; E279-Q282 PolarHBondContact O-N 2.92Å
283	Y	96.3	Very high	96.3	Very high	32 Å²	32	49 Å²	49	13%	0.125	26%	0.262	C	S	.	.			trans	-80.3	132.8	178.9	-49	-65.4	0	0	0	111.3	M281 K286 V310 G312 G313 M333	M281-Y283 WeakPolarHBondContact O-CD2 3.13Å; M281-Y283 WeakPolarHBondContact O-CE2 3.01Å; M281-Y283 PolarHBondContact O-N 3.34Å; M281-Y283 PolarHBondContact SD-OH 3.22Å; Y283-K286 PolarHBondContact O-NZ 2.84Å; Y283-V310 HydrophobicContact CD2-CG1 4.14Å; Y283-V310 HydrophobicContact CG-CG1 4.11Å; Y283-G312 WeakPolarHBondContact OH-CA 3.34Å; Y283-G313 VanDerWaalsContact CE1-N 3.28Å; Y283-M333 HydrophobicContact CD1-CE 3.74Å; Y283-M333 HydrophobicContact CD1-SD 4.01Å; Y283-M333 HydrophobicContact CE1-CE 4.3Å
284	P	96.8	Very high	96.3	Very high	54 Å²	54	49.6 Å²	49.6	35%	0.351	27%	0.266	S	S	.	.	S	Bend	trans	-80.2	-31	-173.7	31.6	-36.1	0	0	0	113.2	K286 L370	P284-K286 WeakPolarHBondContact O-CE 3.39Å; P284-L370 HydrophobicContact CB-CD2 3.85Å; P284-L370 HydrophobicContact CG-CD2 4.34Å
285	F	97.9	Very high	96.3	Very high	2 Å²	2	46 Å²	46	1%	0.009	24%	0.24	C	C	.	.			trans	-62	140.1	169.7	-78.5	-92.5	0	0	0	110.5	M289 V291 V307 L315 M333 A366 L370 F371	F285-M289 HydrophobicContact CB-SD 4.34Å; F285-M289 HydrophobicContact CD1-SD 3.95Å; F285-M289 HydrophobicContact CG-SD 4.44Å; F285-V291 HydrophobicContact CE1-CG1 4.12Å; F285-V307 HydrophobicContact CD1-CG2 4.47Å; F285-L315 HydrophobicContact CB-CD2 3.76Å; F285-L315 HydrophobicContact CD1-CD1 4.11Å; F285-L315 HydrophobicContact CE1-CD1 4.44Å; F285-L315 HydrophobicContact CG-CD1 4.17Å; F285-L315 HydrophobicContact CG-CD2 4.21Å; F285-M333 HydrophobicContact CD2-CB 3.72Å; F285-M333 HydrophobicContact CE2-CB 4.01Å; F285-A366 HydrophobicContact CE1-CB 4.08Å; F285-L370 HydrophobicContact CD2-CB 4.31Å; F285-L370 HydrophobicContact CE1-CB 4.44Å; F285-L370 HydrophobicContact CE2-CB 3.72Å; F285-L370 WeakPolarHBondContact CE2-O 3.28Å; F285-L370 HydrophobicContact CG-CD1 4.46Å; F285-L370 HydrophobicContact CZ-CB 3.8Å; F285-F371 HydrophobicContact CE1-CE1 4.11Å; F285-F371 HydrophobicContact CE1-CE2 4.35Å; F285-F371 AromaticContact CE1-CZ 3.92Å; F285-F371 HydrophobicContact CE1-CZ 3.92Å; F285-F371 HydrophobicContact CZ-CD1 4.04Å; F285-F371 HydrophobicContact CZ-CD2 4.35Å; F285-F371 AromaticContact CZ-CE1 3.87Å; F285-F371 HydrophobicContact CZ-CE1 3.87Å; F285-F371 HydrophobicContact CZ-CE2 4.2Å; F285-F371 HydrophobicContact CZ-CG 4.28Å; F285-F371 AromaticContact CZ-CZ 3.96Å; F285-F371 HydrophobicContact CZ-CZ 3.96Å
286	K	96.9	Very high	96	Very high	108 Å²	108	44.8 Å²	44.8	47%	0.47	23%	0.233	S	C	.	.			trans	-126.7	162.8	-179.3	-52.8	-59.7	171.2	-165.2	0	110.2	Y283 P284 M289 V307	Y283-K286 PolarHBondContact O-NZ 2.84Å; P284-K286 WeakPolarHBondContact O-CE 3.39Å; K286-M289 HydrophobicContact CB-CE 4.04Å; K286-M289 HydrophobicContact CB-SD 4.4Å; K286-M289 HydrophobicContact CG-CE 3.96Å; K286-M289 PolarHBondContact N-SD 3.05Å; K286-M289 WeakPolarHBondContact O-CB 3.33Å; K286-M289 WeakPolarHBondContact O-CG 3.31Å; K286-M289 PolarHBondContact O-N 3.2Å; K286-V307 WeakPolarHBondContact O-CB 3.38Å; K286-V307 WeakPolarHBondContact O-CG1 3.47Å
287	T	96.7	Very high	95.6	Very high	77 Å²	77	46.2 Å²	46.2	47%	0.472	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	153.6	170.9	53	0	0	0	0	111.5	M289 V307 E308	T287-M289 PolarHBondContact O-N 3.15Å; T287-V307 CarbonylContact C-O 3.54Å; T287-V307 VanDerWaalsContact CA-O 3.26Å; T287-V307 WeakPolarHBondContact CA-O 3.43Å; T287-E308 WeakPolarHBondContact CG2-O 3.49Å
288	S	95.6	Very high	95.2	Very high	42 Å²	42	48.9 Å²	48.9	29%	0.294	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	3.2	-176.4	-48.1	0	0	0	0	115.8	V307 H363 F364	S288-V307 PolarHBondContact N-O 3.03Å; S288-H363 WeakPolarHBondContact O-CA 3.34Å; S288-F364 PolarHBondContact O-N 3Å
289	M	97.6	Very high	95	Very high	12 Å²	12	46.7 Å²	46.7	6%	0.059	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	132.5	168.2	-76.9	-174.6	176	0	0	111.2	F285 K286 T287 V306 V307 F364 A366 L370	F285-M289 HydrophobicContact CB-SD 4.34Å; F285-M289 HydrophobicContact CD1-SD 3.95Å; F285-M289 HydrophobicContact CG-SD 4.44Å; K286-M289 HydrophobicContact CB-CE 4.04Å; K286-M289 HydrophobicContact CB-SD 4.4Å; K286-M289 HydrophobicContact CG-CE 3.96Å; K286-M289 PolarHBondContact N-SD 3.05Å; K286-M289 WeakPolarHBondContact O-CB 3.33Å; K286-M289 WeakPolarHBondContact O-CG 3.31Å; K286-M289 PolarHBondContact O-N 3.2Å; T287-M289 PolarHBondContact O-N 3.15Å; M289-V306 CarbonylContact O-C 3.59Å; M289-V306 WeakPolarHBondContact O-CA 3.25Å; M289-V307 HydrophobicContact CB-CB 4.41Å; M289-V307 HydrophobicContact CB-CG2 4.03Å; M289-V307 PolarHBondContact O-N 3.14Å; M289-F364 CarbonylContact C-O 3.55Å; M289-F364 VanDerWaalsContact CA-O 3.29Å; M289-F364 WeakPolarHBondContact CA-O 3.48Å; M289-F364 HydrophobicContact CE-CE2 3.83Å; M289-F364 HydrophobicContact CE-CZ 4.27Å; M289-F364 HydrophobicContact CG-CD2 4.19Å; M289-F364 HydrophobicContact CG-CE2 3.44Å; M289-F364 VanDerWaalsContact CG-CE2 3.44Å; M289-F364 HydrophobicContact CG-CZ 3.65Å; M289-F364 HydrophobicContact SD-CE2 4.48Å; M289-A366 HydrophobicContact CB-CB 4.23Å; M289-A366 HydrophobicContact SD-CB 4.36Å; M289-L370 HydrophobicContact CE-CD1 3.89Å; M289-L370 HydrophobicContact SD-CD1 4.01Å
290	R	97.3	Very high	94.9	Very high	14 Å²	14	42.3 Å²	42.3	5%	0.053	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	134.5	176.2	-55.1	172	73.3	-114	2.5	110.5	V304 A305 V306 E320 I341 H363 F364 D365 A366	R290-V304 HydrophobicContact CB-CG1 4.3Å; R290-A305 CarbonylContact C-O 3.57Å; R290-A305 WeakPolarHBondContact CA-O 3.42Å; R290-V306 HydrophobicContact CG-CG2 4.43Å; R290-E320 IonicContact CZ-OE1 3.3Å; R290-E320 VanDerWaalsContact CZ-OE1 3.28Å; R290-E320 IonicContact CZ-OE2 3Å; R290-E320 IonicContact NE-OE1 2.74Å; R290-E320 PolarHBondContact NE-OE1 3.05Å; R290-E320 IonicContact NE-OE2 2.8Å; R290-E320 VanDerWaalsContact NH2-CD 3.27Å; R290-E320 IonicContact NH2-OE1 3.22Å; R290-E320 PolarHBondContact NH2-OE1 3.46Å; R290-E320 IonicContact NH2-OE2 2.72Å; R290-E320 PolarHBondContact NH2-OE2 3.23Å; R290-I341 HydrophobicContact CB-CD1 4.09Å; R290-I341 HydrophobicContact CB-CG1 4.27Å; R290-H363 HydrophobicContact CG-CB 3.9Å; R290-F364 PolarHBondContact N-O 3.24Å; R290-D365 WeakPolarHBondContact CD-OD1 3.11Å; R290-D365 IonicContact CZ-OD1 3.69Å; R290-D365 IonicContact NE-OD1 3.87Å; R290-D365 IonicContact NH1-OD1 2.72Å; R290-D365 PolarHBondContact NH1-OD1 2.9Å; R290-A366 VanDerWaalsContact O-CB 3.28Å; R290-A366 WeakPolarHBondContact O-CB 3.43Å; R290-A366 PolarHBondContact O-N 2.88Å
291	V	97.9	Very high	94.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	155.1	178.3	-53.7	0	0	0	0	110.8	F285 V304 A305 L317 A366 F371	F285-V291 HydrophobicContact CE1-CG1 4.12Å; V291-V304 WeakPolarHBondContact O-CA 3.05Å; V291-A305 HydrophobicContact CG2-CB 4.39Å; V291-A305 PolarHBondContact N-O 3.29Å; V291-A305 PolarHBondContact O-N 3.38Å; V291-L317 HydrophobicContact CG2-CD1 3.76Å; V291-L317 HydrophobicContact CG2-CD2 3.93Å; V291-L317 HydrophobicContact CG2-CG 4.47Å; V291-A366 HydrophobicContact CG1-CB 3.9Å; V291-F371 HydrophobicContact CB-CE1 4.45Å; V291-F371 HydrophobicContact CB-CZ 4.32Å; V291-F371 HydrophobicContact CG1-CE1 4.21Å; V291-F371 HydrophobicContact CG1-CZ 3.88Å
292	E	97.8	Very high	95	Very high	17 Å²	17	40.8 Å²	40.8	8%	0.079	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	133.7	160.8	-78.4	176.2	-160.5	0	0	108.5	I338 H339 I341 G342 S344	E292-I338 CarbonylContact O-C 3.53Å; E292-I338 WeakPolarHBondContact O-CA 3.4Å; E292-H339 HydrophobicContact CB-CB 4.41Å; E292-H339 PolarHBondContact N-O 2.69Å; E292-H339 PolarHBondContact O-N 3.18Å; E292-I341 HydrophobicContact CG-CD1 4.17Å; E292-G342 WeakPolarHBondContact OE1-CA 3.2Å; E292-G342 PolarHBondContact OE1-N 2.8Å; E292-S344 WeakPolarHBondContact OE2-CB 3.43Å; E292-S344 PolarHBondContact OE2-N 3.41Å; E292-S344 PolarHBondContact OE2-OG 2.72Å
293	V	97.7	Very high	95	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	153	179.1	55	0	0	0	0	109.6	D295 T302 R303 A305 L317 Y319 F329 L337 I338	V293-D295 PolarHBondContact O-N 3.44Å; V293-T302 CarbonylContact O-C 3.55Å; V293-T302 WeakPolarHBondContact O-CA 3Å; V293-T302 WeakPolarHBondContact O-CB 3.49Å; V293-R303 PolarHBondContact N-O 3.39Å; V293-R303 VanDerWaalsContact N-O 3.08Å; V293-R303 PolarHBondContact O-N 2.92Å; V293-A305 HydrophobicContact CG1-CB 3.5Å; V293-L317 HydrophobicContact CB-CD1 4.08Å; V293-L317 HydrophobicContact CG1-CD1 4.14Å; V293-L317 HydrophobicContact CG2-CD1 4.04Å; V293-Y319 HydrophobicContact CG1-CD1 4.2Å; V293-Y319 HydrophobicContact CG1-CE1 3.75Å; V293-F329 HydrophobicContact CG2-CD1 3.7Å; V293-F329 HydrophobicContact CG2-CE1 3.68Å; V293-F329 HydrophobicContact CG2-CG 4.17Å; V293-F329 HydrophobicContact CG2-CZ 4.15Å; V293-L337 WeakPolarHBondContact CA-O 3.42Å; V293-I338 HydrophobicContact CB-CG2 4.11Å; V293-I338 HydrophobicContact CG2-CG2 3.87Å
294	V	95.6	Very high	94.9	Very high	22 Å²	22	34.7 Å²	34.7	13%	0.133	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	138.4	175	68.3	0	0	0	0	111.9	K296 L299 Y319 F329 L337	V294-K296 PolarHBondContact O-N 3.34Å; V294-L299 HydrophobicContact CG2-CD2 4.01Å; V294-Y319 PolarHBondContact O-OH 3.31Å; V294-F329 HydrophobicContact CG1-CE2 3.81Å; V294-F329 HydrophobicContact CG1-CZ 3.68Å; V294-L337 HydrophobicContact CG1-CB 4.08Å; V294-L337 HydrophobicContact CG1-CD1 4.25Å; V294-L337 HydrophobicContact CG1-CD2 4.46Å; V294-L337 HydrophobicContact CG1-CG 4.5Å; V294-L337 PolarHBondContact N-O 2.99Å
295	D	93.1	Very high	94.9	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.164	C	C	.	.			trans	-79.7	108.1	171.6	-175.6	-18.9	0	0	0	109	V293 T297 H298 L299 R301 R303	V293-D295 PolarHBondContact O-N 3.44Å; D295-T297 PolarHBondContact O-N 2.93Å; D295-T297 WeakPolarHBondContact OD1-CB 3.1Å; D295-T297 PolarHBondContact OD1-N 3.18Å; D295-T297 PolarHBondContact OD1-OG1 3.08Å; D295-H298 HydrophobicContact CB-CB 4.39Å; D295-H298 CarbonylContact O-C 3.57Å; D295-H298 PolarHBondContact O-N 3.22Å; D295-L299 PolarHBondContact O-N 3.02Å; D295-R301 HydrophobicContact CB-CG 3.91Å; D295-R301 WeakPolarHBondContact CB-O 3.29Å; D295-R301 PolarHBondContact N-O 2.61Å; D295-R301 IonicContact OD2-CZ 3.72Å; D295-R301 IonicContact OD2-NE 3.63Å; D295-R301 PolarHBondContact OD2-NE 3.08Å; D295-R301 IonicContact OD2-NH2 2.72Å; D295-R301 PolarHBondContact OD2-NH2 2.75Å; D295-R303 HydrophobicContact CB-CG 4.22Å
296	K	88.5	Confident	94.8	Very high	89 Å²	89	32.4 Å²	32.4	39%	0.387	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-11.8	-179.1	72.3	-173.3	-179.3	-163.4	0	114.2	V294 Y319 D327 D328 F329	V294-K296 PolarHBondContact O-N 3.34Å; K296-Y319 HydrophobicContact CD-CE2 4.14Å; K296-Y319 HydrophobicContact CG-CE2 4.28Å; K296-Y319 PolarHBondContact N-OH 3.28Å; K296-Y319 VanDerWaalsContact N-OH 3.13Å; K296-D327 WeakPolarHBondContact CE-OD1 3.35Å; K296-D327 IonicContact NZ-OD1 3.18Å; K296-D327 PolarHBondContact NZ-OD1 3.41Å; K296-D328 PolarHBondContact NZ-O 2.99Å; K296-F329 HydrophobicContact CB-CD2 4.24Å; K296-F329 HydrophobicContact CB-CE2 4.31Å; K296-F329 HydrophobicContact CD-CD2 4.49Å
297	T	87.1	Confident	94.9	Very high	93 Å²	93	27.3 Å²	27.3	57%	0.571	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-14.8	175	69.6	0	0	0	0	113.5	D295	D295-T297 PolarHBondContact O-N 2.93Å; D295-T297 WeakPolarHBondContact OD1-CB 3.1Å; D295-T297 PolarHBondContact OD1-N 3.18Å; D295-T297 PolarHBondContact OD1-OG1 3.08Å
298	H	89.6	Confident	94.9	Very high	72 Å²	72	27 Å²	27	33%	0.333	14%	0.137	S	C	.	.			trans	-152	80.1	-173.8	-68.5	74.6	0	0	0	109.7	D295 C300 R301	D295-H298 HydrophobicContact CB-CB 4.39Å; D295-H298 CarbonylContact O-C 3.57Å; D295-H298 PolarHBondContact O-N 3.22Å; H298-C300 PolarHBondContact O-N 3.05Å; H298-R301 HydrophobicContact CB-CG 4.08Å; H298-R301 PolarHBondContact CD2-NH1 2.91Å; H298-R301 VanDerWaalsContact CD2-NH1 3.29Å; H298-R301 PolarHBondContact CE1-NH2 2.88Å; H298-R301 VanDerWaalsContact CG-CZ 3.42Å; H298-R301 VanDerWaalsContact CG-NH2 3.28Å; H298-R301 PolarHBondContact ND1-NH2 3.36Å; H298-R301 WeakPolarHBondContact O-CG 3.41Å; H298-R301 PolarHBondContact O-N 2.79Å; H298-R301 VanDerWaalsContact O-N 3.09Å
299	L	90.9	Very high	94.9	Very high	24 Å²	24	26.6 Å²	26.6	13%	0.126	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-25.4	-169.4	-62.9	-174.1	0	0	0	114.8	V294 D295 R301 P395 L396 S428 W430 F431	V294-L299 HydrophobicContact CG2-CD2 4.01Å; D295-L299 PolarHBondContact O-N 3.02Å; L299-R301 PolarHBondContact O-N 3.14Å; L299-R301 VanDerWaalsContact O-N 3.12Å; L299-P395 HydrophobicContact CD1-CB 4.31Å; L299-P395 HydrophobicContact CD1-CG 3.73Å; L299-L396 HydrophobicContact CD1-CD1 4.26Å; L299-L396 HydrophobicContact CD1-CD2 3.84Å; L299-L396 HydrophobicContact CD1-CG 3.85Å; L299-L396 HydrophobicContact CG-CD2 4.41Å; L299-S428 PolarHBondContact N-O 3.04Å; L299-W430 CarbonylContact C-O 3.58Å; L299-F431 HydrophobicContact CB-CB 4.33Å; L299-F431 HydrophobicContact CD1-CB 4.25Å
300	C	94.4	Very high	94.9	Very high	5 Å²	5	28 Å²	28	3%	0.034	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-9.3	-180	75.5	0	0	0	0	115.3	H298 H349 R350 M416 G427 S428 W430	H298-C300 PolarHBondContact O-N 3.05Å; C300-H349 PolarHBondContact O-CE1 2.84Å; C300-R350 VanDerWaalsContact O-CB 3.31Å; C300-R350 WeakPolarHBondContact O-CB 2.92Å; C300-R350 PolarHBondContact SG-NH1 2.74Å; C300-M416 HydrophobicContact CB-CE 4.44Å; C300-G427 WeakPolarHBondContact CB-O 3.38Å; C300-S428 WeakPolarHBondContact CB-O 3.41Å; C300-S428 PolarHBondContact N-O 3.36Å; C300-S428 VanDerWaalsContact N-O 3.1Å; C300-W430 WeakPolarHBondContact CA-O 3.41Å; C300-W430 HydrophobicContact CB-CB 4.29Å; C300-W430 WeakPolarHBondContact CB-O 3.42Å; C300-W430 PolarHBondContact N-O 2.96Å
301	R	94.9	Very high	95	Very high	56 Å²	56	30 Å²	30	21%	0.211	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	154.4	-177.9	72.4	179.4	-175.5	-130.9	-5.2	112.9	D295 H298 L299 R350	D295-R301 HydrophobicContact CB-CG 3.91Å; D295-R301 WeakPolarHBondContact CB-O 3.29Å; D295-R301 PolarHBondContact N-O 2.61Å; D295-R301 IonicContact OD2-CZ 3.72Å; D295-R301 IonicContact OD2-NE 3.63Å; D295-R301 PolarHBondContact OD2-NE 3.08Å; D295-R301 IonicContact OD2-NH2 2.72Å; D295-R301 PolarHBondContact OD2-NH2 2.75Å; H298-R301 HydrophobicContact CB-CG 4.08Å; H298-R301 PolarHBondContact CD2-NH1 2.91Å; H298-R301 VanDerWaalsContact CD2-NH1 3.29Å; H298-R301 PolarHBondContact CE1-NH2 2.88Å; H298-R301 VanDerWaalsContact CG-CZ 3.42Å; H298-R301 VanDerWaalsContact CG-NH2 3.28Å; H298-R301 PolarHBondContact ND1-NH2 3.36Å; H298-R301 WeakPolarHBondContact O-CG 3.41Å; H298-R301 PolarHBondContact O-N 2.79Å; H298-R301 VanDerWaalsContact O-N 3.09Å; L299-R301 PolarHBondContact O-N 3.14Å; L299-R301 VanDerWaalsContact O-N 3.12Å; R301-R350 VanDerWaalsContact CA-O 3.24Å; R301-R350 WeakPolarHBondContact CA-O 3.32Å; R301-R350 HydrophobicContact CB-CB 3.88Å
302	T	96.9	Very high	94.9	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.012	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	165.7	161.2	57	0	0	0	0	111.1	V293 W343 S344 R350 F351 K352	V293-T302 CarbonylContact O-C 3.55Å; V293-T302 WeakPolarHBondContact O-CA 3Å; V293-T302 WeakPolarHBondContact O-CB 3.49Å; T302-W343 HydrophobicContact CG2-CE3 4.36Å; T302-W343 HydrophobicContact CG2-CZ3 3.83Å; T302-S344 WeakPolarHBondContact CG2-OG 3.33Å; T302-S344 PolarHBondContact OG1-OG 2.92Å; T302-R350 PolarHBondContact N-O 3.08Å; T302-R350 VanDerWaalsContact N-O 3.08Å; T302-F351 CarbonylContact O-C 3.59Å; T302-F351 WeakPolarHBondContact O-CA 3.45Å; T302-F351 WeakPolarHBondContact OG1-CB 3.26Å; T302-K352 PolarHBondContact O-N 2.76Å
303	R	95.1	Very high	94.8	Very high	18 Å²	18	29.4 Å²	29.4	7%	0.068	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	164	161.2	65.5	-165.9	-78.8	-134.8	1.7	109.1	V293 D295 Y319 E321 D327 K352	V293-R303 PolarHBondContact N-O 3.39Å; V293-R303 VanDerWaalsContact N-O 3.08Å; V293-R303 PolarHBondContact O-N 2.92Å; D295-R303 HydrophobicContact CB-CG 4.22Å; R303-Y319 HydrophobicContact CG-CD1 3.35Å; R303-Y319 HydrophobicContact CG-CE1 3.44Å; R303-Y319 VanDerWaalsContact CG-CE1 3.44Å; R303-Y319 HydrophobicContact CG-CG 4.26Å; R303-Y319 VanDerWaalsContact CZ-CB 3.43Å; R303-Y319 VanDerWaalsContact CZ-CG 3.48Å; R303-E321 IonicContact CZ-OE2 3.69Å; R303-E321 VanDerWaalsContact CZ-OE2 3.3Å; R303-E321 IonicContact NE-OE2 2.67Å; R303-E321 PolarHBondContact NE-OE2 3.39Å; R303-E321 IonicContact NH2-OE2 3.63Å; R303-E321 PolarHBondContact NH2-OE2 3.02Å; R303-D327 IonicContact CZ-OD2 2.74Å; R303-D327 IonicContact NH1-OD2 3.38Å; R303-D327 PolarHBondContact NH1-OD2 2.76Å; R303-D327 IonicContact NH2-OD2 3.42Å; R303-K352 HydrophobicContact CB-CB 3.81Å; R303-K352 HydrophobicContact CB-CD 4.39Å
304	V	95.4	Very high	94.9	Very high	21 Å²	21	29.4 Å²	29.4	13%	0.127	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	136.7	-179.2	-177.9	0	0	0	0	110.4	R290 V291 E320 I341	R290-V304 HydrophobicContact CB-CG1 4.3Å; V291-V304 WeakPolarHBondContact O-CA 3.05Å; V304-E320 HydrophobicContact CB-CB 4.35Å; V304-E320 HydrophobicContact CG1-CB 4.28Å; V304-E320 PolarHBondContact O-N 3.15Å; V304-I341 HydrophobicContact CG1-CD1 4.08Å; V304-I341 HydrophobicContact CG2-CD1 4.31Å
305	A	96.1	Very high	95	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	160.2	170.8	0	0	0	0	0	111.4	R290 V291 V293 L317 V318 Y319	R290-A305 CarbonylContact C-O 3.57Å; R290-A305 WeakPolarHBondContact CA-O 3.42Å; V291-A305 HydrophobicContact CG2-CB 4.39Å; V291-A305 PolarHBondContact N-O 3.29Å; V291-A305 PolarHBondContact O-N 3.38Å; V293-A305 HydrophobicContact CG1-CB 3.5Å; A305-L317 HydrophobicContact CB-CB 3.92Å; A305-V318 CarbonylContact C-O 3.55Å; A305-V318 VanDerWaalsContact CA-O 3.31Å; A305-V318 WeakPolarHBondContact CA-O 3.47Å; A305-V318 WeakPolarHBondContact CB-O 3.36Å; A305-Y319 HydrophobicContact CB-CD1 3.93Å
306	V	96.3	Very high	95.3	Very high	8 Å²	8	30.6 Å²	30.6	5%	0.048	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	137	-179.4	-171.1	0	0	0	0	109	M289 R290 E308 L317 V318 E320	M289-V306 CarbonylContact O-C 3.59Å; M289-V306 WeakPolarHBondContact O-CA 3.25Å; R290-V306 HydrophobicContact CG-CG2 4.43Å; V306-E308 PolarHBondContact O-N 3.17Å; V306-L317 CarbonylContact O-C 3.46Å; V306-L317 WeakPolarHBondContact O-CA 3.48Å; V306-V318 PolarHBondContact N-O 2.9Å; V306-V318 PolarHBondContact O-N 3.44Å; V306-E320 HydrophobicContact CG2-CB 4.49Å
307	V	97.8	Very high	95.7	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	108.8	171.4	-179.1	0	0	0	0	108.9	F285 K286 T287 S288 M289 V310 L315 L317	F285-V307 HydrophobicContact CD1-CG2 4.47Å; K286-V307 WeakPolarHBondContact O-CB 3.38Å; K286-V307 WeakPolarHBondContact O-CG1 3.47Å; T287-V307 CarbonylContact C-O 3.54Å; T287-V307 VanDerWaalsContact CA-O 3.26Å; T287-V307 WeakPolarHBondContact CA-O 3.43Å; S288-V307 PolarHBondContact N-O 3.03Å; M289-V307 HydrophobicContact CB-CB 4.41Å; M289-V307 HydrophobicContact CB-CG2 4.03Å; M289-V307 PolarHBondContact O-N 3.14Å; V307-V310 HydrophobicContact CG1-CG2 3.61Å; V307-L315 HydrophobicContact CG1-CD2 4.42Å; V307-L315 HydrophobicContact CG2-CD1 4.44Å; V307-L317 HydrophobicContact CB-CD2 4.37Å; V307-L317 HydrophobicContact CG2-CD2 3.65Å
308	E	96.5	Very high	96.1	Very high	69 Å²	69	22.4 Å²	22.4	32%	0.322	11%	0.112	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-37.7	175.8	-175.8	78.7	173.2	0	0	110.9	T287 V306 R316 V318 K325	T287-E308 WeakPolarHBondContact CG2-O 3.49Å; V306-E308 PolarHBondContact O-N 3.17Å; E308-R316 PolarHBondContact N-O 2.92Å; E308-V318 HydrophobicContact CB-CG2 3.84Å; E308-V318 HydrophobicContact CG-CG2 4.25Å; E308-K325 WeakPolarHBondContact OE1-CD 3.49Å; E308-K325 IonicContact OE1-NZ 2.69Å; E308-K325 PolarHBondContact OE1-NZ 3.47Å; E308-K325 IonicContact OE2-NZ 3.57Å; E308-K325 PolarHBondContact OE2-NZ 2.64Å
309	S	97.1	Very high	96.4	Very high	35 Å²	35	19.1 Å²	19.1	25%	0.245	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	161.5	175.9	70.5	0	0	0	0	113.2	R316	S309-R316 PolarHBondContact O-N 3.09Å; S309-R316 WeakPolarHBondContact OG-CB 3.39Å
310	V	98	Very high	96.3	Very high	41 Å²	41	19.3 Å²	19.3	25%	0.248	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	123	178.4	-175.3	0	0	0	0	109	Y283 V307 R314 L315	Y283-V310 HydrophobicContact CD2-CG1 4.14Å; Y283-V310 HydrophobicContact CG-CG1 4.11Å; V307-V310 HydrophobicContact CG1-CG2 3.61Å; V310-R314 CarbonylContact C-O 3.46Å; V310-R314 WeakPolarHBondContact CA-O 3.45Å; V310-L315 HydrophobicContact CB-CD2 4.4Å; V310-L315 HydrophobicContact CG1-CD2 4.04Å; V310-L315 HydrophobicContact CG2-CD2 3.72Å
311	I	97.6	Very high	95.9	Very high	56 Å²	56	22.3 Å²	22.3	29%	0.287	11%	0.11	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	116.9	-179.6	-48.7	176.7	0	0	0	108.5	G313 R314 W330 Y555	I311-G313 PolarHBondContact O-N 3.47Å; I311-G313 VanDerWaalsContact O-N 3.13Å; I311-R314 PolarHBondContact N-O 2.77Å; I311-R314 WeakPolarHBondContact O-CA 3.18Å; I311-R314 WeakPolarHBondContact O-CB 3.31Å; I311-R314 PolarHBondContact O-N 3.33Å; I311-W330 HydrophobicContact CD1-CH2 4.32Å; I311-Y555 HydrophobicContact CB-CD2 3.97Å; I311-Y555 HydrophobicContact CB-CE2 4.37Å; I311-Y555 HydrophobicContact CG2-CD2 3.73Å
312	G	96.2	Very high	95.3	Very high	4 Å²	4	20.7 Å²	20.7	4%	0.041	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	18	177.5	0	0	0	0	0	115.8	Y283 R314 W549 T553	Y283-G312 WeakPolarHBondContact OH-CA 3.34Å; G312-R314 VanDerWaalsContact C-N 3.33Å; G312-W549 WeakPolarHBondContact O-CZ2 3.46Å; G312-T553 VanDerWaalsContact CA-CG2 3.5Å
313	G	96.9	Very high	94.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.6	-8	-170.4	0	0	0	0	0	114.2	Y283 I311 H332 M333	Y283-G313 VanDerWaalsContact CE1-N 3.28Å; I311-G313 PolarHBondContact O-N 3.47Å; I311-G313 VanDerWaalsContact O-N 3.13Å; G313-H332 PolarHBondContact O-CD2 3.24Å; G313-M333 WeakPolarHBondContact O-CB 3.49Å; G313-M333 WeakPolarHBondContact O-CG 3.23Å; G313-M333 PolarHBondContact O-N 3.25Å
314	R	98.4	Very high	93.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	133.4	166	-56.1	-168.1	66.7	64.8	-3.3	110.1	V310 I311 G312 C331 V501 P506 D543 Y545 W549 Y555	V310-R314 CarbonylContact C-O 3.46Å; V310-R314 WeakPolarHBondContact CA-O 3.45Å; I311-R314 PolarHBondContact N-O 2.77Å; I311-R314 WeakPolarHBondContact O-CA 3.18Å; I311-R314 WeakPolarHBondContact O-CB 3.31Å; I311-R314 PolarHBondContact O-N 3.33Å; G312-R314 VanDerWaalsContact C-N 3.33Å; R314-C331 CarbonylContact C-O 3.55Å; R314-C331 WeakPolarHBondContact CA-O 3.19Å; R314-V501 VanDerWaalsContact CZ-CG2 3.44Å; R314-P506 PolarHBondContact NH2-O 2.95Å; R314-D543 IonicContact CZ-OD1 2.69Å; R314-D543 IonicContact NH1-OD1 3.22Å; R314-D543 PolarHBondContact NH1-OD1 2.78Å; R314-D543 IonicContact NH2-OD1 2.75Å; R314-D543 PolarHBondContact NH2-OD1 2.7Å; R314-Y545 PolarHBondContact NH1-OH 2.77Å; R314-W549 HydrophobicContact CG-CH2 3.93Å; R314-W549 HydrophobicContact CG-CZ2 4.19Å; R314-Y555 HydrophobicContact CB-CE2 4.4Å
315	L	98.6	Very high	93	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	133.4	175.2	-50.2	-178.5	0	0	0	108.7	F285 V307 V310 L317 C331 M333 I338	F285-L315 HydrophobicContact CB-CD2 3.76Å; F285-L315 HydrophobicContact CD1-CD1 4.11Å; F285-L315 HydrophobicContact CE1-CD1 4.44Å; F285-L315 HydrophobicContact CG-CD1 4.17Å; F285-L315 HydrophobicContact CG-CD2 4.21Å; V307-L315 HydrophobicContact CG1-CD2 4.42Å; V307-L315 HydrophobicContact CG2-CD1 4.44Å; V310-L315 HydrophobicContact CB-CD2 4.4Å; V310-L315 HydrophobicContact CG1-CD2 4.04Å; V310-L315 HydrophobicContact CG2-CD2 3.72Å; L315-L317 HydrophobicContact CB-CD2 3.97Å; L315-L317 HydrophobicContact CB-CG 4.29Å; L315-L317 HydrophobicContact CD1-CD2 4.2Å; L315-C331 PolarHBondContact N-O 3.19Å; L315-C331 PolarHBondContact O-N 3.22Å; L315-M333 HydrophobicContact CD1-CB 4.26Å; L315-M333 HydrophobicContact CD2-CB 4.2Å; L315-M333 HydrophobicContact CG-CB 4.19Å; L315-I338 HydrophobicContact CD1-CD1 3.83Å
316	R	98.1	Very high	92.4	Very high	49 Å²	49	41.3 Å²	41.3	19%	0.185	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	108.3	156.4	-173.4	-176.4	-170.9	-115.7	-8.6	107.5	E308 S309 K325 D328 W330	E308-R316 PolarHBondContact N-O 2.92Å; S309-R316 PolarHBondContact O-N 3.09Å; S309-R316 WeakPolarHBondContact OG-CB 3.39Å; R316-K325 PolarHBondContact NH2-O 3.03Å; R316-D328 HydrophobicContact CG-CB 4.3Å; R316-D328 IonicContact CZ-OD2 2.81Å; R316-D328 IonicContact NE-OD2 2.76Å; R316-D328 PolarHBondContact NE-OD2 3.31Å; R316-D328 IonicContact NH2-OD2 3.3Å; R316-D328 PolarHBondContact NH2-OD2 3.27Å; R316-W330 HydrophobicContact CB-CD2 4.15Å; R316-W330 HydrophobicContact CB-CE3 4.15Å; R316-W330 HydrophobicContact CB-CH2 3.81Å; R316-W330 HydrophobicContact CB-CZ2 3.77Å; R316-W330 HydrophobicContact CB-CZ3 3.98Å; R316-W330 HydrophobicContact CG-CD2 4.29Å; R316-W330 HydrophobicContact CG-CH2 4.3Å; R316-W330 HydrophobicContact CG-CZ2 3.73Å
317	L	98	Very high	92.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	139.1	171.6	-54.1	-179.1	0	0	0	109.2	V291 V293 A305 V306 V307 L315 D328 F329 I338	V291-L317 HydrophobicContact CG2-CD1 3.76Å; V291-L317 HydrophobicContact CG2-CD2 3.93Å; V291-L317 HydrophobicContact CG2-CG 4.47Å; V293-L317 HydrophobicContact CB-CD1 4.08Å; V293-L317 HydrophobicContact CG1-CD1 4.14Å; V293-L317 HydrophobicContact CG2-CD1 4.04Å; A305-L317 HydrophobicContact CB-CB 3.92Å; V306-L317 CarbonylContact O-C 3.46Å; V306-L317 WeakPolarHBondContact O-CA 3.48Å; V307-L317 HydrophobicContact CB-CD2 4.37Å; V307-L317 HydrophobicContact CG2-CD2 3.65Å; L315-L317 HydrophobicContact CB-CD2 3.97Å; L315-L317 HydrophobicContact CB-CG 4.29Å; L315-L317 HydrophobicContact CD1-CD2 4.2Å; L317-D328 CarbonylContact O-C 3.58Å; L317-D328 WeakPolarHBondContact O-CA 3.38Å; L317-D328 VanDerWaalsContact O-CB 3.31Å; L317-D328 WeakPolarHBondContact O-CB 3.43Å; L317-F329 HydrophobicContact CB-CB 4.34Å; L317-F329 WeakPolarHBondContact CB-O 3.43Å; L317-F329 HydrophobicContact CD1-CD1 4.37Å; L317-F329 PolarHBondContact N-O 3.37Å; L317-F329 PolarHBondContact O-N 2.79Å; L317-I338 HydrophobicContact CD1-CG2 3.81Å
318	V	96.3	Very high	91.9	Very high	9 Å²	9	44.2 Å²	44.2	6%	0.055	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	129.1	169.6	176.7	0	0	0	0	107.6	A305 V306 E308 K325 D328	A305-V318 CarbonylContact C-O 3.55Å; A305-V318 VanDerWaalsContact CA-O 3.31Å; A305-V318 WeakPolarHBondContact CA-O 3.47Å; A305-V318 WeakPolarHBondContact CB-O 3.36Å; V306-V318 PolarHBondContact N-O 2.9Å; V306-V318 PolarHBondContact O-N 3.44Å; E308-V318 HydrophobicContact CB-CG2 3.84Å; E308-V318 HydrophobicContact CG-CG2 4.25Å; V318-K325 HydrophobicContact CG1-CB 4.12Å; V318-K325 HydrophobicContact CG1-CG 4.2Å; V318-D328 HydrophobicContact CG2-CB 4.18Å
319	Y	94.3	Very high	91.9	Very high	3 Å²	3	42.2 Å²	42.2	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	139.3	-177.7	-63.9	-70.8	0	0	0	111.2	V293 V294 K296 R303 A305 E321 S322 D327 F329	V293-Y319 HydrophobicContact CG1-CD1 4.2Å; V293-Y319 HydrophobicContact CG1-CE1 3.75Å; V294-Y319 PolarHBondContact O-OH 3.31Å; K296-Y319 HydrophobicContact CD-CE2 4.14Å; K296-Y319 HydrophobicContact CG-CE2 4.28Å; K296-Y319 PolarHBondContact N-OH 3.28Å; K296-Y319 VanDerWaalsContact N-OH 3.13Å; R303-Y319 HydrophobicContact CG-CD1 3.35Å; R303-Y319 HydrophobicContact CG-CE1 3.44Å; R303-Y319 VanDerWaalsContact CG-CE1 3.44Å; R303-Y319 HydrophobicContact CG-CG 4.26Å; R303-Y319 VanDerWaalsContact CZ-CB 3.43Å; R303-Y319 VanDerWaalsContact CZ-CG 3.48Å; A305-Y319 HydrophobicContact CB-CD1 3.93Å; Y319-E321 PolarHBondContact O-N 3.27Å; Y319-S322 VanDerWaalsContact O-CB 3.3Å; Y319-S322 WeakPolarHBondContact O-CB 3.04Å; Y319-S322 PolarHBondContact O-N 2.76Å; Y319-D327 HydrophobicContact CD2-CB 4.39Å; Y319-D327 VanDerWaalsContact CD2-CG 3.46Å; Y319-D327 VanDerWaalsContact CD2-O 3.28Å; Y319-D327 WeakPolarHBondContact CD2-O 3.16Å; Y319-D327 VanDerWaalsContact CD2-OD2 3.28Å; Y319-D327 WeakPolarHBondContact CD2-OD2 3.42Å; Y319-D327 PolarHBondContact N-O 3.5Å; Y319-F329 HydrophobicContact CE2-CB 4.42Å; Y319-F329 WeakPolarHBondContact OH-CD2 3.44Å
320	E	90	Very high	91.9	Very high	29 Å²	29	42 Å²	42	14%	0.136	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-13	-169.8	-171.4	168.5	-121.4	0	0	114.2	R290 V304 V306	R290-E320 IonicContact CZ-OE1 3.3Å; R290-E320 VanDerWaalsContact CZ-OE1 3.28Å; R290-E320 IonicContact CZ-OE2 3Å; R290-E320 IonicContact NE-OE1 2.74Å; R290-E320 PolarHBondContact NE-OE1 3.05Å; R290-E320 IonicContact NE-OE2 2.8Å; R290-E320 VanDerWaalsContact NH2-CD 3.27Å; R290-E320 IonicContact NH2-OE1 3.22Å; R290-E320 PolarHBondContact NH2-OE1 3.46Å; R290-E320 IonicContact NH2-OE2 2.72Å; R290-E320 PolarHBondContact NH2-OE2 3.23Å; V304-E320 HydrophobicContact CB-CB 4.35Å; V304-E320 HydrophobicContact CG1-CB 4.28Å; V304-E320 PolarHBondContact O-N 3.15Å; V306-E320 HydrophobicContact CG2-CB 4.49Å
321	E	84.8	Confident	92	Very high	67 Å²	67	40.1 Å²	40.1	31%	0.313	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	3	-179.3	-47.6	158.1	125.4	0	0	112.8	R303 Y319 E323 K352	R303-E321 IonicContact CZ-OE2 3.69Å; R303-E321 VanDerWaalsContact CZ-OE2 3.3Å; R303-E321 IonicContact NE-OE2 2.67Å; R303-E321 PolarHBondContact NE-OE2 3.39Å; R303-E321 IonicContact NH2-OE2 3.63Å; R303-E321 PolarHBondContact NH2-OE2 3.02Å; Y319-E321 PolarHBondContact O-N 3.27Å; E321-E323 PolarHBondContact O-N 3.18Å; E321-K352 WeakPolarHBondContact OE1-CD 3.39Å; E321-K352 WeakPolarHBondContact OE1-CE 3.23Å; E321-K352 IonicContact OE1-NZ 2.68Å; E321-K352 PolarHBondContact OE1-NZ 3Å; E321-K352 WeakPolarHBondContact OE2-CD 3.46Å; E321-K352 IonicContact OE2-NZ 3.84Å; E321-K352 PolarHBondContact OE2-NZ 3.45Å
322	S	83.1	Confident	92	Very high	22 Å²	22	37.6 Å²	37.6	15%	0.154	19%	0.187	C	C	.	.			trans	-74.3	118.3	177.6	175.2	0	0	0	0	110.4	Y319 D324 K325	Y319-S322 VanDerWaalsContact O-CB 3.3Å; Y319-S322 WeakPolarHBondContact O-CB 3.04Å; Y319-S322 PolarHBondContact O-N 2.76Å; S322-D324 PolarHBondContact OG-OD1 3.17Å; S322-K325 WeakPolarHBondContact OG-CA 3.26Å; S322-K325 PolarHBondContact OG-N 3.39Å
323	E	75.9	Confident	92.1	Very high	187 Å²	187	37.9 Å²	37.9	87%	0.874	19%	0.187	S	C	*	.	S	Bend	trans	-77.1	-22.9	179	-57.7	-164.6	142.7	0	0	113	E321	E321-E323 PolarHBondContact O-N 3.18Å
324	D	81.5	Confident	92.1	Very high	96 Å²	96	41.7 Å²	41.7	51%	0.513	20%	0.202	S	C	.	.	S	Bend	trans	-114.7	-5.4	-170.1	70.5	-14.4	0	0	0	114.7	S322 T326	S322-D324 PolarHBondContact OG-OD1 3.17Å; D324-T326 HydrophobicContact CB-CG2 4.26Å; D324-T326 VanDerWaalsContact CG-OG1 3.26Å; D324-T326 PolarHBondContact O-N 3.2Å; D324-T326 PolarHBondContact OD1-N 3.31Å; D324-T326 PolarHBondContact OD1-OG1 3.4Å; D324-T326 WeakPolarHBondContact OD2-CB 3.43Å; D324-T326 WeakPolarHBondContact OD2-CG2 3.39Å; D324-T326 PolarHBondContact OD2-OG1 3.23Å
325	K	81.2	Confident	92.1	Very high	95 Å²	95	42.1 Å²	42.1	41%	0.413	21%	0.205	S	C	.	.	S	Bend	trans	55	19.2	-169.9	-57.1	-161	178.4	-161.8	0	115.5	E308 R316 V318 S322	E308-K325 WeakPolarHBondContact OE1-CD 3.49Å; E308-K325 IonicContact OE1-NZ 2.69Å; E308-K325 PolarHBondContact OE1-NZ 3.47Å; E308-K325 IonicContact OE2-NZ 3.57Å; E308-K325 PolarHBondContact OE2-NZ 2.64Å; R316-K325 PolarHBondContact NH2-O 3.03Å; V318-K325 HydrophobicContact CG1-CB 4.12Å; V318-K325 HydrophobicContact CG1-CG 4.2Å; S322-K325 WeakPolarHBondContact OG-CA 3.26Å; S322-K325 PolarHBondContact OG-N 3.39Å
326	T	83.7	Confident	92	Very high	97 Å²	97	46.6 Å²	46.6	60%	0.595	23%	0.234	S	C	*	.			trans	-90.6	-23.5	172.7	80.6	0	0	0	0	112.5	D324 D328	D324-T326 HydrophobicContact CB-CG2 4.26Å; D324-T326 VanDerWaalsContact CG-OG1 3.26Å; D324-T326 PolarHBondContact O-N 3.2Å; D324-T326 PolarHBondContact OD1-N 3.31Å; D324-T326 PolarHBondContact OD1-OG1 3.4Å; D324-T326 WeakPolarHBondContact OD2-CB 3.43Å; D324-T326 WeakPolarHBondContact OD2-CG2 3.39Å; D324-T326 PolarHBondContact OD2-OG1 3.23Å; T326-D328 PolarHBondContact O-N 2.94Å
327	D	90.6	Very high	91.9	Very high	39 Å²	39	47.1 Å²	47.1	21%	0.209	24%	0.24	C	C	.	.	S	Bend	trans	-74.2	72.9	172.9	-169.1	24.1	0	0	0	110.8	K296 R303 Y319	K296-D327 WeakPolarHBondContact CE-OD1 3.35Å; K296-D327 IonicContact NZ-OD1 3.18Å; K296-D327 PolarHBondContact NZ-OD1 3.41Å; R303-D327 IonicContact CZ-OD2 2.74Å; R303-D327 IonicContact NH1-OD2 3.38Å; R303-D327 PolarHBondContact NH1-OD2 2.76Å; R303-D327 IonicContact NH2-OD2 3.42Å; Y319-D327 HydrophobicContact CD2-CB 4.39Å; Y319-D327 VanDerWaalsContact CD2-CG 3.46Å; Y319-D327 VanDerWaalsContact CD2-O 3.28Å; Y319-D327 WeakPolarHBondContact CD2-O 3.16Å; Y319-D327 VanDerWaalsContact CD2-OD2 3.28Å; Y319-D327 WeakPolarHBondContact CD2-OD2 3.42Å; Y319-D327 PolarHBondContact N-O 3.5Å
328	D	93.8	Very high	91.9	Very high	31 Å²	31	47.4 Å²	47.4	17%	0.166	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	167.4	-179.6	83.6	15.1	0	0	0	113.7	K296 R316 L317 V318 T326 W330	K296-D328 PolarHBondContact NZ-O 2.99Å; R316-D328 HydrophobicContact CG-CB 4.3Å; R316-D328 IonicContact CZ-OD2 2.81Å; R316-D328 IonicContact NE-OD2 2.76Å; R316-D328 PolarHBondContact NE-OD2 3.31Å; R316-D328 IonicContact NH2-OD2 3.3Å; R316-D328 PolarHBondContact NH2-OD2 3.27Å; L317-D328 CarbonylContact O-C 3.58Å; L317-D328 WeakPolarHBondContact O-CA 3.38Å; L317-D328 VanDerWaalsContact O-CB 3.31Å; L317-D328 WeakPolarHBondContact O-CB 3.43Å; V318-D328 HydrophobicContact CG2-CB 4.18Å; T326-D328 PolarHBondContact O-N 2.94Å; D328-W330 PolarHBondContact OD2-NE1 3.21Å; D328-W330 VanDerWaalsContact OD2-NE1 3.09Å
329	F	95.8	Very high	92	Very high	26 Å²	26	47.9 Å²	47.9	11%	0.114	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	120.4	177.3	-170.4	-84	0	0	0	108.6	V293 V294 K296 L317 Y319 C331 L337	V293-F329 HydrophobicContact CG2-CD1 3.7Å; V293-F329 HydrophobicContact CG2-CE1 3.68Å; V293-F329 HydrophobicContact CG2-CG 4.17Å; V293-F329 HydrophobicContact CG2-CZ 4.15Å; V294-F329 HydrophobicContact CG1-CE2 3.81Å; V294-F329 HydrophobicContact CG1-CZ 3.68Å; K296-F329 HydrophobicContact CB-CD2 4.24Å; K296-F329 HydrophobicContact CB-CE2 4.31Å; K296-F329 HydrophobicContact CD-CD2 4.49Å; L317-F329 HydrophobicContact CB-CB 4.34Å; L317-F329 WeakPolarHBondContact CB-O 3.43Å; L317-F329 HydrophobicContact CD1-CD1 4.37Å; L317-F329 PolarHBondContact N-O 3.37Å; L317-F329 PolarHBondContact O-N 2.79Å; Y319-F329 HydrophobicContact CE2-CB 4.42Å; Y319-F329 WeakPolarHBondContact OH-CD2 3.44Å; F329-C331 HydrophobicContact CD1-CB 4.29Å; F329-C331 HydrophobicContact CE1-CB 3.94Å; F329-L337 HydrophobicContact CZ-CD1 3.99Å
330	W	98.1	Very high	92.2	Very high	30 Å²	30	50.4 Å²	50.4	11%	0.114	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	131	-178.9	-75.4	84.5	0	0	0	111	I311 R316 D328 P506 R507 Y555	I311-W330 HydrophobicContact CD1-CH2 4.32Å; R316-W330 HydrophobicContact CB-CD2 4.15Å; R316-W330 HydrophobicContact CB-CE3 4.15Å; R316-W330 HydrophobicContact CB-CH2 3.81Å; R316-W330 HydrophobicContact CB-CZ2 3.77Å; R316-W330 HydrophobicContact CB-CZ3 3.98Å; R316-W330 HydrophobicContact CG-CD2 4.29Å; R316-W330 HydrophobicContact CG-CH2 4.3Å; R316-W330 HydrophobicContact CG-CZ2 3.73Å; D328-W330 PolarHBondContact OD2-NE1 3.21Å; D328-W330 VanDerWaalsContact OD2-NE1 3.09Å; W330-P506 HydrophobicContact CB-CB 4.06Å; W330-P506 WeakPolarHBondContact CB-O 3.38Å; W330-P506 WeakPolarHBondContact O-CB 3.46Å; W330-R507 HydrophobicContact CG-CB 4.11Å; W330-Y555 HydrophobicContact CE3-CE2 4.28Å; W330-Y555 HydrophobicContact CH2-CE2 4.35Å; W330-Y555 AromaticContact CZ3-CE2 3.72Å; W330-Y555 HydrophobicContact CZ3-CE2 3.72Å; W330-Y555 WeakPolarHBondContact CZ3-OH 2.99Å
331	C	98.4	Very high	92.5	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.02	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	161.2	177.9	61.3	0	0	0	0	111.4	R314 L315 F329	R314-C331 CarbonylContact C-O 3.55Å; R314-C331 WeakPolarHBondContact CA-O 3.19Å; L315-C331 PolarHBondContact N-O 3.19Å; L315-C331 PolarHBondContact O-N 3.22Å; F329-C331 HydrophobicContact CD1-CB 4.29Å; F329-C331 HydrophobicContact CE1-CB 3.94Å
332	H	98.7	Very high	93	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.009	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	152.5	167.5	-164	-102.5	0	0	0	111.7	G313 Y334 S335 P542	G313-H332 PolarHBondContact O-CD2 3.24Å; H332-Y334 AromaticContact CE1-CD2 3.51Å; H332-Y334 AromaticContact CE1-CG 3.96Å; H332-Y334 AromaticContact ND1-CD2 3.69Å; H332-Y334 AromaticContact ND1-CG 3.73Å; H332-Y334 PolarHBondContact ND1-N 3.13Å; H332-Y334 PolarHBondContact O-N 3.36Å; H332-S335 VanDerWaalsContact O-CB 3.25Å; H332-S335 WeakPolarHBondContact O-CB 3.41Å; H332-S335 PolarHBondContact O-N 3.04Å; H332-P542 HydrophobicContact CB-CB 3.73Å; H332-P542 HydrophobicContact CB-CG 4.18Å; H332-P542 WeakPolarHBondContact CB-O 3.29Å
333	M	97.8	Very high	93.7	Very high	10 Å²	10	49.3 Å²	49.3	5%	0.049	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-8	173.1	63.3	175.7	175.5	0	0	115	Y283 F285 G313 L315	Y283-M333 HydrophobicContact CD1-CE 3.74Å; Y283-M333 HydrophobicContact CD1-SD 4.01Å; Y283-M333 HydrophobicContact CE1-CE 4.3Å; F285-M333 HydrophobicContact CD2-CB 3.72Å; F285-M333 HydrophobicContact CE2-CB 4.01Å; G313-M333 WeakPolarHBondContact O-CB 3.49Å; G313-M333 WeakPolarHBondContact O-CG 3.23Å; G313-M333 PolarHBondContact O-N 3.25Å; L315-M333 HydrophobicContact CD1-CB 4.26Å; L315-M333 HydrophobicContact CD2-CB 4.2Å; L315-M333 HydrophobicContact CG-CB 4.19Å
334	Y	97.6	Very high	94.7	Very high	80 Å²	80	40.4 Å²	40.4	31%	0.314	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	17.6	175.1	-57.3	-31.7	0	0	0	112.5	H162 H332	H162-Y334 HydrophobicContact CB-CD2 3.94Å; H162-Y334 HydrophobicContact CB-CE2 4.24Å; H332-Y334 AromaticContact CE1-CD2 3.51Å; H332-Y334 AromaticContact CE1-CG 3.96Å; H332-Y334 AromaticContact ND1-CD2 3.69Å; H332-Y334 AromaticContact ND1-CG 3.73Å; H332-Y334 PolarHBondContact ND1-N 3.13Å; H332-Y334 PolarHBondContact O-N 3.36Å
335	S	97.8	Very high	95.4	Very high	9 Å²	9	44.8 Å²	44.8	6%	0.063	22%	0.224	C	C	.	.			trans	-63.1	139	175.1	-178.5	0	0	0	0	110.8	H332 L337 I338	H332-S335 VanDerWaalsContact O-CB 3.25Å; H332-S335 WeakPolarHBondContact O-CB 3.41Å; H332-S335 PolarHBondContact O-N 3.04Å; S335-L337 PolarHBondContact O-N 2.76Å; S335-L337 VanDerWaalsContact O-N 3.16Å; S335-L337 PolarHBondContact OG-N 3.39Å; S335-I338 WeakPolarHBondContact O-CG1 3.49Å
336	P	96.3	Very high	96.1	Very high	94 Å²	94	44.2 Å²	44.2	61%	0.61	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	0.3	174.5	32.3	-37.2	0	0	0	113.4	H339	P336-H339 PolarHBondContact O-CE1 2.98Å; P336-H339 PolarHBondContact O-NE2 3.05Å
337	L	97.1	Very high	96.7	Very high	60 Å²	60	39.8 Å²	39.8	31%	0.314	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-2.1	-178	-54.7	178	0	0	0	113.5	V293 V294 F329 S335	V293-L337 WeakPolarHBondContact CA-O 3.42Å; V294-L337 HydrophobicContact CG1-CB 4.08Å; V294-L337 HydrophobicContact CG1-CD1 4.25Å; V294-L337 HydrophobicContact CG1-CD2 4.46Å; V294-L337 HydrophobicContact CG1-CG 4.5Å; V294-L337 PolarHBondContact N-O 2.99Å; F329-L337 HydrophobicContact CZ-CD1 3.99Å; S335-L337 PolarHBondContact O-N 2.76Å; S335-L337 VanDerWaalsContact O-N 3.16Å; S335-L337 PolarHBondContact OG-N 3.39Å
338	I	98	Very high	97	Very high	6 Å²	6	39.6 Å²	39.6	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	138	-179.2	65.2	170	0	0	0	111.5	E292 V293 L315 L317 S335 F371	E292-I338 CarbonylContact O-C 3.53Å; E292-I338 WeakPolarHBondContact O-CA 3.4Å; V293-I338 HydrophobicContact CB-CG2 4.11Å; V293-I338 HydrophobicContact CG2-CG2 3.87Å; L315-I338 HydrophobicContact CD1-CD1 3.83Å; L317-I338 HydrophobicContact CD1-CG2 3.81Å; S335-I338 WeakPolarHBondContact O-CG1 3.49Å; I338-F371 HydrophobicContact CB-CE1 4.34Å; I338-F371 HydrophobicContact CD1-CE1 4.41Å; I338-F371 HydrophobicContact CG1-CD1 4.19Å; I338-F371 HydrophobicContact CG1-CE1 4.23Å; I338-F371 WeakPolarHBondContact O-CD1 3.45Å
339	H	98.2	Very high	97.1	Very high	20 Å²	20	38.7 Å²	38.7	9%	0.093	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	164	-172.5	-46.6	-77.2	0	0	0	111.7	E292 P336 W343 F371	E292-H339 HydrophobicContact CB-CB 4.41Å; E292-H339 PolarHBondContact N-O 2.69Å; E292-H339 PolarHBondContact O-N 3.18Å; P336-H339 PolarHBondContact O-CE1 2.98Å; P336-H339 PolarHBondContact O-NE2 3.05Å; H339-W343 HydrophobicContact CB-CB 3.67Å; H339-W343 HydrophobicContact CB-CD2 3.53Å; H339-W343 HydrophobicContact CB-CE3 3.68Å; H339-W343 HydrophobicContact CB-CG 3.54Å; H339-W343 AromaticContact CD2-CD2 3.81Å; H339-W343 AromaticContact CD2-CE3 3.38Å; H339-W343 AromaticContact CD2-CH2 3.67Å; H339-W343 AromaticContact CD2-CZ3 3.33Å; H339-W343 WeakPolarHBondContact CD2-CZ3 3.45Å; H339-W343 AromaticContact CE1-CE2 3.83Å; H339-W343 AromaticContact CE1-CH2 3.71Å; H339-W343 AromaticContact CE1-CZ2 3.53Å; H339-W343 AromaticContact CG-CD2 3.36Å; H339-W343 AromaticContact CG-CE2 3.69Å; H339-W343 AromaticContact CG-CE3 3.41Å; H339-W343 VanDerWaalsContact CG-CE3 3.41Å; H339-W343 AromaticContact CG-CG 3.87Å; H339-W343 AromaticContact CG-CZ3 3.81Å; H339-W343 AromaticContact ND1-CD2 3.68Å; H339-W343 AromaticContact ND1-CE2 3.49Å; H339-W343 AromaticContact ND1-CZ2 3.71Å; H339-W343 AromaticContact ND1-NE1 3.91Å; H339-W343 AromaticContact NE2-CH2 3.42Å; H339-W343 WeakPolarHBondContact NE2-CH2 3.4Å; H339-W343 AromaticContact NE2-CZ2 3.76Å; H339-W343 AromaticContact NE2-CZ3 3.6Å; H339-F371 WeakPolarHBondContact O-CE1 3.38Å; H339-F371 VanDerWaalsContact O-CZ 3.29Å; H339-F371 WeakPolarHBondContact O-CZ 3.39Å
340	H	97.4	Very high	97.1	Very high	56 Å²	56	42.6 Å²	42.6	26%	0.259	22%	0.221	S	C	.	.			trans	-74.1	154.2	176.9	64.6	-91	0	0	0	111.5	G342 W343 P368 F371	H340-G342 PolarHBondContact O-N 2.76Å; H340-W343 VanDerWaalsContact O-CB 3.23Å; H340-W343 WeakPolarHBondContact O-CB 3.48Å; H340-W343 PolarHBondContact O-N 3.36Å; H340-P368 HydrophobicContact CB-CB 4.06Å; H340-P368 HydrophobicContact CB-CG 3.93Å; H340-F371 HydrophobicContact CB-CD2 3.99Å; H340-F371 HydrophobicContact CB-CE2 3.62Å; H340-F371 HydrophobicContact CB-CZ 4.2Å
341	I	96.4	Very high	97	Very high	50 Å²	50	44.8 Å²	44.8	26%	0.256	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	124.3	177.1	-56.2	-58	0	0	0	110	R290 E292 V304 D365	R290-I341 HydrophobicContact CB-CD1 4.09Å; R290-I341 HydrophobicContact CB-CG1 4.27Å; E292-I341 HydrophobicContact CG-CD1 4.17Å; V304-I341 HydrophobicContact CG1-CD1 4.08Å; V304-I341 HydrophobicContact CG2-CD1 4.31Å; I341-D365 HydrophobicContact CB-CB 4.34Å; I341-D365 HydrophobicContact CG1-CB 3.94Å
342	G	95.3	Very high	96.7	Very high	31 Å²	31	48.2 Å²	48.2	32%	0.32	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	103.3	-15.9	-174.8	0	0	0	0	0	114.7	E292 H340 S344 R345 S346	E292-G342 WeakPolarHBondContact OE1-CA 3.2Å; E292-G342 PolarHBondContact OE1-N 2.8Å; H340-G342 PolarHBondContact O-N 2.76Å; G342-S344 PolarHBondContact O-N 3.45Å; G342-R345 WeakPolarHBondContact O-CB 3.5Å; G342-R345 PolarHBondContact O-N 3.2Å; G342-S346 PolarHBondContact O-N 2.74Å
343	W	97.6	Very high	96.1	Very high	13 Å²	13	58.2 Å²	58.2	5%	0.049	28%	0.284	C	S	.	.	H	α-helix	trans	-56.3	-47.1	-176.1	169.8	81.2	0	0	0	113	T302 H339 H340 R345 S346 I347 H349 Y414	T302-W343 HydrophobicContact CG2-CE3 4.36Å; T302-W343 HydrophobicContact CG2-CZ3 3.83Å; H339-W343 HydrophobicContact CB-CB 3.67Å; H339-W343 HydrophobicContact CB-CD2 3.53Å; H339-W343 HydrophobicContact CB-CE3 3.68Å; H339-W343 HydrophobicContact CB-CG 3.54Å; H339-W343 AromaticContact CD2-CD2 3.81Å; H339-W343 AromaticContact CD2-CE3 3.38Å; H339-W343 AromaticContact CD2-CH2 3.67Å; H339-W343 AromaticContact CD2-CZ3 3.33Å; H339-W343 WeakPolarHBondContact CD2-CZ3 3.45Å; H339-W343 AromaticContact CE1-CE2 3.83Å; H339-W343 AromaticContact CE1-CH2 3.71Å; H339-W343 AromaticContact CE1-CZ2 3.53Å; H339-W343 AromaticContact CG-CD2 3.36Å; H339-W343 AromaticContact CG-CE2 3.69Å; H339-W343 AromaticContact CG-CE3 3.41Å; H339-W343 VanDerWaalsContact CG-CE3 3.41Å; H339-W343 AromaticContact CG-CG 3.87Å; H339-W343 AromaticContact CG-CZ3 3.81Å; H339-W343 AromaticContact ND1-CD2 3.68Å; H339-W343 AromaticContact ND1-CE2 3.49Å; H339-W343 AromaticContact ND1-CZ2 3.71Å; H339-W343 AromaticContact ND1-NE1 3.91Å; H339-W343 AromaticContact NE2-CH2 3.42Å; H339-W343 WeakPolarHBondContact NE2-CH2 3.4Å; H339-W343 AromaticContact NE2-CZ2 3.76Å; H339-W343 AromaticContact NE2-CZ3 3.6Å; H340-W343 VanDerWaalsContact O-CB 3.23Å; H340-W343 WeakPolarHBondContact O-CB 3.48Å; H340-W343 PolarHBondContact O-N 3.36Å; W343-R345 PolarHBondContact O-N 3.3Å; W343-S346 WeakPolarHBondContact O-CA 3.21Å; W343-S346 VanDerWaalsContact O-CB 3.29Å; W343-S346 WeakPolarHBondContact O-CB 3.45Å; W343-S346 PolarHBondContact O-N 3.06Å; W343-I347 HydrophobicContact CD2-CD1 4.43Å; W343-I347 HydrophobicContact CD2-CG1 4.36Å; W343-I347 HydrophobicContact CH2-CD1 3.61Å; W343-I347 HydrophobicContact CH2-CG1 4.38Å; W343-I347 HydrophobicContact CZ2-CD1 3.2Å; W343-I347 HydrophobicContact CZ2-CG1 4Å; W343-I347 HydrophobicContact CZ3-CD1 4.34Å; W343-I347 PolarHBondContact O-N 3.3Å; W343-H349 HydrophobicContact CZ3-CB 4.29Å; W343-Y414 AromaticContact CZ2-CD1 3.92Å; W343-Y414 HydrophobicContact CZ2-CD1 3.92Å; W343-Y414 HydrophobicContact CZ2-CD2 4.35Å; W343-Y414 AromaticContact CZ2-CE1 3.65Å; W343-Y414 HydrophobicContact CZ2-CE1 3.65Å; W343-Y414 HydrophobicContact CZ2-CE2 4.13Å; W343-Y414 HydrophobicContact CZ2-CG 4.25Å; W343-Y414 AromaticContact CZ2-CZ 3.75Å; W343-Y414 AromaticContact NE1-CE2 3.82Å; W343-Y414 AromaticContact NE1-CZ 3.86Å
344	S	97.1	Very high	94.9	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.7	-36.6	-177.4	-55.3	0	0	0	0	111.8	E292 T302 G342 G348 H349	E292-S344 WeakPolarHBondContact OE2-CB 3.43Å; E292-S344 PolarHBondContact OE2-N 3.41Å; E292-S344 PolarHBondContact OE2-OG 2.72Å; T302-S344 WeakPolarHBondContact CG2-OG 3.33Å; T302-S344 PolarHBondContact OG1-OG 2.92Å; G342-S344 PolarHBondContact O-N 3.45Å; S344-G348 PolarHBondContact O-N 3.2Å; S344-G348 VanDerWaalsContact O-N 3.1Å; S344-H349 PolarHBondContact O-N 2.89Å
345	R	96.4	Very high	93.4	Very high	188 Å²	188	62.6 Å²	62.6	71%	0.709	32%	0.316	S	S	*	.	H	α-helix	trans	-68.6	-40.6	173.7	-175.8	-173.2	-63.4	-143	2.4	111.4	G342 W343 F351	G342-R345 WeakPolarHBondContact O-CB 3.5Å; G342-R345 PolarHBondContact O-N 3.2Å; W343-R345 PolarHBondContact O-N 3.3Å; R345-F351 HydrophobicContact CB-CE1 4.2Å
346	S	96.4	Very high	91.4	Very high	83 Å²	83	69.7 Å²	69.7	58%	0.58	35%	0.352	S	S	*	.	H	α-helix	trans	-59	-49.4	178.5	-163	0	0	0	0	111.6	G342 W343	G342-S346 PolarHBondContact O-N 2.74Å; W343-S346 WeakPolarHBondContact O-CA 3.21Å; W343-S346 VanDerWaalsContact O-CB 3.29Å; W343-S346 WeakPolarHBondContact O-CB 3.45Å; W343-S346 PolarHBondContact O-N 3.06Å
347	I	95.9	Very high	89.3	Confident	5 Å²	5	71.5 Å²	71.5	3%	0.026	36%	0.361	C	S	.	.	H	α-helix	trans	-89.8	-7.7	-174.9	71.8	151.6	0	0	0	115.1	W343 H349 L410 A411 D412 Y414	W343-I347 HydrophobicContact CD2-CD1 4.43Å; W343-I347 HydrophobicContact CD2-CG1 4.36Å; W343-I347 HydrophobicContact CH2-CD1 3.61Å; W343-I347 HydrophobicContact CH2-CG1 4.38Å; W343-I347 HydrophobicContact CZ2-CD1 3.2Å; W343-I347 HydrophobicContact CZ2-CG1 4Å; W343-I347 HydrophobicContact CZ3-CD1 4.34Å; W343-I347 PolarHBondContact O-N 3.3Å; I347-H349 HydrophobicContact CD1-CB 4.02Å; I347-H349 HydrophobicContact CG1-CB 3.92Å; I347-L410 HydrophobicContact CD1-CB 4.33Å; I347-L410 HydrophobicContact CD1-CD1 3.73Å; I347-L410 HydrophobicContact CG1-CD1 4.44Å; I347-L410 WeakPolarHBondContact O-CB 3.21Å; I347-A411 HydrophobicContact CB-CB 4.34Å; I347-A411 PolarHBondContact O-N 3.49Å; I347-D412 HydrophobicContact CG2-CB 4.02Å; I347-D412 WeakPolarHBondContact CG2-OD2 3.42Å; I347-Y414 HydrophobicContact CD1-CD1 4.33Å; I347-Y414 HydrophobicContact CD1-CD2 3.74Å; I347-Y414 HydrophobicContact CD1-CE2 4.43Å; I347-Y414 HydrophobicContact CD1-CG 3.67Å; I347-Y414 HydrophobicContact CG2-CD2 4.3Å
348	G	96.3	Very high	87.2	Confident	35 Å²	35	75.9 Å²	75.9	36%	0.361	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	25.2	-177.1	0	0	0	0	0	114.8	S344 K408 L410	S344-G348 PolarHBondContact O-N 3.2Å; S344-G348 VanDerWaalsContact O-N 3.1Å; G348-K408 PolarHBondContact O-NZ 2.77Å; G348-L410 WeakPolarHBondContact O-CD2 3.37Å
349	H	97.4	Very high	85.3	Confident	12 Å²	12	81.6 Å²	81.6	6%	0.056	40%	0.402	C	S	.	.			trans	-75.6	153.4	170.3	-166.6	-87.6	0	0	0	110.5	C300 W343 S344 I347 L410 M416 C432	C300-H349 PolarHBondContact O-CE1 2.84Å; W343-H349 HydrophobicContact CZ3-CB 4.29Å; S344-H349 PolarHBondContact O-N 2.89Å; I347-H349 HydrophobicContact CD1-CB 4.02Å; I347-H349 HydrophobicContact CG1-CB 3.92Å; H349-L410 HydrophobicContact CB-CD1 4.04Å; H349-M416 PolarHBondContact CD2-SD 2.66Å; H349-C432 VanDerWaalsContact NE2-CB 3.34Å; H349-C432 WeakPolarHBondContact NE2-CB 3.49Å
350	R	95.9	Very high	83.5	Confident	107 Å²	107	85.8 Å²	85.8	40%	0.404	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	145.5	174.6	-50.6	172.6	171.6	-178	-5.2	108.9	C300 R301 T302 D426 G427	C300-R350 VanDerWaalsContact O-CB 3.31Å; C300-R350 WeakPolarHBondContact O-CB 2.92Å; C300-R350 PolarHBondContact SG-NH1 2.74Å; R301-R350 VanDerWaalsContact CA-O 3.24Å; R301-R350 WeakPolarHBondContact CA-O 3.32Å; R301-R350 HydrophobicContact CB-CB 3.88Å; T302-R350 PolarHBondContact N-O 3.08Å; T302-R350 VanDerWaalsContact N-O 3.08Å; R350-D426 PolarHBondContact NH1-O 3.49Å; R350-D426 PolarHBondContact NH2-O 3.04Å; R350-G427 PolarHBondContact NH1-O 2.75Å
351	F	94.8	Very high	81.9	Confident	76 Å²	76	92.7 Å²	92.7	33%	0.333	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	143.2	173.8	59.9	-88.2	0	0	0	110.1	T302 R345 R353	T302-F351 CarbonylContact O-C 3.59Å; T302-F351 WeakPolarHBondContact O-CA 3.45Å; T302-F351 WeakPolarHBondContact OG1-CB 3.26Å; R345-F351 HydrophobicContact CB-CE1 4.2Å; F351-R353 HydrophobicContact CE2-CG 4.12Å; F351-R353 PolarHBondContact O-N 3.27Å
352	K	93.3	Very high	81.1	Confident	75 Å²	75	93.1 Å²	93.1	33%	0.326	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-69.4	128.1	169.4	-164.8	-179.3	177.6	-165.1	0	108.4	T302 R303 E321	T302-K352 PolarHBondContact O-N 2.76Å; R303-K352 HydrophobicContact CB-CB 3.81Å; R303-K352 HydrophobicContact CB-CD 4.39Å; E321-K352 WeakPolarHBondContact OE1-CD 3.39Å; E321-K352 WeakPolarHBondContact OE1-CE 3.23Å; E321-K352 IonicContact OE1-NZ 2.68Å; E321-K352 PolarHBondContact OE1-NZ 3Å; E321-K352 WeakPolarHBondContact OE2-CD 3.46Å; E321-K352 IonicContact OE2-NZ 3.84Å; E321-K352 PolarHBondContact OE2-NZ 3.45Å
353	R	84.4	Confident	80.9	Confident	213 Å²	213	93.8 Å²	93.8	80%	0.804	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-76.8	124.2	171.9	-64	-178.6	-178.4	-178.1	0.9	108.1	F351	F351-R353 HydrophobicContact CE2-CG 4.12Å; F351-R353 PolarHBondContact O-N 3.27Å
354	S	73.3	Confident	80.7	Confident	43 Å²	43	97.7 Å²	97.7	30%	0.301	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-82.7	147.3	167.3	49.3	0	0	0	0	110.7	I356	S354-I356 PolarHBondContact O-N 3.35Å
355	D	66.6	Low	80.6	Confident	138 Å²	138	101 Å²	101	74%	0.738	50%	0.501	S	S	*	.			trans	-70.7	113.6	171.5	-69.3	-42.7	0	0	0	109.6	T357 K358	D355-T357 PolarHBondContact O-N 2.78Å; D355-K358 PolarHBondContact O-N 3.26Å
356	I	55	Low	80.7	Confident	159 Å²	159	92.2 Å²	92.2	82%	0.815	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-61.1	-16.7	-169.5	-63.6	172.7	0	0	0	112.5	S354 K358	S354-I356 PolarHBondContact O-N 3.35Å; I356-K358 VanDerWaalsContact C-N 3.27Å; I356-K358 PolarHBondContact O-N 3.04Å
357	T	52.1	Low	80.7	Confident	132 Å²	132	90.4 Å²	90.4	81%	0.81	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-70.5	-10.4	179.9	51	0	0	0	0	115.2	D355	D355-T357 PolarHBondContact O-N 2.78Å
358	K	54.4	Low	80.7	Confident	152 Å²	152	94.1 Å²	94.1	66%	0.661	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-120.9	40.6	-177.6	-67.9	-172.2	179.5	178.9	0	115	D355 I356 Q360	D355-K358 PolarHBondContact O-N 3.26Å; I356-K358 VanDerWaalsContact C-N 3.27Å; I356-K358 PolarHBondContact O-N 3.04Å; K358-Q360 PolarHBondContact O-N 3.27Å
359	K	56.4	Low	80.7	Confident	126 Å²	126	99.4 Å²	99.4	55%	0.548	49%	0.494	S	S	.	.			trans	-65.5	102.6	160.1	-95.7	-155.3	172	-162.3	0	108.7	D365	K359-D365 IonicContact NZ-OD1 3.28Å; K359-D365 IonicContact NZ-OD2 3.98Å
360	Q	60.5	Low	80.7	Confident	108 Å²	108	100 Å²	100	51%	0.505	50%	0.497	S	S	.	.			trans	-63.6	140.7	175.4	-62	-179.5	10.5	0	0	110.3	K358 G362 H363	K358-Q360 PolarHBondContact O-N 3.27Å; Q360-G362 PolarHBondContact O-N 3.13Å; Q360-H363 PolarHBondContact OE1-CE1 3.27Å; Q360-H363 VanDerWaalsContact OE1-CE1 3.32Å
361	E	63.5	Low	80.8	Confident	201 Å²	201	96 Å²	96	94%	0.939	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	135.7	-178.6	-63.7	-171.4	127.5	0	0	111.3
362	G	80.8	Confident	80.7	Confident	59 Å²	59	97.6 Å²	97.6	61%	0.608	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.7	-6.2	178.3	0	0	0	0	0	116.3	Q360	Q360-G362 PolarHBondContact O-N 3.13Å
363	H	89.9	Confident	80.6	Confident	45 Å²	45	103 Å²	103	21%	0.208	52%	0.516	C	S	.	.			trans	-82.9	135.3	171.4	-62.4	171	0	0	0	111.9	S288 R290 Q360	S288-H363 WeakPolarHBondContact O-CA 3.34Å; R290-H363 HydrophobicContact CG-CB 3.9Å; Q360-H363 PolarHBondContact OE1-CE1 3.27Å; Q360-H363 VanDerWaalsContact OE1-CE1 3.32Å
364	F	93.6	Very high	80.9	Confident	95 Å²	95	95.7 Å²	95.7	42%	0.417	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	151.9	-177	62.3	-84.7	0	0	0	112.1	S288 M289 R290	S288-F364 PolarHBondContact O-N 3Å; M289-F364 CarbonylContact C-O 3.55Å; M289-F364 VanDerWaalsContact CA-O 3.29Å; M289-F364 WeakPolarHBondContact CA-O 3.48Å; M289-F364 HydrophobicContact CE-CE2 3.83Å; M289-F364 HydrophobicContact CE-CZ 4.27Å; M289-F364 HydrophobicContact CG-CD2 4.19Å; M289-F364 HydrophobicContact CG-CE2 3.44Å; M289-F364 VanDerWaalsContact CG-CE2 3.44Å; M289-F364 HydrophobicContact CG-CZ 3.65Å; M289-F364 HydrophobicContact SD-CE2 4.48Å; R290-F364 PolarHBondContact N-O 3.24Å
365	D	96.3	Very high	81.6	Confident	70 Å²	70	99.4 Å²	99.4	37%	0.374	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	134	-170.7	-58.4	-34.1	0	0	0	111.6	R290 I341 K359 P367	R290-D365 WeakPolarHBondContact CD-OD1 3.11Å; R290-D365 IonicContact CZ-OD1 3.69Å; R290-D365 IonicContact NE-OD1 3.87Å; R290-D365 IonicContact NH1-OD1 2.72Å; R290-D365 PolarHBondContact NH1-OD1 2.9Å; I341-D365 HydrophobicContact CB-CB 4.34Å; I341-D365 HydrophobicContact CG1-CB 3.94Å; K359-D365 IonicContact NZ-OD1 3.28Å; K359-D365 IonicContact NZ-OD2 3.98Å; D365-P367 WeakPolarHBondContact O-CD 3.25Å
366	A	97.3	Very high	82.5	Confident	3 Å²	3	102 Å²	102	3%	0.025	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-66	125.9	-179.3	0	0	0	0	0	111.2	F285 M289 R290 V291 F371	F285-A366 HydrophobicContact CE1-CB 4.08Å; M289-A366 HydrophobicContact CB-CB 4.23Å; M289-A366 HydrophobicContact SD-CB 4.36Å; R290-A366 VanDerWaalsContact O-CB 3.28Å; R290-A366 WeakPolarHBondContact O-CB 3.43Å; R290-A366 PolarHBondContact O-N 2.88Å; V291-A366 HydrophobicContact CG1-CB 3.9Å; A366-F371 HydrophobicContact CB-CE2 3.85Å; A366-F371 HydrophobicContact CB-CZ 3.8Å
367	P	97.1	Very high	84	Confident	44 Å²	44	96.4 Å²	96.4	29%	0.286	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-59.6	132.7	-178.7	-26	34.3	0	0	0	112.8	D365 H369 L370	D365-P367 WeakPolarHBondContact O-CD 3.25Å; P367-H369 VanDerWaalsContact CB-CE1 3.41Å; P367-H369 WeakPolarHBondContact CB-CE1 3.22Å; P367-H369 PolarHBondContact O-N 3.46Å; P367-L370 HydrophobicContact CB-CG 4.3Å; P367-L370 HydrophobicContact CG-CD1 4.48Å; P367-L370 WeakPolarHBondContact O-CB 3.48Å; P367-L370 PolarHBondContact O-N 3.24Å
368	P	96.5	Very high	85.5	Confident	83 Å²	83	96.2 Å²	96.2	54%	0.539	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-57	-23.5	-175.5	-28.8	34.8	0	0	0	115.7	H340 L370	H340-P368 HydrophobicContact CB-CB 4.06Å; H340-P368 HydrophobicContact CB-CG 3.93Å; P368-L370 VanDerWaalsContact C-N 3.26Å; P368-L370 PolarHBondContact O-N 3.26Å
369	H	96.1	Very high	86.9	Confident	146 Å²	146	92.6 Å²	92.6	68%	0.676	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-76.4	-5.6	178.9	68.6	-100.5	0	0	0	114.5	P367	P367-H369 VanDerWaalsContact CB-CE1 3.41Å; P367-H369 WeakPolarHBondContact CB-CE1 3.22Å; P367-H369 PolarHBondContact O-N 3.46Å
370	L	97.1	Very high	87.9	Confident	24 Å²	24	91 Å²	91	13%	0.126	48%	0.482	C	S	.	.	G	3₁₀ helix	trans	-83	-22.6	175.9	-61.2	-167.7	0	0	0	113.6	P284 F285 M289 P367 P368	P284-L370 HydrophobicContact CB-CD2 3.85Å; P284-L370 HydrophobicContact CG-CD2 4.34Å; F285-L370 HydrophobicContact CD2-CB 4.31Å; F285-L370 HydrophobicContact CE1-CB 4.44Å; F285-L370 HydrophobicContact CE2-CB 3.72Å; F285-L370 WeakPolarHBondContact CE2-O 3.28Å; F285-L370 HydrophobicContact CG-CD1 4.46Å; F285-L370 HydrophobicContact CZ-CB 3.8Å; M289-L370 HydrophobicContact CE-CD1 3.89Å; M289-L370 HydrophobicContact SD-CD1 4.01Å; P367-L370 HydrophobicContact CB-CG 4.3Å; P367-L370 HydrophobicContact CG-CD1 4.48Å; P367-L370 WeakPolarHBondContact O-CB 3.48Å; P367-L370 PolarHBondContact O-N 3.24Å; P368-L370 VanDerWaalsContact C-N 3.26Å; P368-L370 PolarHBondContact O-N 3.26Å
371	F	97.1	Very high	89	Confident	23 Å²	23	88.5 Å²	88.5	10%	0.101	49%	0.485	C	S	.	.	S	Bend	trans	-78.7	155.5	-177.2	-62.9	-93.5	0	0	0	111.1	F285 V291 I338 H339 H340 A366 K373	F285-F371 HydrophobicContact CE1-CE1 4.11Å; F285-F371 HydrophobicContact CE1-CE2 4.35Å; F285-F371 AromaticContact CE1-CZ 3.92Å; F285-F371 HydrophobicContact CE1-CZ 3.92Å; F285-F371 HydrophobicContact CZ-CD1 4.04Å; F285-F371 HydrophobicContact CZ-CD2 4.35Å; F285-F371 AromaticContact CZ-CE1 3.87Å; F285-F371 HydrophobicContact CZ-CE1 3.87Å; F285-F371 HydrophobicContact CZ-CE2 4.2Å; F285-F371 HydrophobicContact CZ-CG 4.28Å; F285-F371 AromaticContact CZ-CZ 3.96Å; F285-F371 HydrophobicContact CZ-CZ 3.96Å; V291-F371 HydrophobicContact CB-CE1 4.45Å; V291-F371 HydrophobicContact CB-CZ 4.32Å; V291-F371 HydrophobicContact CG1-CE1 4.21Å; V291-F371 HydrophobicContact CG1-CZ 3.88Å; I338-F371 HydrophobicContact CB-CE1 4.34Å; I338-F371 HydrophobicContact CD1-CE1 4.41Å; I338-F371 HydrophobicContact CG1-CD1 4.19Å; I338-F371 HydrophobicContact CG1-CE1 4.23Å; I338-F371 WeakPolarHBondContact O-CD1 3.45Å; H339-F371 WeakPolarHBondContact O-CE1 3.38Å; H339-F371 VanDerWaalsContact O-CZ 3.29Å; H339-F371 WeakPolarHBondContact O-CZ 3.39Å; H340-F371 HydrophobicContact CB-CD2 3.99Å; H340-F371 HydrophobicContact CB-CE2 3.62Å; H340-F371 HydrophobicContact CB-CZ 4.2Å; A366-F371 HydrophobicContact CB-CE2 3.85Å; A366-F371 HydrophobicContact CB-CZ 3.8Å; F371-K373 PolarHBondContact O-N 2.82Å
372	M	93.6	Very high	90.2	Very high	111 Å²	111	85.2 Å²	85.2	55%	0.547	47%	0.47	S	S	.	.			trans	-60.6	124.7	174.2	-172.7	-168.3	-67.1	0	0	109.5	V374	M372-V374 PolarHBondContact O-N 2.82Å
373	K	91.3	Very high	91	Very high	187 Å²	187	84.2 Å²	84.2	81%	0.813	45%	0.448	S	S	*	.			trans	-69.1	113.2	169.9	-67.9	-169.1	177.2	-170.6	0	109.5	F371	F371-K373 PolarHBondContact O-N 2.82Å
374	V	90.3	Very high	91.3	Very high	61 Å²	61	82.3 Å²	82.3	37%	0.37	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-71.1	145.3	172.5	179.2	0	0	0	0	109.5	M372 E376 H434	M372-V374 PolarHBondContact O-N 2.82Å; V374-E376 PolarHBondContact O-N 3.39Å; V374-H434 HydrophobicContact CG1-CB 4.19Å; V374-H434 WeakPolarHBondContact CG1-CE1 3.5Å; V374-H434 VanDerWaalsContact CG1-CG 3.45Å; V374-H434 WeakPolarHBondContact CG1-ND1 3.2Å
375	K	87.8	Confident	91.5	Very high	120 Å²	120	84.2 Å²	84.2	52%	0.522	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-69	117.4	-178.5	-177.2	173.6	-175	171.3	0	109.8	H434 T436 E486	K375-H434 PolarHBondContact O-CE1 2.87Å; K375-H434 VanDerWaalsContact O-CE1 3.3Å; K375-T436 HydrophobicContact CB-CG2 4.39Å; K375-E486 IonicContact NZ-OE2 3.34Å; K375-E486 PolarHBondContact NZ-OE2 3.37Å; K375-E486 VanDerWaalsContact NZ-OE2 3.11Å
376	E	86.6	Confident	91.6	Very high	192 Å²	192	86.7 Å²	86.7	90%	0.897	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-54.9	142.6	175	-68.3	170.7	-160.8	0	0	111.4	V374	V374-E376 PolarHBondContact O-N 3.39Å
377	V	86.6	Confident	91.6	Very high	43 Å²	43	88.2 Å²	88.2	26%	0.261	47%	0.473	S	S	.	.			trans	-132.3	137.2	-176.7	-73	0	0	0	0	110.6	T379 W383 T436	V377-T379 HydrophobicContact CG2-CG2 4.36Å; V377-T379 PolarHBondContact O-N 3.02Å; V377-W383 HydrophobicContact CB-CH2 3.71Å; V377-W383 HydrophobicContact CB-CZ3 4.19Å; V377-W383 HydrophobicContact CG1-CH2 4.22Å; V377-W383 HydrophobicContact CG2-CH2 3.6Å; V377-W383 HydrophobicContact CG2-CZ2 4.02Å; V377-W383 HydrophobicContact CG2-CZ3 4.45Å; V377-T436 HydrophobicContact CG1-CG2 3.66Å
378	D	83.3	Confident	91.7	Very high	127 Å²	127	86.6 Å²	86.6	68%	0.679	46%	0.461	S	S	*	.			trans	-77.9	114.4	174.3	-180	9.2	0	0	0	110.2	A380	D378-A380 WeakPolarHBondContact OD1-CB 3.27Å; D378-A380 PolarHBondContact OD1-N 3.19Å
379	T	83.3	Confident	91.8	Very high	76 Å²	76	83.4 Å²	83.4	47%	0.466	44%	0.439	S	S	.	.			trans	-100	-1.1	179.8	58.7	0	0	0	0	113.3	V377 G381 W383	V377-T379 HydrophobicContact CG2-CG2 4.36Å; V377-T379 PolarHBondContact O-N 3.02Å; T379-G381 VanDerWaalsContact C-N 3.31Å; T379-G381 PolarHBondContact O-N 2.72Å; T379-W383 HydrophobicContact CG2-CD2 3.98Å; T379-W383 HydrophobicContact CG2-CE3 4.33Å; T379-W383 HydrophobicContact CG2-CG 4.48Å; T379-W383 HydrophobicContact CG2-CH2 4.4Å; T379-W383 HydrophobicContact CG2-CZ2 4.02Å
380	A	78.3	Confident	91.9	Very high	93 Å²	93	76.5 Å²	76.5	77%	0.769	41%	0.407	S	S	*	.	S	Bend	trans	-78.4	-12	-175.1	0	0	0	0	0	114.2	D378	D378-A380 WeakPolarHBondContact OD1-CB 3.27Å; D378-A380 PolarHBondContact OD1-N 3.19Å
381	G	83.3	Confident	92	Very high	55 Å²	55	75.4 Å²	75.4	57%	0.567	40%	0.401	S	S	*	.	S	Bend	trans	-96.7	-147.5	179.9	0	0	0	0	0	114.5	T379 W383	T379-G381 VanDerWaalsContact C-N 3.31Å; T379-G381 PolarHBondContact O-N 2.72Å; G381-W383 PolarHBondContact O-N 2.84Å
382	E	89.1	Confident	92.1	Very high	132 Å²	132	74.3 Å²	74.3	62%	0.617	40%	0.396	S	S	*	.	S	Bend	trans	-67.3	112.4	164.1	-82.2	175.4	-105.6	0	0	109.7	K481 L482	E382-K481 IonicContact OE1-NZ 2.62Å; E382-K481 PolarHBondContact OE1-NZ 2.84Å; E382-K481 WeakPolarHBondContact OE2-CE 3.47Å; E382-K481 IonicContact OE2-NZ 2.72Å; E382-K481 PolarHBondContact OE2-NZ 2.9Å; E382-L482 WeakPolarHBondContact O-CD2 3.49Å
383	W	95.9	Very high	92.3	Very high	38 Å²	38	69.1 Å²	69.1	14%	0.144	37%	0.371	C	S	.	.			trans	-115.1	173.6	179	-163.9	-115.8	0	0	0	112.7	V377 T379 G381 A435	V377-W383 HydrophobicContact CB-CH2 3.71Å; V377-W383 HydrophobicContact CB-CZ3 4.19Å; V377-W383 HydrophobicContact CG1-CH2 4.22Å; V377-W383 HydrophobicContact CG2-CH2 3.6Å; V377-W383 HydrophobicContact CG2-CZ2 4.02Å; V377-W383 HydrophobicContact CG2-CZ3 4.45Å; T379-W383 HydrophobicContact CG2-CD2 3.98Å; T379-W383 HydrophobicContact CG2-CE3 4.33Å; T379-W383 HydrophobicContact CG2-CG 4.48Å; T379-W383 HydrophobicContact CG2-CH2 4.4Å; T379-W383 HydrophobicContact CG2-CZ2 4.02Å; G381-W383 PolarHBondContact O-N 2.84Å; W383-A435 HydrophobicContact CH2-CB 3.54Å; W383-A435 HydrophobicContact CZ2-CB 3.5Å
384	F	97.7	Very high	92.5	Very high	5 Å²	5	61.5 Å²	61.5	2%	0.022	34%	0.339	C	S	.	.			trans	-58.7	148.7	168.1	-71.8	-74.1	0	0	0	111	I406 L415 A435 A478 L482 F483	F384-I406 HydrophobicContact CB-CD1 3.79Å; F384-I406 HydrophobicContact CD1-CD1 3.33Å; F384-I406 HydrophobicContact CE1-CD1 4.13Å; F384-I406 HydrophobicContact CG-CD1 3.85Å; F384-L415 HydrophobicContact CB-CD1 4.44Å; F384-L415 HydrophobicContact CB-CD2 3.85Å; F384-L415 HydrophobicContact CD1-CD1 4.39Å; F384-L415 HydrophobicContact CD2-CD1 3.82Å; F384-L415 HydrophobicContact CD2-CD2 4.35Å; F384-L415 HydrophobicContact CE2-CD1 4.06Å; F384-L415 HydrophobicContact CG-CD1 3.98Å; F384-L415 HydrophobicContact CG-CD2 4.27Å; F384-L415 HydrophobicContact CZ-CD1 4.41Å; F384-A435 HydrophobicContact CD2-CB 4.16Å; F384-A435 HydrophobicContact CE2-CB 3.77Å; F384-A478 HydrophobicContact CD1-CB 4.09Å; F384-A478 HydrophobicContact CE1-CB 3.91Å; F384-L482 HydrophobicContact CB-CD1 4.42Å; F384-L482 HydrophobicContact CD1-CB 4.36Å; F384-L482 HydrophobicContact CD1-CD1 3.61Å; F384-L482 HydrophobicContact CD2-CB 4.18Å; F384-L482 HydrophobicContact CD2-CD1 4.09Å; F384-L482 HydrophobicContact CE1-CB 3.82Å; F384-L482 HydrophobicContact CE1-CD1 3.88Å; F384-L482 HydrophobicContact CE2-CB 3.6Å; F384-L482 HydrophobicContact CE2-CD1 4.3Å; F384-L482 HydrophobicContact CG-CD1 3.76Å; F384-L482 HydrophobicContact CZ-CB 3.42Å; F384-L482 VanDerWaalsContact CZ-CB 3.42Å; F384-L482 HydrophobicContact CZ-CD1 4.22Å; F384-L482 HydrophobicContact CZ-CG 4.47Å; F384-F483 HydrophobicContact CE1-CE1 4.35Å; F384-F483 HydrophobicContact CE1-CE2 4.1Å; F384-F483 AromaticContact CE1-CZ 3.93Å; F384-F483 HydrophobicContact CE1-CZ 3.93Å; F384-F483 HydrophobicContact CZ-CE1 4.38Å; F384-F483 HydrophobicContact CZ-CE2 4.44Å; F384-F483 HydrophobicContact CZ-CZ 4.33Å
385	K	97.7	Very high	92.6	Very high	136 Å²	136	60.4 Å²	60.4	59%	0.591	33%	0.333	S	S	*	.			trans	-137.4	154.3	-179.9	-57.7	-174.5	-178.3	-177	0	110.9	M388 I406	K385-M388 HydrophobicContact CB-CE 3.97Å; K385-M388 HydrophobicContact CB-CG 4.22Å; K385-M388 HydrophobicContact CB-SD 4.17Å; K385-M388 HydrophobicContact CD-CE 4.23Å; K385-M388 HydrophobicContact CG-CE 3.93Å; K385-M388 PolarHBondContact N-SD 2.87Å; K385-M388 VanDerWaalsContact O-CB 3.32Å; K385-M388 WeakPolarHBondContact O-CB 3.27Å; K385-M388 WeakPolarHBondContact O-CG 3.34Å; K385-M388 PolarHBondContact O-N 3.29Å; K385-I406 WeakPolarHBondContact O-CB 3.46Å
386	E	98	Very high	92.7	Very high	121 Å²	121	59.3 Å²	59.3	57%	0.565	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	143.5	172.9	-63	175.9	-174.1	0	0	110.6	M388 I406 K408 V409	E386-M388 VanDerWaalsContact C-N 3.26Å; E386-M388 PolarHBondContact O-N 3.18Å; E386-I406 WeakPolarHBondContact CA-O 3.44Å; E386-K408 WeakPolarHBondContact OE1-CA 3.4Å; E386-V409 HydrophobicContact CG-CG2 4.38Å; E386-V409 PolarHBondContact OE1-N 3.4Å
387	G	98	Very high	93	Very high	36 Å²	36	53 Å²	53	37%	0.371	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	-11.2	-174.2	0	0	0	0	0	115.5	I406	G387-I406 PolarHBondContact N-O 2.68Å
388	M	98.7	Very high	93.3	Very high	10 Å²	10	52.1 Å²	52.1	5%	0.049	30%	0.299	C	S	.	.			trans	-64.3	136.4	173	-73	-175.3	169.1	0	0	111.5	K385 E386 I406 I476 A478	K385-M388 HydrophobicContact CB-CE 3.97Å; K385-M388 HydrophobicContact CB-CG 4.22Å; K385-M388 HydrophobicContact CB-SD 4.17Å; K385-M388 HydrophobicContact CD-CE 4.23Å; K385-M388 HydrophobicContact CG-CE 3.93Å; K385-M388 PolarHBondContact N-SD 2.87Å; K385-M388 VanDerWaalsContact O-CB 3.32Å; K385-M388 WeakPolarHBondContact O-CB 3.27Å; K385-M388 WeakPolarHBondContact O-CG 3.34Å; K385-M388 PolarHBondContact O-N 3.29Å; E386-M388 VanDerWaalsContact C-N 3.26Å; E386-M388 PolarHBondContact O-N 3.18Å; M388-I406 HydrophobicContact CB-CD1 4.17Å; M388-I406 HydrophobicContact CB-CG1 4.37Å; M388-I406 PolarHBondContact O-N 3.47Å; M388-I476 WeakPolarHBondContact CA-O 3.44Å; M388-I476 HydrophobicContact CE-CD1 3.99Å; M388-I476 HydrophobicContact CG-CD1 4.31Å; M388-I476 HydrophobicContact CG-CG1 4.19Å; M388-A478 HydrophobicContact CB-CB 4.15Å; M388-A478 HydrophobicContact SD-CB 4.18Å
389	K	98.7	Very high	93.8	Very high	16 Å²	16	47.4 Å²	47.4	7%	0.07	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	146.5	176.2	-58.1	-60.6	-174	172.4	0	112.6	A404 T405 D420 V443 W466 L470 S475 I476 A478	K389-A404 WeakPolarHBondContact CA-O 3.29Å; K389-T405 HydrophobicContact CD-CG2 4.47Å; K389-T405 WeakPolarHBondContact CD-OG1 3.47Å; K389-T405 PolarHBondContact NZ-OG1 2.89Å; K389-D420 IonicContact NZ-OD1 2.89Å; K389-D420 IonicContact NZ-OD2 2.68Å; K389-D420 PolarHBondContact NZ-OD2 2.78Å; K389-V443 HydrophobicContact CB-CG2 4.31Å; K389-W466 HydrophobicContact CB-CH2 4.15Å; K389-W466 HydrophobicContact CB-CZ3 3.78Å; K389-W466 HydrophobicContact CG-CZ3 4.32Å; K389-L470 HydrophobicContact CB-CD2 3.92Å; K389-L470 HydrophobicContact CG-CD2 3.69Å; K389-S475 WeakPolarHBondContact CE-OG 3.34Å; K389-S475 VanDerWaalsContact CG-OG 3.3Å; K389-S475 WeakPolarHBondContact CG-OG 3.32Å; K389-I476 PolarHBondContact N-O 3.11Å; K389-A478 PolarHBondContact O-N 3.03Å
390	L	98.8	Very high	94.4	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	179.5	176.1	68.8	148.2	0	0	0	111.5	A392 A404 I406 I417 I440 W466 F483	L390-A392 HydrophobicContact CD1-CB 4.46Å; L390-A404 HydrophobicContact CD2-CB 4.47Å; L390-A404 HydrophobicContact CG-CB 4.26Å; L390-A404 PolarHBondContact N-O 3.19Å; L390-A404 PolarHBondContact O-N 3.27Å; L390-I406 HydrophobicContact CD2-CD1 4.31Å; L390-I406 HydrophobicContact CD2-CG1 3.55Å; L390-I417 HydrophobicContact CD1-CD1 4.24Å; L390-I417 HydrophobicContact CD2-CG2 4.4Å; L390-I440 HydrophobicContact CD1-CB 3.73Å; L390-I440 HydrophobicContact CD1-CG2 3.85Å; L390-W466 WeakPolarHBondContact O-CH2 3.25Å; L390-F483 HydrophobicContact CB-CE1 4.39Å; L390-F483 HydrophobicContact CB-CZ 3.94Å; L390-F483 HydrophobicContact CD1-CE1 4.27Å
391	E	98.8	Very high	95.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	138.2	166.8	-67.8	175.5	-164.2	0	0	108.9	I401 C402 F441 G444 F445 C446 L453 W466	E391-I401 HydrophobicContact CB-CG2 4.08Å; E391-C402 WeakPolarHBondContact CA-O 3.28Å; E391-F441 HydrophobicContact CB-CB 4.19Å; E391-F441 HydrophobicContact CB-CD2 4.41Å; E391-F441 PolarHBondContact N-O 2.75Å; E391-F441 PolarHBondContact O-N 2.69Å; E391-G444 WeakPolarHBondContact OE1-CA 3.31Å; E391-G444 PolarHBondContact OE1-N 3.19Å; E391-F445 PolarHBondContact OE1-N 3.05Å; E391-F445 WeakPolarHBondContact OE2-CB 3.39Å; E391-F445 PolarHBondContact OE2-N 3.22Å; E391-C446 VanDerWaalsContact OE2-CB 3.31Å; E391-C446 WeakPolarHBondContact OE2-CB 3.41Å; E391-C446 PolarHBondContact OE2-N 3.38Å; E391-C446 PolarHBondContact OE2-SG 3.44Å; E391-L453 HydrophobicContact CG-CD1 3.86Å; E391-L453 HydrophobicContact CG-CD2 4.46Å; E391-W466 HydrophobicContact CG-CZ2 3.59Å; E391-W466 PolarHBondContact OE1-NE1 2.87Å
392	A	98.4	Very high	96.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	149.4	-179.5	0	0	0	0	0	111.9	L390 I401 C402 A404 F431 S439 I440	L390-A392 HydrophobicContact CD1-CB 4.46Å; A392-I401 CarbonylContact O-C 3.59Å; A392-I401 WeakPolarHBondContact O-CA 3.34Å; A392-I401 WeakPolarHBondContact O-CG2 3.45Å; A392-C402 PolarHBondContact N-O 3.04Å; A392-C402 PolarHBondContact O-N 3.05Å; A392-A404 HydrophobicContact CB-CB 3.92Å; A392-F431 HydrophobicContact CB-CE2 4.48Å; A392-F431 HydrophobicContact CB-CZ 4.31Å; A392-S439 WeakPolarHBondContact CA-O 3.35Å; A392-I440 HydrophobicContact CB-CG2 4.26Å
393	I	98.1	Very high	96.6	Very high	3 Å²	3	31 Å²	31	2%	0.015	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	133.2	166.1	-52.1	179.5	0	0	0	107.9	P395 L398 I401 S439 F441 L521 W536	I393-P395 WeakPolarHBondContact O-CD 3.4Å; I393-L398 HydrophobicContact CG2-CB 4.3Å; I393-L398 HydrophobicContact CG2-CG 4.45Å; I393-I401 HydrophobicContact CG1-CG1 4.41Å; I393-S439 PolarHBondContact N-O 3.43Å; I393-F441 HydrophobicContact CD1-CE2 4.49Å; I393-F441 HydrophobicContact CD1-CZ 4.25Å; I393-F441 HydrophobicContact CG1-CE2 3.82Å; I393-F441 HydrophobicContact CG1-CZ 4.08Å; I393-L521 HydrophobicContact CD1-CD1 4.05Å; I393-W536 HydrophobicContact CD1-CB 3.96Å; I393-W536 HydrophobicContact CG1-CB 4.44Å
394	D	95.2	Very high	96.7	Very high	27 Å²	27	29.2 Å²	29.2	14%	0.144	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	117.1	175.8	-178	-13.5	0	0	0	110	L396 N397 L398 A400	D394-L396 PolarHBondContact O-N 3.14Å; D394-L396 WeakPolarHBondContact OD1-CB 3.38Å; D394-L396 PolarHBondContact OD1-N 3.06Å; D394-N397 HydrophobicContact CB-CB 4.28Å; D394-N397 CarbonylContact O-C 3.2Å; D394-N397 PolarHBondContact O-N 2.95Å; D394-N397 PolarHBondContact OD1-N 2.89Å; D394-L398 PolarHBondContact O-N 2.78Å; D394-A400 PolarHBondContact N-O 2.69Å
395	P	91.7	Very high	96.7	Very high	38 Å²	38	29 Å²	29	25%	0.247	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-15.9	-179.4	30.7	-37.4	0	0	0	113.6	L299 I393 F431	L299-P395 HydrophobicContact CD1-CB 4.31Å; L299-P395 HydrophobicContact CD1-CG 3.73Å; I393-P395 WeakPolarHBondContact O-CD 3.4Å; P395-F431 HydrophobicContact CG-CB 3.91Å; P395-F431 HydrophobicContact CG-CD1 3.82Å; P395-F431 HydrophobicContact CG-CD2 4.08Å; P395-F431 HydrophobicContact CG-CE1 4.38Å; P395-F431 HydrophobicContact CG-CG 3.67Å
396	L	90.4	Very high	96.8	Very high	97 Å²	97	22.6 Å²	22.6	51%	0.508	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-4	173	-61.1	178	0	0	0	112.4	L299 D394 M504	L299-L396 HydrophobicContact CD1-CD1 4.26Å; L299-L396 HydrophobicContact CD1-CD2 3.84Å; L299-L396 HydrophobicContact CD1-CG 3.85Å; L299-L396 HydrophobicContact CG-CD2 4.41Å; D394-L396 PolarHBondContact O-N 3.14Å; D394-L396 WeakPolarHBondContact OD1-CB 3.38Å; D394-L396 PolarHBondContact OD1-N 3.06Å; L396-M504 WeakPolarHBondContact O-CE 3.37Å
397	N	92.5	Very high	96.8	Very high	60 Å²	60	21.3 Å²	21.3	32%	0.321	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	77.6	177.6	178	25.3	0	0	0	110.8	D394 S399 A400	D394-N397 HydrophobicContact CB-CB 4.28Å; D394-N397 CarbonylContact O-C 3.2Å; D394-N397 PolarHBondContact O-N 2.95Å; D394-N397 PolarHBondContact OD1-N 2.89Å; N397-S399 PolarHBondContact O-N 3.09Å; N397-S399 PolarHBondContact OD1-OG 3.23Å; N397-A400 WeakPolarHBondContact ND2-CB 3.41Å; N397-A400 PolarHBondContact O-N 3.04Å
398	L	93.6	Very high	96.7	Very high	24 Å²	24	23.4 Å²	23.4	13%	0.126	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	-3.4	-175.1	-60.2	93.8	0	0	0	114.1	I393 D394 A400 L503 M504 Q535 W536	I393-L398 HydrophobicContact CG2-CB 4.3Å; I393-L398 HydrophobicContact CG2-CG 4.45Å; D394-L398 PolarHBondContact O-N 2.78Å; L398-A400 VanDerWaalsContact C-N 3.27Å; L398-L503 HydrophobicContact CD1-CB 3.93Å; L398-L503 HydrophobicContact CD2-CB 3.74Å; L398-L503 HydrophobicContact CD2-CD1 3.63Å; L398-L503 HydrophobicContact CD2-CG 4.3Å; L398-L503 HydrophobicContact CG-CB 4.42Å; L398-M504 HydrophobicContact CD1-SD 3.86Å; L398-Q535 HydrophobicContact CB-CB 4.29Å; L398-Q535 HydrophobicContact CB-CG 4.11Å; L398-W536 PolarHBondContact O-N 2.89Å
399	S	94.3	Very high	96.7	Very high	28 Å²	28	25 Å²	25	20%	0.196	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	-18.2	166.9	81.6	0	0	0	0	113.2	N397 R523 D534	N397-S399 PolarHBondContact O-N 3.09Å; N397-S399 PolarHBondContact OD1-OG 3.23Å; S399-R523 PolarHBondContact O-NH1 3.05Å; S399-D534 VanDerWaalsContact CA-O 3.23Å; S399-D534 WeakPolarHBondContact CA-O 3.29Å; S399-D534 WeakPolarHBondContact CB-O 3.49Å
400	A	96	Very high	96.6	Very high	7 Å²	7	24.9 Å²	24.9	6%	0.058	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	142.5	-174.4	0	0	0	0	0	113	D394 N397 L398	D394-A400 PolarHBondContact N-O 2.69Å; N397-A400 WeakPolarHBondContact ND2-CB 3.41Å; N397-A400 PolarHBondContact O-N 3.04Å; L398-A400 VanDerWaalsContact C-N 3.27Å
401	I	98.3	Very high	96.4	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	133.4	156.7	-52.8	-178	0	0	0	106.2	E391 A392 I393 F441 F445 C446 I451 L453 T454 L521 W536	E391-I401 HydrophobicContact CB-CG2 4.08Å; A392-I401 CarbonylContact O-C 3.59Å; A392-I401 WeakPolarHBondContact O-CA 3.34Å; A392-I401 WeakPolarHBondContact O-CG2 3.45Å; I393-I401 HydrophobicContact CG1-CG1 4.41Å; I401-F441 HydrophobicContact CD1-CD2 4.41Å; I401-F441 HydrophobicContact CD1-CE2 3.83Å; I401-F441 HydrophobicContact CD1-CZ 4.39Å; I401-F441 HydrophobicContact CG1-CE2 4.39Å; I401-F441 HydrophobicContact CG2-CD2 4Å; I401-F441 HydrophobicContact CG2-CE2 4.08Å; I401-F445 HydrophobicContact CD1-CE1 4.24Å; I401-C446 VanDerWaalsContact CG2-SG 3.59Å; I401-I451 HydrophobicContact CD1-CD1 4.13Å; I401-I451 HydrophobicContact CD1-CG2 4.13Å; I401-L453 HydrophobicContact CG2-CD1 4.49Å; I401-T454 WeakPolarHBondContact O-CB 3.44Å; I401-T454 PolarHBondContact O-N 3.14Å; I401-T454 PolarHBondContact O-OG1 3.48Å; I401-L521 HydrophobicContact CD1-CD2 3.99Å; I401-W536 HydrophobicContact CD1-CD2 4.44Å; I401-W536 HydrophobicContact CD1-CG 4.35Å; I401-W536 HydrophobicContact CG1-CG 4.27Å
402	C	98.4	Very high	96.2	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.02	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	156.9	-167.5	-65.6	0	0	0	0	111.8	E391 A392 I419 T454	E391-C402 WeakPolarHBondContact CA-O 3.28Å; A392-C402 PolarHBondContact N-O 3.04Å; A392-C402 PolarHBondContact O-N 3.05Å; C402-I419 HydrophobicContact CB-CD1 3.88Å; C402-I419 HydrophobicContact CB-CG1 4.38Å; C402-I419 HydrophobicContact CB-CG2 3.69Å; C402-T454 VanDerWaalsContact SG-CB 3.56Å
403	V	98.5	Very high	96	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	128	165.4	172.7	0	0	0	0	109.4	D420 L453 T454 P456 F464 W466 Y469	V403-D420 HydrophobicContact CG1-CB 4Å; V403-D420 PolarHBondContact O-N 3.1Å; V403-L453 HydrophobicContact CG2-CD1 4.28Å; V403-L453 HydrophobicContact CG2-CD2 3.95Å; V403-L453 HydrophobicContact CG2-CG 4.16Å; V403-T454 PolarHBondContact N-O 2.97Å; V403-P456 HydrophobicContact CB-CG 3.95Å; V403-P456 HydrophobicContact CG1-CG 3.76Å; V403-P456 HydrophobicContact CG2-CG 4.34Å; V403-F464 HydrophobicContact CG1-CZ 4.42Å; V403-F464 HydrophobicContact CG2-CE1 3.79Å; V403-F464 HydrophobicContact CG2-CE2 4.07Å; V403-F464 HydrophobicContact CG2-CZ 3.53Å; V403-W466 HydrophobicContact CB-CH2 4.17Å; V403-W466 HydrophobicContact CB-CZ2 4.37Å; V403-W466 HydrophobicContact CG1-CH2 3.59Å; V403-W466 HydrophobicContact CG1-CZ2 4.26Å; V403-W466 HydrophobicContact CG1-CZ3 3.99Å; V403-W466 HydrophobicContact CG2-CH2 4Å; V403-W466 HydrophobicContact CG2-CZ2 3.81Å; V403-Y469 HydrophobicContact CG1-CD1 4.17Å; V403-Y469 HydrophobicContact CG1-CE1 3.72Å
404	A	98.6	Very high	96	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	157.8	-172.2	0	0	0	0	0	113.4	K389 L390 A392 I417 G418 I419 D420	K389-A404 WeakPolarHBondContact CA-O 3.29Å; L390-A404 HydrophobicContact CD2-CB 4.47Å; L390-A404 HydrophobicContact CG-CB 4.26Å; L390-A404 PolarHBondContact N-O 3.19Å; L390-A404 PolarHBondContact O-N 3.27Å; A392-A404 HydrophobicContact CB-CB 3.92Å; A404-I417 HydrophobicContact CB-CG2 3.8Å; A404-G418 CarbonylContact C-O 3.48Å; A404-G418 VanDerWaalsContact CA-O 3.23Å; A404-G418 WeakPolarHBondContact CA-O 3.43Å; A404-G418 WeakPolarHBondContact CB-O 3.36Å; A404-I419 HydrophobicContact CB-CD1 3.9Å; A404-D420 WeakPolarHBondContact CA-OD1 3.25Å
405	T	98.6	Very high	96.2	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.012	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137.6	-177.8	-59.8	0	0	0	0	111.3	K389 R407 I417 G418 D420	K389-T405 HydrophobicContact CD-CG2 4.47Å; K389-T405 WeakPolarHBondContact CD-OG1 3.47Å; K389-T405 PolarHBondContact NZ-OG1 2.89Å; T405-R407 PolarHBondContact O-N 2.82Å; T405-I417 WeakPolarHBondContact O-CA 3.38Å; T405-G418 PolarHBondContact N-O 3.27Å; T405-G418 PolarHBondContact O-N 3.02Å; T405-D420 WeakPolarHBondContact CB-OD1 3.36Å; T405-D420 PolarHBondContact N-OD1 2.93Å; T405-D420 VanDerWaalsContact N-OD1 3.14Å; T405-D420 VanDerWaalsContact OG1-CG 3.27Å; T405-D420 PolarHBondContact OG1-OD1 3.11Å; T405-D420 PolarHBondContact OG1-OD2 3.36Å
406	I	98.6	Very high	96.5	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	117.2	167.7	-56.1	-172.1	0	0	0	108.9	F384 K385 E386 G387 M388 L390 V409 L415	F384-I406 HydrophobicContact CB-CD1 3.79Å; F384-I406 HydrophobicContact CD1-CD1 3.33Å; F384-I406 HydrophobicContact CE1-CD1 4.13Å; F384-I406 HydrophobicContact CG-CD1 3.85Å; K385-I406 WeakPolarHBondContact O-CB 3.46Å; E386-I406 WeakPolarHBondContact CA-O 3.44Å; G387-I406 PolarHBondContact N-O 2.68Å; M388-I406 HydrophobicContact CB-CD1 4.17Å; M388-I406 HydrophobicContact CB-CG1 4.37Å; M388-I406 PolarHBondContact O-N 3.47Å; L390-I406 HydrophobicContact CD2-CD1 4.31Å; L390-I406 HydrophobicContact CD2-CG1 3.55Å; I406-V409 HydrophobicContact CG2-CG2 4.25Å; I406-L415 HydrophobicContact CD1-CD1 4.28Å; I406-L415 HydrophobicContact CG2-CD2 4.41Å
407	R	97.8	Very high	96.8	Very high	93 Å²	93	25.5 Å²	25.5	35%	0.351	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-26.3	-174.1	-71.2	-65.2	-169	-170.1	1.4	114.1	T405 M416 E423 W430	T405-R407 PolarHBondContact O-N 2.82Å; R407-M416 PolarHBondContact N-O 3.29Å; R407-E423 IonicContact CZ-OE1 2.73Å; R407-E423 IonicContact CZ-OE2 3Å; R407-E423 IonicContact NE-OE1 2.7Å; R407-E423 PolarHBondContact NE-OE1 2.96Å; R407-E423 IonicContact NE-OE2 3.61Å; R407-E423 PolarHBondContact NE-OE2 3.04Å; R407-E423 IonicContact NH2-OE1 3.17Å; R407-E423 PolarHBondContact NH2-OE1 2.89Å; R407-E423 IonicContact NH2-OE2 2.77Å; R407-E423 PolarHBondContact NH2-OE2 2.97Å; R407-W430 HydrophobicContact CB-CD2 3.65Å; R407-W430 HydrophobicContact CB-CE3 3.89Å; R407-W430 HydrophobicContact CB-CG 4.19Å; R407-W430 HydrophobicContact CB-CH2 4.04Å; R407-W430 HydrophobicContact CB-CZ2 3.81Å; R407-W430 HydrophobicContact CB-CZ3 4.07Å; R407-W430 HydrophobicContact CG-CD2 4.06Å; R407-W430 HydrophobicContact CG-CG 4.32Å; R407-W430 HydrophobicContact CG-CZ2 3.96Å
408	K	97.8	Very high	97.1	Very high	81 Å²	81	22.6 Å²	22.6	35%	0.352	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	140.9	169.1	-165.9	-175.5	168.6	-161.8	0	110.7	G348 E386 L410 M416	G348-K408 PolarHBondContact O-NZ 2.77Å; E386-K408 WeakPolarHBondContact OE1-CA 3.4Å; K408-L410 HydrophobicContact CD-CD2 3.64Å; K408-L410 VanDerWaalsContact CE-CD2 3.5Å; K408-L410 HydrophobicContact CG-CD2 4.12Å; K408-M416 HydrophobicContact CB-CB 3.85Å; K408-M416 HydrophobicContact CB-CG 3.91Å; K408-M416 PolarHBondContact N-O 2.86Å; K408-M416 PolarHBondContact O-N 2.8Å
409	V	97.4	Very high	97.3	Very high	43 Å²	43	22.3 Å²	22.3	26%	0.261	12%	0.118	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	133	165.6	-175.9	0	0	0	0	109.2	E386 I406 L415	E386-V409 HydrophobicContact CG-CG2 4.38Å; E386-V409 PolarHBondContact OE1-N 3.4Å; I406-V409 HydrophobicContact CG2-CG2 4.25Å; V409-L415 HydrophobicContact CG1-CD2 4.22Å; V409-L415 HydrophobicContact CG2-CD2 4.17Å
410	L	96.8	Very high	97.4	Very high	14 Å²	14	21.1 Å²	21.1	7%	0.073	11%	0.109	C	C	.	.			trans	-109.7	173.7	178.4	-60.5	-174.5	0	0	0	110.6	I347 G348 H349 K408 Y414 M416	I347-L410 HydrophobicContact CD1-CB 4.33Å; I347-L410 HydrophobicContact CD1-CD1 3.73Å; I347-L410 HydrophobicContact CG1-CD1 4.44Å; I347-L410 WeakPolarHBondContact O-CB 3.21Å; G348-L410 WeakPolarHBondContact O-CD2 3.37Å; H349-L410 HydrophobicContact CB-CD1 4.04Å; K408-L410 HydrophobicContact CD-CD2 3.64Å; K408-L410 VanDerWaalsContact CE-CD2 3.5Å; K408-L410 HydrophobicContact CG-CD2 4.12Å; L410-Y414 WeakPolarHBondContact CA-O 3.08Å; L410-Y414 WeakPolarHBondContact CB-O 3.17Å; L410-Y414 PolarHBondContact N-O 3.41Å; L410-M416 HydrophobicContact CD1-CG 4.08Å; L410-M416 HydrophobicContact CD1-SD 3.83Å; L410-M416 HydrophobicContact CG-CG 4.3Å
411	A	95.1	Very high	97.2	Very high	46 Å²	46	23.2 Å²	23.2	38%	0.38	13%	0.132	S	C	.	.	S	Bend	trans	-69.6	173.8	170.2	0	0	0	0	0	111.3	I347 G413 Y414	I347-A411 HydrophobicContact CB-CB 4.34Å; I347-A411 PolarHBondContact O-N 3.49Å; A411-G413 PolarHBondContact O-N 3.45Å; A411-Y414 PolarHBondContact O-N 2.89Å; A411-Y414 VanDerWaalsContact O-N 3.12Å
412	D	93.8	Very high	96.8	Very high	102 Å²	102	25.8 Å²	25.8	55%	0.545	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	32.7	175.6	-53	-11.8	0	0	0	114	I347 Y414 H434	I347-D412 HydrophobicContact CG2-CB 4.02Å; I347-D412 WeakPolarHBondContact CG2-OD2 3.42Å; D412-Y414 VanDerWaalsContact C-N 3.32Å; D412-Y414 HydrophobicContact CB-CD2 4.06Å; D412-Y414 HydrophobicContact CB-CE2 4.11Å; D412-Y414 VanDerWaalsContact O-CD2 3.23Å; D412-Y414 WeakPolarHBondContact O-CD2 3.3Å; D412-Y414 WeakPolarHBondContact O-CE2 3.39Å; D412-Y414 PolarHBondContact O-N 3.32Å; D412-H434 PolarHBondContact O-CD2 3.42Å; D412-H434 PolarHBondContact O-NE2 3.27Å; D412-H434 VanDerWaalsContact O-NE2 3.11Å
413	G	95.1	Very high	96.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	7.5	176.6	0	0	0	0	0	116.2	A411 H434 A435	A411-G413 PolarHBondContact O-N 3.45Å; G413-H434 PolarHBondContact O-CD2 3.06Å; G413-H434 VanDerWaalsContact O-CD2 3.25Å; G413-A435 VanDerWaalsContact O-CB 3.31Å; G413-A435 WeakPolarHBondContact O-CB 3.36Å; G413-A435 PolarHBondContact O-N 2.85Å
414	Y	97.7	Very high	95.9	Very high	23 Å²	23	29.5 Å²	29.5	9%	0.09	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	150.9	179.3	-68.9	-91.2	0	0	0	112.9	W343 I347 L410 A411 D412 H434	W343-Y414 AromaticContact CZ2-CD1 3.92Å; W343-Y414 HydrophobicContact CZ2-CD1 3.92Å; W343-Y414 HydrophobicContact CZ2-CD2 4.35Å; W343-Y414 AromaticContact CZ2-CE1 3.65Å; W343-Y414 HydrophobicContact CZ2-CE1 3.65Å; W343-Y414 HydrophobicContact CZ2-CE2 4.13Å; W343-Y414 HydrophobicContact CZ2-CG 4.25Å; W343-Y414 AromaticContact CZ2-CZ 3.75Å; W343-Y414 AromaticContact NE1-CE2 3.82Å; W343-Y414 AromaticContact NE1-CZ 3.86Å; I347-Y414 HydrophobicContact CD1-CD1 4.33Å; I347-Y414 HydrophobicContact CD1-CD2 3.74Å; I347-Y414 HydrophobicContact CD1-CE2 4.43Å; I347-Y414 HydrophobicContact CD1-CG 3.67Å; I347-Y414 HydrophobicContact CG2-CD2 4.3Å; L410-Y414 WeakPolarHBondContact CA-O 3.08Å; L410-Y414 WeakPolarHBondContact CB-O 3.17Å; L410-Y414 PolarHBondContact N-O 3.41Å; A411-Y414 PolarHBondContact O-N 2.89Å; A411-Y414 VanDerWaalsContact O-N 3.12Å; D412-Y414 VanDerWaalsContact C-N 3.32Å; D412-Y414 HydrophobicContact CB-CD2 4.06Å; D412-Y414 HydrophobicContact CB-CE2 4.11Å; D412-Y414 VanDerWaalsContact O-CD2 3.23Å; D412-Y414 WeakPolarHBondContact O-CD2 3.3Å; D412-Y414 WeakPolarHBondContact O-CE2 3.39Å; D412-Y414 PolarHBondContact O-N 3.32Å; Y414-H434 HydrophobicContact CD1-CB 4.05Å; Y414-H434 HydrophobicContact CE1-CB 3.99Å
415	L	98.2	Very high	95.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	130.9	-175.2	-56	171.4	0	0	0	109.4	F384 I406 V409 I417 C432 Y433 A435 I440	F384-L415 HydrophobicContact CB-CD1 4.44Å; F384-L415 HydrophobicContact CB-CD2 3.85Å; F384-L415 HydrophobicContact CD1-CD1 4.39Å; F384-L415 HydrophobicContact CD2-CD1 3.82Å; F384-L415 HydrophobicContact CD2-CD2 4.35Å; F384-L415 HydrophobicContact CE2-CD1 4.06Å; F384-L415 HydrophobicContact CG-CD1 3.98Å; F384-L415 HydrophobicContact CG-CD2 4.27Å; F384-L415 HydrophobicContact CZ-CD1 4.41Å; I406-L415 HydrophobicContact CD1-CD1 4.28Å; I406-L415 HydrophobicContact CG2-CD2 4.41Å; V409-L415 HydrophobicContact CG1-CD2 4.22Å; V409-L415 HydrophobicContact CG2-CD2 4.17Å; L415-I417 HydrophobicContact CB-CD1 4.31Å; L415-I417 HydrophobicContact CB-CG1 4.2Å; L415-C432 WeakPolarHBondContact O-CA 3.49Å; L415-Y433 PolarHBondContact N-O 2.96Å; L415-Y433 PolarHBondContact O-N 3.2Å; L415-A435 HydrophobicContact CD1-CB 4.46Å; L415-I440 HydrophobicContact CD1-CD1 4.37Å
416	M	98.3	Very high	94.8	Very high	7 Å²	7	39.6 Å²	39.6	3%	0.034	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	129.6	163.4	-57.1	-54.5	-58.3	0	0	109	C300 H349 R407 K408 L410 W430 F431 C432	C300-M416 HydrophobicContact CB-CE 4.44Å; H349-M416 PolarHBondContact CD2-SD 2.66Å; R407-M416 PolarHBondContact N-O 3.29Å; K408-M416 HydrophobicContact CB-CB 3.85Å; K408-M416 HydrophobicContact CB-CG 3.91Å; K408-M416 PolarHBondContact N-O 2.86Å; K408-M416 PolarHBondContact O-N 2.8Å; L410-M416 HydrophobicContact CD1-CG 4.08Å; L410-M416 HydrophobicContact CD1-SD 3.83Å; L410-M416 HydrophobicContact CG-CG 4.3Å; M416-W430 HydrophobicContact CB-CE3 4.45Å; M416-W430 HydrophobicContact CE-CB 4.06Å; M416-W430 WeakPolarHBondContact CE-O 3.09Å; M416-F431 WeakPolarHBondContact CA-O 3.48Å; M416-C432 HydrophobicContact CE-CB 4.19Å; M416-C432 HydrophobicContact SD-CB 3.76Å
417	I	98.4	Very high	94.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	144.9	-174.4	-59.8	168.8	0	0	0	108.6	L390 A404 T405 L415 W430 F431 Y433 I440	L390-I417 HydrophobicContact CD1-CD1 4.24Å; L390-I417 HydrophobicContact CD2-CG2 4.4Å; A404-I417 HydrophobicContact CB-CG2 3.8Å; T405-I417 WeakPolarHBondContact O-CA 3.38Å; L415-I417 HydrophobicContact CB-CD1 4.31Å; L415-I417 HydrophobicContact CB-CG1 4.2Å; I417-W430 CarbonylContact O-C 3.47Å; I417-W430 VanDerWaalsContact O-CA 3.27Å; I417-W430 WeakPolarHBondContact O-CA 3.45Å; I417-F431 HydrophobicContact CB-CD2 4.29Å; I417-F431 HydrophobicContact CB-CE1 4.35Å; I417-F431 HydrophobicContact CB-CE2 3.79Å; I417-F431 HydrophobicContact CB-CZ 3.82Å; I417-F431 HydrophobicContact CG2-CE1 4.16Å; I417-F431 HydrophobicContact CG2-CE2 3.85Å; I417-F431 HydrophobicContact CG2-CZ 3.48Å; I417-F431 VanDerWaalsContact CG2-CZ 3.48Å; I417-F431 PolarHBondContact N-O 3.04Å; I417-F431 WeakPolarHBondContact O-CD1 3.38Å; I417-F431 WeakPolarHBondContact O-CE1 3.22Å; I417-F431 PolarHBondContact O-N 3.27Å; I417-Y433 HydrophobicContact CD1-CD2 4.3Å; I417-I440 HydrophobicContact CD1-CG2 3.8Å
418	G	97.9	Very high	93.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	151.1	171.7	0	0	0	0	0	111.7	A404 T405	A404-G418 CarbonylContact C-O 3.48Å; A404-G418 VanDerWaalsContact CA-O 3.23Å; A404-G418 WeakPolarHBondContact CA-O 3.43Å; A404-G418 WeakPolarHBondContact CB-O 3.36Å; T405-G418 PolarHBondContact N-O 3.27Å; T405-G418 PolarHBondContact O-N 3.02Å
419	I	97.8	Very high	93.5	Very high	18 Å²	18	35.2 Å²	35.2	9%	0.092	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	116.5	173	-60.6	-45.4	0	0	0	109.8	C402 A404 G421 S422 E423 F431	C402-I419 HydrophobicContact CB-CD1 3.88Å; C402-I419 HydrophobicContact CB-CG1 4.38Å; C402-I419 HydrophobicContact CB-CG2 3.69Å; A404-I419 HydrophobicContact CB-CD1 3.9Å; I419-G421 PolarHBondContact O-N 2.71Å; I419-S422 PolarHBondContact O-N 2.93Å; I419-E423 WeakPolarHBondContact O-CG 3.4Å; I419-F431 HydrophobicContact CD1-CE1 3.69Å; I419-F431 HydrophobicContact CD1-CZ 3.61Å; I419-F431 HydrophobicContact CG1-CE1 3.8Å; I419-F431 HydrophobicContact CG1-CZ 4.24Å
420	D	96.7	Very high	93.4	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.016	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	123.6	-168.6	-72.3	29.9	0	0	0	112.6	K389 V403 A404 T405 S422 P456 R457 Y469	K389-D420 IonicContact NZ-OD1 2.89Å; K389-D420 IonicContact NZ-OD2 2.68Å; K389-D420 PolarHBondContact NZ-OD2 2.78Å; V403-D420 HydrophobicContact CG1-CB 4Å; V403-D420 PolarHBondContact O-N 3.1Å; A404-D420 WeakPolarHBondContact CA-OD1 3.25Å; T405-D420 WeakPolarHBondContact CB-OD1 3.36Å; T405-D420 PolarHBondContact N-OD1 2.93Å; T405-D420 VanDerWaalsContact N-OD1 3.14Å; T405-D420 VanDerWaalsContact OG1-CG 3.27Å; T405-D420 PolarHBondContact OG1-OD1 3.11Å; T405-D420 PolarHBondContact OG1-OD2 3.36Å; D420-S422 VanDerWaalsContact C-N 3.33Å; D420-P456 HydrophobicContact CB-CB 3.92Å; D420-P456 HydrophobicContact CB-CG 4.03Å; D420-P456 WeakPolarHBondContact O-CA 3.35Å; D420-P456 WeakPolarHBondContact O-CB 3.43Å; D420-R457 PolarHBondContact O-N 2.98Å; D420-Y469 WeakPolarHBondContact OD2-CE1 3.39Å; D420-Y469 PolarHBondContact OD2-OH 2.87Å
421	G	91.9	Very high	93.4	Very high	51 Å²	51	35.5 Å²	35.5	53%	0.526	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	85	-4.2	-179.1	0	0	0	0	0	115.4	I419 R457	I419-G421 PolarHBondContact O-N 2.71Å; G421-R457 WeakPolarHBondContact O-CB 3.47Å
422	S	90.1	Very high	93.5	Very high	53 Å²	53	34.5 Å²	34.5	37%	0.371	22%	0.218	S	C	.	.			trans	-114.6	21.6	175.5	-66.8	0	0	0	0	112.9	I419 D420	I419-S422 PolarHBondContact O-N 2.93Å; D420-S422 VanDerWaalsContact C-N 3.33Å
423	E	88.4	Confident	93.6	Very high	47 Å²	47	31 Å²	31	22%	0.22	20%	0.197	C	C	.	.			trans	-103.6	130.5	-175.5	-57.2	172.6	-96.9	0	0	112.7	R407 I419 W430	R407-E423 IonicContact CZ-OE1 2.73Å; R407-E423 IonicContact CZ-OE2 3Å; R407-E423 IonicContact NE-OE1 2.7Å; R407-E423 PolarHBondContact NE-OE1 2.96Å; R407-E423 IonicContact NE-OE2 3.61Å; R407-E423 PolarHBondContact NE-OE2 3.04Å; R407-E423 IonicContact NH2-OE1 3.17Å; R407-E423 PolarHBondContact NH2-OE1 2.89Å; R407-E423 IonicContact NH2-OE2 2.77Å; R407-E423 PolarHBondContact NH2-OE2 2.97Å; I419-E423 WeakPolarHBondContact O-CG 3.4Å; E423-W430 PolarHBondContact OE2-NE1 3.24Å
424	A	88.2	Confident	93.8	Very high	36 Å²	36	31.8 Å²	31.8	30%	0.298	20%	0.201	S	C	.	.			trans	-66.2	148.8	164.4	0	0	0	0	0	112.4	D426 G427 S428 D429	A424-D426 WeakPolarHBondContact CB-OD1 3.35Å; A424-D426 PolarHBondContact O-N 3.24Å; A424-G427 PolarHBondContact O-N 2.96Å; A424-S428 VanDerWaalsContact CB-OG 3.29Å; A424-S428 WeakPolarHBondContact CB-OG 3.39Å; A424-D429 WeakPolarHBondContact CB-OD2 3.43Å; A424-D429 PolarHBondContact N-OD2 2.88Å
425	A	86.3	Confident	93.7	Very high	118 Å²	118	30.8 Å²	30.8	98%	0.975	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-16.3	-173.5	0	0	0	0	0	115
426	D	87.6	Confident	93.6	Very high	96 Å²	96	32.4 Å²	32.4	51%	0.513	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-3.8	174	72.3	-29.9	0	0	0	113.2	R350 A424 S428	R350-D426 PolarHBondContact NH1-O 3.49Å; R350-D426 PolarHBondContact NH2-O 3.04Å; A424-D426 WeakPolarHBondContact CB-OD1 3.35Å; A424-D426 PolarHBondContact O-N 3.24Å; D426-S428 VanDerWaalsContact OD1-CB 3.26Å; D426-S428 WeakPolarHBondContact OD1-CB 3.4Å; D426-S428 PolarHBondContact OD1-N 2.97Å; D426-S428 PolarHBondContact OD1-OG 2.86Å; D426-S428 WeakPolarHBondContact OD2-CB 3.4Å; D426-S428 PolarHBondContact OD2-OG 3.39Å
427	G	88.4	Confident	93.5	Very high	1 Å²	1	33 Å²	33	1%	0.01	21%	0.212	C	C	.	.			trans	68.2	29.8	-173	0	0	0	0	0	113.5	C300 R350 A424 D429 W430	C300-G427 WeakPolarHBondContact CB-O 3.38Å; R350-G427 PolarHBondContact NH1-O 2.75Å; A424-G427 PolarHBondContact O-N 2.96Å; G427-D429 VanDerWaalsContact C-N 3.3Å; G427-D429 PolarHBondContact O-N 2.78Å; G427-W430 VanDerWaalsContact CA-CE2 3.45Å; G427-W430 PolarHBondContact O-N 3.13Å
428	S	88.6	Confident	93.4	Very high	19 Å²	19	34.9 Å²	34.9	13%	0.133	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-32.8	176.8	42.2	0	0	0	0	113.6	L299 C300 A424 D426 W430	L299-S428 PolarHBondContact N-O 3.04Å; C300-S428 WeakPolarHBondContact CB-O 3.41Å; C300-S428 PolarHBondContact N-O 3.36Å; C300-S428 VanDerWaalsContact N-O 3.1Å; A424-S428 VanDerWaalsContact CB-OG 3.29Å; A424-S428 WeakPolarHBondContact CB-OG 3.39Å; D426-S428 VanDerWaalsContact OD1-CB 3.26Å; D426-S428 WeakPolarHBondContact OD1-CB 3.4Å; D426-S428 PolarHBondContact OD1-N 2.97Å; D426-S428 PolarHBondContact OD1-OG 2.86Å; D426-S428 WeakPolarHBondContact OD2-CB 3.4Å; D426-S428 PolarHBondContact OD2-OG 3.39Å; S428-W430 VanDerWaalsContact C-N 3.35Å
429	D	89.9	Confident	93.4	Very high	62 Å²	62	36 Å²	36	33%	0.332	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.6	177.8	-52.3	-59.8	0	0	0	114.6	A424 G427 F431	A424-D429 WeakPolarHBondContact CB-OD2 3.43Å; A424-D429 PolarHBondContact N-OD2 2.88Å; G427-D429 VanDerWaalsContact C-N 3.3Å; G427-D429 PolarHBondContact O-N 2.78Å; D429-F431 PolarHBondContact O-N 3.19Å
430	W	95.6	Very high	93.4	Very high	52 Å²	52	35.6 Å²	35.6	20%	0.197	23%	0.23	C	C	.	.			trans	-64	133.7	178	-63.4	-10.5	0	0	0	110.3	L299 C300 R407 M416 I417 E423 G427 S428	L299-W430 CarbonylContact C-O 3.58Å; C300-W430 WeakPolarHBondContact CA-O 3.41Å; C300-W430 HydrophobicContact CB-CB 4.29Å; C300-W430 WeakPolarHBondContact CB-O 3.42Å; C300-W430 PolarHBondContact N-O 2.96Å; R407-W430 HydrophobicContact CB-CD2 3.65Å; R407-W430 HydrophobicContact CB-CE3 3.89Å; R407-W430 HydrophobicContact CB-CG 4.19Å; R407-W430 HydrophobicContact CB-CH2 4.04Å; R407-W430 HydrophobicContact CB-CZ2 3.81Å; R407-W430 HydrophobicContact CB-CZ3 4.07Å; R407-W430 HydrophobicContact CG-CD2 4.06Å; R407-W430 HydrophobicContact CG-CG 4.32Å; R407-W430 HydrophobicContact CG-CZ2 3.96Å; M416-W430 HydrophobicContact CB-CE3 4.45Å; M416-W430 HydrophobicContact CE-CB 4.06Å; M416-W430 WeakPolarHBondContact CE-O 3.09Å; I417-W430 CarbonylContact O-C 3.47Å; I417-W430 VanDerWaalsContact O-CA 3.27Å; I417-W430 WeakPolarHBondContact O-CA 3.45Å; E423-W430 PolarHBondContact OE2-NE1 3.24Å; G427-W430 VanDerWaalsContact CA-CE2 3.45Å; G427-W430 PolarHBondContact O-N 3.13Å; S428-W430 VanDerWaalsContact C-N 3.35Å
431	F	96.6	Very high	93.5	Very high	11 Å²	11	36.1 Å²	36.1	5%	0.048	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	152.8	-179.3	54.2	-83.7	0	0	0	111	L299 A392 P395 M416 I417 I419 D429 Y433	L299-F431 HydrophobicContact CB-CB 4.33Å; L299-F431 HydrophobicContact CD1-CB 4.25Å; A392-F431 HydrophobicContact CB-CE2 4.48Å; A392-F431 HydrophobicContact CB-CZ 4.31Å; P395-F431 HydrophobicContact CG-CB 3.91Å; P395-F431 HydrophobicContact CG-CD1 3.82Å; P395-F431 HydrophobicContact CG-CD2 4.08Å; P395-F431 HydrophobicContact CG-CE1 4.38Å; P395-F431 HydrophobicContact CG-CG 3.67Å; M416-F431 WeakPolarHBondContact CA-O 3.48Å; I417-F431 HydrophobicContact CB-CD2 4.29Å; I417-F431 HydrophobicContact CB-CE1 4.35Å; I417-F431 HydrophobicContact CB-CE2 3.79Å; I417-F431 HydrophobicContact CB-CZ 3.82Å; I417-F431 HydrophobicContact CG2-CE1 4.16Å; I417-F431 HydrophobicContact CG2-CE2 3.85Å; I417-F431 HydrophobicContact CG2-CZ 3.48Å; I417-F431 VanDerWaalsContact CG2-CZ 3.48Å; I417-F431 PolarHBondContact N-O 3.04Å; I417-F431 WeakPolarHBondContact O-CD1 3.38Å; I417-F431 WeakPolarHBondContact O-CE1 3.22Å; I417-F431 PolarHBondContact O-N 3.27Å; I419-F431 HydrophobicContact CD1-CE1 3.69Å; I419-F431 HydrophobicContact CD1-CZ 3.61Å; I419-F431 HydrophobicContact CG1-CE1 3.8Å; I419-F431 HydrophobicContact CG1-CZ 4.24Å; D429-F431 PolarHBondContact O-N 3.19Å; F431-Y433 AromaticContact CD2-CD2 3.85Å; F431-Y433 HydrophobicContact CD2-CD2 3.85Å; F431-Y433 AromaticContact CD2-CE2 3.79Å; F431-Y433 HydrophobicContact CD2-CE2 3.79Å; F431-Y433 HydrophobicContact CD2-CG 4.44Å; F431-Y433 AromaticContact CE2-CD2 3.66Å; F431-Y433 HydrophobicContact CE2-CD2 3.66Å; F431-Y433 AromaticContact CE2-CE2 3.54Å; F431-Y433 HydrophobicContact CE2-CE2 3.54Å
432	C	97.8	Very high	93.8	Very high	26 Å²	26	34.9 Å²	34.9	18%	0.176	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	127.7	-178.1	-170.5	0	0	0	0	111.4	H349 L415 M416	H349-C432 VanDerWaalsContact NE2-CB 3.34Å; H349-C432 WeakPolarHBondContact NE2-CB 3.49Å; L415-C432 WeakPolarHBondContact O-CA 3.49Å; M416-C432 HydrophobicContact CE-CB 4.19Å; M416-C432 HydrophobicContact SD-CB 3.76Å
433	Y	97.3	Very high	94.2	Very high	27 Å²	27	34 Å²	34	11%	0.106	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	146.3	165.5	-76.8	-36.1	0	0	0	110.6	L415 I417 F431 I440	L415-Y433 PolarHBondContact N-O 2.96Å; L415-Y433 PolarHBondContact O-N 3.2Å; I417-Y433 HydrophobicContact CD1-CD2 4.3Å; F431-Y433 AromaticContact CD2-CD2 3.85Å; F431-Y433 HydrophobicContact CD2-CD2 3.85Å; F431-Y433 AromaticContact CD2-CE2 3.79Å; F431-Y433 HydrophobicContact CD2-CE2 3.79Å; F431-Y433 HydrophobicContact CD2-CG 4.44Å; F431-Y433 AromaticContact CE2-CD2 3.66Å; F431-Y433 HydrophobicContact CE2-CD2 3.66Å; F431-Y433 AromaticContact CE2-CE2 3.54Å; F431-Y433 HydrophobicContact CE2-CE2 3.54Å; Y433-I440 HydrophobicContact CD2-CG2 3.51Å; Y433-I440 HydrophobicContact CE2-CG2 4.22Å; Y433-I440 HydrophobicContact CG-CG2 4.32Å
434	H	97.5	Very high	94.6	Very high	17 Å²	17	32.2 Å²	32.2	8%	0.079	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	149.8	167.9	-173.3	-110.3	0	0	0	111	V374 K375 D412 G413 Y414 T436 S437	V374-H434 HydrophobicContact CG1-CB 4.19Å; V374-H434 WeakPolarHBondContact CG1-CE1 3.5Å; V374-H434 VanDerWaalsContact CG1-CG 3.45Å; V374-H434 WeakPolarHBondContact CG1-ND1 3.2Å; K375-H434 PolarHBondContact O-CE1 2.87Å; K375-H434 VanDerWaalsContact O-CE1 3.3Å; D412-H434 PolarHBondContact O-CD2 3.42Å; D412-H434 PolarHBondContact O-NE2 3.27Å; D412-H434 VanDerWaalsContact O-NE2 3.11Å; G413-H434 PolarHBondContact O-CD2 3.06Å; G413-H434 VanDerWaalsContact O-CD2 3.25Å; Y414-H434 HydrophobicContact CD1-CB 4.05Å; Y414-H434 HydrophobicContact CE1-CB 3.99Å; H434-T436 PolarHBondContact ND1-N 2.88Å; H434-T436 VanDerWaalsContact ND1-N 3.19Å; H434-T436 PolarHBondContact ND1-OG1 3.09Å; H434-T436 PolarHBondContact O-N 3.25Å; H434-S437 WeakPolarHBondContact O-CB 3.2Å; H434-S437 PolarHBondContact O-N 2.78Å
435	A	96.7	Very high	95.1	Very high	2 Å²	2	31.7 Å²	31.7	2%	0.017	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-24.7	176.8	0	0	0	0	0	114.9	W383 F384 G413 L415	W383-A435 HydrophobicContact CH2-CB 3.54Å; W383-A435 HydrophobicContact CZ2-CB 3.5Å; F384-A435 HydrophobicContact CD2-CB 4.16Å; F384-A435 HydrophobicContact CE2-CB 3.77Å; G413-A435 VanDerWaalsContact O-CB 3.31Å; G413-A435 WeakPolarHBondContact O-CB 3.36Å; G413-A435 PolarHBondContact O-N 2.85Å; L415-A435 HydrophobicContact CD1-CB 4.46Å
436	T	95.9	Very high	95.7	Very high	34 Å²	34	26.1 Å²	26.1	21%	0.209	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	7.6	175.2	70.9	0	0	0	0	114	K375 V377 H434	K375-T436 HydrophobicContact CB-CG2 4.39Å; V377-T436 HydrophobicContact CG1-CG2 3.66Å; H434-T436 PolarHBondContact ND1-N 2.88Å; H434-T436 VanDerWaalsContact ND1-N 3.19Å; H434-T436 PolarHBondContact ND1-OG1 3.09Å; H434-T436 PolarHBondContact O-N 3.25Å
437	S	96.8	Very high	96.1	Very high	19 Å²	19	29 Å²	29	13%	0.133	16%	0.156	C	C	.	.			trans	-60.2	134.7	-179.6	179.5	0	0	0	0	110.9	H434 S439 I440	H434-S437 WeakPolarHBondContact O-CB 3.2Å; H434-S437 PolarHBondContact O-N 2.78Å; S437-S439 PolarHBondContact O-N 3.04Å; S437-S439 PolarHBondContact OG-N 3.12Å; S437-I440 WeakPolarHBondContact O-CG1 3.13Å
438	P	96.3	Very high	96.5	Very high	40 Å²	40	35.4 Å²	35.4	26%	0.26	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-5.9	173.7	32.4	-35.9	0	0	0	113.1	F441 D538	P438-F441 WeakPolarHBondContact O-CE1 3.21Å; P438-F441 VanDerWaalsContact O-CZ 3.25Å; P438-F441 WeakPolarHBondContact O-CZ 3.49Å; P438-D538 HydrophobicContact CB-CB 3.75Å; P438-D538 VanDerWaalsContact CB-CG 3.46Å; P438-D538 VanDerWaalsContact CB-OD1 3.22Å; P438-D538 WeakPolarHBondContact CB-OD1 3.37Å; P438-D538 HydrophobicContact CG-CB 3.55Å
439	S	97.4	Very high	96.9	Very high	24 Å²	24	35.7 Å²	35.7	17%	0.168	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	3	-179.6	-52	0	0	0	0	114.3	A392 I393 S437	A392-S439 WeakPolarHBondContact CA-O 3.35Å; I393-S439 PolarHBondContact N-O 3.43Å; S437-S439 PolarHBondContact O-N 3.04Å; S437-S439 PolarHBondContact OG-N 3.12Å
440	I	98.3	Very high	97.2	Very high	9 Å²	9	40.2 Å²	40.2	5%	0.046	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	138.5	177.6	61.5	172.9	0	0	0	111.3	L390 A392 L415 I417 Y433 S437 F483	L390-I440 HydrophobicContact CD1-CB 3.73Å; L390-I440 HydrophobicContact CD1-CG2 3.85Å; A392-I440 HydrophobicContact CB-CG2 4.26Å; L415-I440 HydrophobicContact CD1-CD1 4.37Å; I417-I440 HydrophobicContact CD1-CG2 3.8Å; Y433-I440 HydrophobicContact CD2-CG2 3.51Å; Y433-I440 HydrophobicContact CE2-CG2 4.22Å; Y433-I440 HydrophobicContact CG-CG2 4.32Å; S437-I440 WeakPolarHBondContact O-CG1 3.13Å; I440-F483 HydrophobicContact CB-CE1 4.25Å; I440-F483 HydrophobicContact CD1-CE1 4.41Å; I440-F483 HydrophobicContact CG1-CD1 4.25Å; I440-F483 HydrophobicContact CG1-CE1 4.24Å
441	F	98.4	Very high	97.3	Very high	15 Å²	15	38.4 Å²	38.4	7%	0.066	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	151.1	-170.9	-40.6	-78.1	0	0	0	111.6	E391 I393 I401 P438 F445 F483 L521	E391-F441 HydrophobicContact CB-CB 4.19Å; E391-F441 HydrophobicContact CB-CD2 4.41Å; E391-F441 PolarHBondContact N-O 2.75Å; E391-F441 PolarHBondContact O-N 2.69Å; I393-F441 HydrophobicContact CD1-CE2 4.49Å; I393-F441 HydrophobicContact CD1-CZ 4.25Å; I393-F441 HydrophobicContact CG1-CE2 3.82Å; I393-F441 HydrophobicContact CG1-CZ 4.08Å; I401-F441 HydrophobicContact CD1-CD2 4.41Å; I401-F441 HydrophobicContact CD1-CE2 3.83Å; I401-F441 HydrophobicContact CD1-CZ 4.39Å; I401-F441 HydrophobicContact CG1-CE2 4.39Å; I401-F441 HydrophobicContact CG2-CD2 4Å; I401-F441 HydrophobicContact CG2-CE2 4.08Å; P438-F441 WeakPolarHBondContact O-CE1 3.21Å; P438-F441 VanDerWaalsContact O-CZ 3.25Å; P438-F441 WeakPolarHBondContact O-CZ 3.49Å; F441-F445 HydrophobicContact CB-CB 3.64Å; F441-F445 HydrophobicContact CB-CD1 3.66Å; F441-F445 HydrophobicContact CB-CD2 4.18Å; F441-F445 HydrophobicContact CB-CE1 4.34Å; F441-F445 HydrophobicContact CB-CG 3.56Å; F441-F445 AromaticContact CD1-CD1 3.85Å; F441-F445 HydrophobicContact CD1-CD1 3.85Å; F441-F445 HydrophobicContact CD1-CD2 4.19Å; F441-F445 AromaticContact CD1-CE1 3.63Å; F441-F445 HydrophobicContact CD1-CE1 3.63Å; F441-F445 HydrophobicContact CD1-CE2 4Å; F441-F445 HydrophobicContact CD1-CG 4.13Å; F441-F445 AromaticContact CD1-CZ 3.72Å; F441-F445 HydrophobicContact CD1-CZ 3.72Å; F441-F445 AromaticContact CD2-CD1 3.92Å; F441-F445 HydrophobicContact CD2-CD1 3.92Å; F441-F445 HydrophobicContact CD2-CE1 4.06Å; F441-F445 HydrophobicContact CE1-CD1 4.5Å; F441-F445 AromaticContact CE1-CE1 3.87Å; F441-F445 HydrophobicContact CE1-CE1 3.87Å; F441-F445 AromaticContact CE1-CZ 3.89Å; F441-F445 HydrophobicContact CE1-CZ 3.89Å; F441-F445 HydrophobicContact CE2-CE1 4.28Å; F441-F445 HydrophobicContact CG-CB 4.46Å; F441-F445 AromaticContact CG-CD1 3.52Å; F441-F445 HydrophobicContact CG-CD1 3.52Å; F441-F445 HydrophobicContact CG-CD2 4.4Å; F441-F445 AromaticContact CG-CE1 3.73Å; F441-F445 HydrophobicContact CG-CE1 3.73Å; F441-F445 AromaticContact CG-CG 3.89Å; F441-F445 HydrophobicContact CG-CG 3.89Å; F441-F445 HydrophobicContact CG-CZ 4.27Å; F441-F445 HydrophobicContact CZ-CE1 4.2Å; F441-F483 WeakPolarHBondContact O-CE1 3.5Å; F441-L521 HydrophobicContact CE1-CD2 4.2Å; F441-L521 HydrophobicContact CZ-CD1 4.14Å; F441-L521 HydrophobicContact CZ-CD2 3.8Å
442	P	98.3	Very high	97.3	Very high	25 Å²	25	45.5 Å²	45.5	16%	0.162	24%	0.238	C	C	.	.			trans	-65.8	151.5	173.4	28.6	-35.3	0	0	0	111.7	G444 F445 V480 F483	P442-G444 PolarHBondContact O-N 3.06Å; P442-F445 VanDerWaalsContact O-CB 3.23Å; P442-F445 WeakPolarHBondContact O-CB 3.42Å; P442-F445 PolarHBondContact O-N 3.12Å; P442-V480 HydrophobicContact CB-CB 4.41Å; P442-V480 HydrophobicContact CB-CG1 4.34Å; P442-V480 HydrophobicContact CB-CG2 3.95Å; P442-V480 HydrophobicContact CG-CG1 4.26Å; P442-F483 HydrophobicContact CB-CD2 3.85Å; P442-F483 HydrophobicContact CB-CE2 3.85Å; P442-F483 HydrophobicContact CB-CG 4.42Å; P442-F483 HydrophobicContact CB-CZ 4.42Å; P442-F483 HydrophobicContact CG-CD2 4.39Å
443	V	98.6	Very high	97.3	Very high	34 Å²	34	45.9 Å²	45.9	21%	0.206	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.6	126.1	170.3	164.2	0	0	0	0	111.4	K389 W466 A477	K389-V443 HydrophobicContact CB-CG2 4.31Å; V443-W466 HydrophobicContact CB-CD2 4.35Å; V443-W466 HydrophobicContact CG1-CB 3.84Å; V443-W466 HydrophobicContact CG1-CD2 3.53Å; V443-W466 HydrophobicContact CG1-CE3 3.98Å; V443-W466 HydrophobicContact CG1-CG 3.49Å; V443-W466 VanDerWaalsContact CG1-CG 3.49Å; V443-W466 HydrophobicContact CG2-CD2 4.17Å; V443-W466 HydrophobicContact CG2-CE3 4.07Å; V443-W466 HydrophobicContact CG2-CH2 3.82Å; V443-W466 HydrophobicContact CG2-CZ2 3.95Å; V443-W466 HydrophobicContact CG2-CZ3 3.91Å; V443-A477 HydrophobicContact CB-CB 3.76Å; V443-A477 HydrophobicContact CG1-CB 4.17Å; V443-A477 HydrophobicContact CG2-CB 3.6Å
444	G	97.3	Very high	97.3	Very high	9 Å²	9	47.2 Å²	47.2	9%	0.093	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.8	-2.9	-178.8	0	0	0	0	0	114.7	E391 P442 C446 E447 I448	E391-G444 WeakPolarHBondContact OE1-CA 3.31Å; E391-G444 PolarHBondContact OE1-N 3.19Å; P442-G444 PolarHBondContact O-N 3.06Å; G444-C446 VanDerWaalsContact C-N 3.35Å; G444-C446 PolarHBondContact O-N 3.3Å; G444-E447 PolarHBondContact O-N 2.84Å; G444-I448 WeakPolarHBondContact O-CB 3.32Å; G444-I448 WeakPolarHBondContact O-CD1 3.18Å; G444-I448 VanDerWaalsContact O-CG1 3.26Å; G444-I448 WeakPolarHBondContact O-CG1 3.21Å; G444-I448 PolarHBondContact O-N 2.91Å
445	F	98.1	Very high	97.3	Very high	26 Å²	26	48.7 Å²	48.7	11%	0.114	26%	0.26	C	S	.	.	H	α-helix	trans	-56.3	-45.6	179.5	168.6	-96.3	0	0	0	112.4	E391 I401 F441 P442 N449 I451 I518 L521	E391-F445 PolarHBondContact OE1-N 3.05Å; E391-F445 WeakPolarHBondContact OE2-CB 3.39Å; E391-F445 PolarHBondContact OE2-N 3.22Å; I401-F445 HydrophobicContact CD1-CE1 4.24Å; F441-F445 HydrophobicContact CB-CB 3.64Å; F441-F445 HydrophobicContact CB-CD1 3.66Å; F441-F445 HydrophobicContact CB-CD2 4.18Å; F441-F445 HydrophobicContact CB-CE1 4.34Å; F441-F445 HydrophobicContact CB-CG 3.56Å; F441-F445 AromaticContact CD1-CD1 3.85Å; F441-F445 HydrophobicContact CD1-CD1 3.85Å; F441-F445 HydrophobicContact CD1-CD2 4.19Å; F441-F445 AromaticContact CD1-CE1 3.63Å; F441-F445 HydrophobicContact CD1-CE1 3.63Å; F441-F445 HydrophobicContact CD1-CE2 4Å; F441-F445 HydrophobicContact CD1-CG 4.13Å; F441-F445 AromaticContact CD1-CZ 3.72Å; F441-F445 HydrophobicContact CD1-CZ 3.72Å; F441-F445 AromaticContact CD2-CD1 3.92Å; F441-F445 HydrophobicContact CD2-CD1 3.92Å; F441-F445 HydrophobicContact CD2-CE1 4.06Å; F441-F445 HydrophobicContact CE1-CD1 4.5Å; F441-F445 AromaticContact CE1-CE1 3.87Å; F441-F445 HydrophobicContact CE1-CE1 3.87Å; F441-F445 AromaticContact CE1-CZ 3.89Å; F441-F445 HydrophobicContact CE1-CZ 3.89Å; F441-F445 HydrophobicContact CE2-CE1 4.28Å; F441-F445 HydrophobicContact CG-CB 4.46Å; F441-F445 AromaticContact CG-CD1 3.52Å; F441-F445 HydrophobicContact CG-CD1 3.52Å; F441-F445 HydrophobicContact CG-CD2 4.4Å; F441-F445 AromaticContact CG-CE1 3.73Å; F441-F445 HydrophobicContact CG-CE1 3.73Å; F441-F445 AromaticContact CG-CG 3.89Å; F441-F445 HydrophobicContact CG-CG 3.89Å; F441-F445 HydrophobicContact CG-CZ 4.27Å; F441-F445 HydrophobicContact CZ-CE1 4.2Å; P442-F445 VanDerWaalsContact O-CB 3.23Å; P442-F445 WeakPolarHBondContact O-CB 3.42Å; P442-F445 PolarHBondContact O-N 3.12Å; F445-N449 WeakPolarHBondContact CD2-ND2 3.33Å; F445-N449 WeakPolarHBondContact CE2-ND2 3.43Å; F445-N449 WeakPolarHBondContact O-CB 3.3Å; F445-N449 PolarHBondContact O-N 2.88Å; F445-N449 VanDerWaalsContact O-N 3.07Å; F445-N449 PolarHBondContact O-ND2 2.66Å; F445-I451 HydrophobicContact CE1-CD1 3.8Å; F445-I451 HydrophobicContact CZ-CD1 4.39Å; F445-I518 HydrophobicContact CE2-CG2 4.3Å; F445-I518 HydrophobicContact CZ-CG2 3.89Å; F445-L521 HydrophobicContact CE1-CD2 4.19Å; F445-L521 HydrophobicContact CZ-CD2 4.25Å
446	C	98.1	Very high	97.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-65.9	-43.8	178.7	-72.1	0	0	0	0	112.4	E391 I401 G444 N449 M450 I451 L453	E391-C446 VanDerWaalsContact OE2-CB 3.31Å; E391-C446 WeakPolarHBondContact OE2-CB 3.41Å; E391-C446 PolarHBondContact OE2-N 3.38Å; E391-C446 PolarHBondContact OE2-SG 3.44Å; I401-C446 VanDerWaalsContact CG2-SG 3.59Å; G444-C446 VanDerWaalsContact C-N 3.35Å; G444-C446 PolarHBondContact O-N 3.3Å; C446-N449 CarbonylContact O-C 3.6Å; C446-N449 PolarHBondContact O-N 3.2Å; C446-M450 PolarHBondContact O-N 2.78Å; C446-I451 HydrophobicContact CB-CB 3.96Å; C446-I451 HydrophobicContact CB-CG2 4.4Å; C446-I451 PolarHBondContact O-N 3.19Å; C446-L453 HydrophobicContact CB-CB 3.8Å; C446-L453 HydrophobicContact CB-CD1 4.41Å
447	E	97	Very high	97.1	Very high	156 Å²	156	56.7 Å²	56.7	73%	0.729	29%	0.287	S	S	*	.	H	α-helix	trans	-61.3	-48.1	179	-176	174.4	-163	0	0	111.1	G444 N449 M450	G444-E447 PolarHBondContact O-N 2.84Å; E447-N449 VanDerWaalsContact C-N 3.3Å; E447-N449 PolarHBondContact O-N 2.84Å; E447-M450 PolarHBondContact O-N 2.88Å
448	I	96.4	Very high	96.8	Very high	136 Å²	136	59.5 Å²	59.5	70%	0.697	32%	0.319	S	S	*	.	H	α-helix	trans	-60.5	-40.2	178.1	-68	165.5	0	0	0	111.4	G444	G444-I448 WeakPolarHBondContact O-CB 3.32Å; G444-I448 WeakPolarHBondContact O-CD1 3.18Å; G444-I448 VanDerWaalsContact O-CG1 3.26Å; G444-I448 WeakPolarHBondContact O-CG1 3.21Å; G444-I448 PolarHBondContact O-N 2.91Å
449	N	96.9	Very high	96.7	Very high	25 Å²	25	59.5 Å²	59.5	13%	0.134	31%	0.314	C	S	.	.	H	α-helix	trans	-92.2	3.7	-176	-71.2	-70.7	0	0	0	114.5	F445 C446 E447 I451 R516 I518	F445-N449 WeakPolarHBondContact CD2-ND2 3.33Å; F445-N449 WeakPolarHBondContact CE2-ND2 3.43Å; F445-N449 WeakPolarHBondContact O-CB 3.3Å; F445-N449 PolarHBondContact O-N 2.88Å; F445-N449 VanDerWaalsContact O-N 3.07Å; F445-N449 PolarHBondContact O-ND2 2.66Å; C446-N449 CarbonylContact O-C 3.6Å; C446-N449 PolarHBondContact O-N 3.2Å; E447-N449 VanDerWaalsContact C-N 3.3Å; E447-N449 PolarHBondContact O-N 2.84Å; N449-I451 VanDerWaalsContact C-N 3.34Å; N449-I451 HydrophobicContact CB-CD1 4.16Å; N449-I451 HydrophobicContact CB-CG1 4.24Å; N449-I451 PolarHBondContact O-N 3.19Å; N449-R516 PolarHBondContact O-NH2 2.74Å; N449-I518 HydrophobicContact CB-CD1 4.28Å; N449-I518 HydrophobicContact CB-CG2 3.72Å; N449-I518 VanDerWaalsContact CG-CG2 3.47Å; N449-I518 WeakPolarHBondContact OD1-CG2 3.35Å
450	M	97.1	Very high	96.4	Very high	157 Å²	157	62.8 Å²	62.8	77%	0.773	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	39.5	-175.9	-52.6	173	-73.2	0	0	113.4	C446 E447 R516	C446-M450 PolarHBondContact O-N 2.78Å; E447-M450 PolarHBondContact O-N 2.88Å; M450-R516 PolarHBondContact O-NH1 3.43Å; M450-R516 PolarHBondContact O-NH2 2.63Å
451	I	97.3	Very high	96	Very high	14 Å²	14	67.9 Å²	67.9	7%	0.072	37%	0.365	C	S	.	.			trans	-94.3	144.7	171.9	-59.3	170.3	0	0	0	108.6	I401 F445 C446 N449 L453 I518 W536	I401-I451 HydrophobicContact CD1-CD1 4.13Å; I401-I451 HydrophobicContact CD1-CG2 4.13Å; F445-I451 HydrophobicContact CE1-CD1 3.8Å; F445-I451 HydrophobicContact CZ-CD1 4.39Å; C446-I451 HydrophobicContact CB-CB 3.96Å; C446-I451 HydrophobicContact CB-CG2 4.4Å; C446-I451 PolarHBondContact O-N 3.19Å; N449-I451 VanDerWaalsContact C-N 3.34Å; N449-I451 HydrophobicContact CB-CD1 4.16Å; N449-I451 HydrophobicContact CB-CG1 4.24Å; N449-I451 PolarHBondContact O-N 3.19Å; I451-L453 PolarHBondContact O-N 2.61Å; I451-I518 HydrophobicContact CD1-CG1 4.28Å; I451-I518 HydrophobicContact CD1-CG2 4.34Å; I451-W536 HydrophobicContact CB-CZ2 4.38Å; I451-W536 HydrophobicContact CD1-CH2 3.92Å; I451-W536 HydrophobicContact CD1-CZ2 3.98Å; I451-W536 HydrophobicContact CG1-CH2 3.99Å; I451-W536 HydrophobicContact CG1-CZ2 3.9Å; I451-W536 HydrophobicContact CG2-CZ2 3.64Å
452	E	96.4	Very high	95.7	Very high	161 Å²	161	73 Å²	73	75%	0.752	39%	0.392	S	S	*	.			trans	-72.6	104.8	171.7	-174	168.4	-160.1	0	0	109.5
453	L	97.8	Very high	95.5	Very high	33 Å²	33	77 Å²	77	17%	0.173	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	125.3	171.8	-179.7	63	0	0	0	109.4	E391 I401 V403 C446 I451 P455 F464 W466	E391-L453 HydrophobicContact CG-CD1 3.86Å; E391-L453 HydrophobicContact CG-CD2 4.46Å; I401-L453 HydrophobicContact CG2-CD1 4.49Å; V403-L453 HydrophobicContact CG2-CD1 4.28Å; V403-L453 HydrophobicContact CG2-CD2 3.95Å; V403-L453 HydrophobicContact CG2-CG 4.16Å; C446-L453 HydrophobicContact CB-CB 3.8Å; C446-L453 HydrophobicContact CB-CD1 4.41Å; I451-L453 PolarHBondContact O-N 2.61Å; L453-P455 WeakPolarHBondContact O-CD 3.23Å; L453-F464 HydrophobicContact CD2-CD1 4.06Å; L453-F464 HydrophobicContact CD2-CE1 3.86Å; L453-W466 HydrophobicContact CD2-CZ2 4.33Å
454	T	97.4	Very high	95.4	Very high	56 Å²	56	77.1 Å²	77.1	34%	0.344	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	117.4	173.3	-58.4	0	0	0	0	109.1	I401 C402 V403	I401-T454 WeakPolarHBondContact O-CB 3.44Å; I401-T454 PolarHBondContact O-N 3.14Å; I401-T454 PolarHBondContact O-OG1 3.48Å; C402-T454 VanDerWaalsContact SG-CB 3.56Å; V403-T454 PolarHBondContact N-O 2.97Å
455	P	96.9	Very high	95.4	Very high	48 Å²	48	82.4 Å²	82.4	31%	0.312	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-74.2	164	179.8	33.2	-36.7	0	0	0	111.2	L453 R457 L462 F464	L453-P455 WeakPolarHBondContact O-CD 3.23Å; P455-R457 PolarHBondContact O-N 3.35Å; P455-L462 HydrophobicContact CG-CD2 4.31Å; P455-F464 HydrophobicContact CB-CB 3.81Å; P455-F464 HydrophobicContact CB-CD2 4.01Å; P455-F464 HydrophobicContact CB-CG 4.02Å
456	P	96.3	Very high	95.4	Very high	10 Å²	10	82 Å²	82	7%	0.065	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-56.2	139.2	178.3	-23.5	33.7	0	0	0	111.8	V403 D420 G458 Y459 F464 Y469	V403-P456 HydrophobicContact CB-CG 3.95Å; V403-P456 HydrophobicContact CG1-CG 3.76Å; V403-P456 HydrophobicContact CG2-CG 4.34Å; D420-P456 HydrophobicContact CB-CB 3.92Å; D420-P456 HydrophobicContact CB-CG 4.03Å; D420-P456 WeakPolarHBondContact O-CA 3.35Å; D420-P456 WeakPolarHBondContact O-CB 3.43Å; P456-G458 PolarHBondContact O-N 3Å; P456-Y459 WeakPolarHBondContact O-CB 3.33Å; P456-Y459 PolarHBondContact O-N 3.41Å; P456-F464 HydrophobicContact CG-CE2 4.09Å; P456-Y469 HydrophobicContact CG-CD2 4.47Å; P456-Y469 HydrophobicContact CG-CE1 4.04Å; P456-Y469 HydrophobicContact CG-CE2 3.84Å
457	R	92.6	Very high	95.3	Very high	194 Å²	194	89.4 Å²	89.4	73%	0.732	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	123.1	-175.9	-178.9	179.6	178.4	175.9	-2.6	110.2	D420 G421 P455	D420-R457 PolarHBondContact O-N 2.98Å; G421-R457 WeakPolarHBondContact O-CB 3.47Å; P455-R457 PolarHBondContact O-N 3.35Å
458	G	90.7	Very high	95.3	Very high	77 Å²	77	84 Å²	84	79%	0.794	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.8	0.2	-176.4	0	0	0	0	0	115.4	P456 A460	P456-G458 PolarHBondContact O-N 3Å; G458-A460 PolarHBondContact O-N 3.22Å
459	Y	93.1	Very high	95.4	Very high	40 Å²	40	78.6 Å²	78.6	16%	0.157	41%	0.413	C	S	.	.			trans	-69.8	111.7	178.4	-167.1	-106.5	0	0	0	112.1	P456 K461 F464 Y469 E472	P456-Y459 WeakPolarHBondContact O-CB 3.33Å; P456-Y459 PolarHBondContact O-N 3.41Å; Y459-K461 HydrophobicContact CD1-CB 4.37Å; Y459-K461 HydrophobicContact CE1-CB 3.66Å; Y459-K461 VanDerWaalsContact CE1-O 3.28Å; Y459-K461 WeakPolarHBondContact CE1-O 3.21Å; Y459-F464 AromaticContact CD1-CD2 3.73Å; Y459-F464 HydrophobicContact CD1-CD2 3.73Å; Y459-F464 AromaticContact CE1-CD2 3.72Å; Y459-F464 HydrophobicContact CE1-CD2 3.72Å; Y459-F464 HydrophobicContact CE1-CE2 4.39Å; Y459-Y469 HydrophobicContact CD2-CD2 4.06Å; Y459-Y469 HydrophobicContact CD2-CE2 4.07Å; Y459-Y469 AromaticContact CE2-CD2 3.61Å; Y459-Y469 HydrophobicContact CE2-CD2 3.61Å; Y459-Y469 HydrophobicContact CE2-CE2 4.02Å; Y459-Y469 AromaticContact CZ-CD2 3.97Å; Y459-E472 PolarHBondContact OH-OE2 2.91Å
460	A	90.9	Very high	95.4	Very high	94 Å²	94	78.9 Å²	78.9	78%	0.777	42%	0.415	S	S	*	.			trans	-82.6	-18.2	-170.3	0	0	0	0	0	115.3	G458 L462	G458-A460 PolarHBondContact O-N 3.22Å; A460-L462 PolarHBondContact O-N 2.9Å; A460-L462 VanDerWaalsContact O-N 3.14Å
461	K	90.9	Very high	95.5	Very high	116 Å²	116	77.9 Å²	77.9	50%	0.504	40%	0.402	S	S	.	.	S	Bend	trans	-85.7	88	-175.6	-67	169.9	-177.1	165.1	0	110.3	Y459 P463 E472	Y459-K461 HydrophobicContact CD1-CB 4.37Å; Y459-K461 HydrophobicContact CE1-CB 3.66Å; Y459-K461 VanDerWaalsContact CE1-O 3.28Å; Y459-K461 WeakPolarHBondContact CE1-O 3.21Å; K461-P463 CarbonylContact O-C 3.47Å; K461-E472 IonicContact NZ-OE1 2.72Å; K461-E472 PolarHBondContact NZ-OE1 3.34Å; K461-E472 IonicContact NZ-OE2 2.65Å; K461-E472 PolarHBondContact NZ-OE2 3.16Å
462	L	92.3	Very high	95.4	Very high	123 Å²	123	81 Å²	81	64%	0.644	42%	0.416	S	S	*	.	S	Bend	trans	-104.6	143.2	-179.3	-60.5	179.9	0	0	0	112	P455 A460	P455-L462 HydrophobicContact CG-CD2 4.31Å; A460-L462 PolarHBondContact O-N 2.9Å; A460-L462 VanDerWaalsContact O-N 3.14Å
463	P	93.4	Very high	95.4	Very high	109 Å²	109	75.9 Å²	75.9	71%	0.708	40%	0.396	S	S	*	.	S	Bend	cis	-67.4	144.5	-5.4	30.5	-35.8	0	0	0	111.9	K461	K461-P463 CarbonylContact O-C 3.47Å
464	F	96.7	Very high	95.4	Very high	36 Å²	36	82 Å²	82	16%	0.158	43%	0.429	C	S	.	.			trans	-59.7	143.9	178.4	171.5	-88.9	0	0	0	111.3	V403 L453 P455 P456 Y459 W466 Y469	V403-F464 HydrophobicContact CG1-CZ 4.42Å; V403-F464 HydrophobicContact CG2-CE1 3.79Å; V403-F464 HydrophobicContact CG2-CE2 4.07Å; V403-F464 HydrophobicContact CG2-CZ 3.53Å; L453-F464 HydrophobicContact CD2-CD1 4.06Å; L453-F464 HydrophobicContact CD2-CE1 3.86Å; P455-F464 HydrophobicContact CB-CB 3.81Å; P455-F464 HydrophobicContact CB-CD2 4.01Å; P455-F464 HydrophobicContact CB-CG 4.02Å; P456-F464 HydrophobicContact CG-CE2 4.09Å; Y459-F464 AromaticContact CD1-CD2 3.73Å; Y459-F464 HydrophobicContact CD1-CD2 3.73Å; Y459-F464 AromaticContact CE1-CD2 3.72Å; Y459-F464 HydrophobicContact CE1-CD2 3.72Å; Y459-F464 HydrophobicContact CE1-CE2 4.39Å; F464-W466 AromaticContact CE1-CD1 4Å; F464-W466 AromaticContact CE1-CD2 3.77Å; F464-W466 HydrophobicContact CE1-CD2 3.77Å; F464-W466 AromaticContact CE1-CE2 3.94Å; F464-W466 HydrophobicContact CE1-CE3 4.31Å; F464-W466 AromaticContact CE1-CG 3.86Å; F464-W466 HydrophobicContact CE1-CG 3.86Å; F464-W466 AromaticContact CZ-CD2 3.92Å; F464-W466 HydrophobicContact CZ-CD2 3.92Å; F464-W466 AromaticContact CZ-CE3 3.97Å; F464-W466 HydrophobicContact CZ-CE3 3.97Å; F464-W466 HydrophobicContact CZ-CG 4.36Å; F464-W466 HydrophobicContact CZ-CZ3 4.4Å; F464-Y469 AromaticContact CE2-CD1 3.91Å; F464-Y469 HydrophobicContact CE2-CD1 3.91Å; F464-Y469 AromaticContact CE2-CD2 3.94Å; F464-Y469 HydrophobicContact CE2-CD2 3.94Å; F464-Y469 AromaticContact CE2-CG 3.52Å; F464-Y469 HydrophobicContact CE2-CG 3.52Å; F464-Y469 AromaticContact CZ-CD1 3.93Å; F464-Y469 HydrophobicContact CZ-CD1 3.93Å; F464-Y469 AromaticContact CZ-CG 3.89Å; F464-Y469 HydrophobicContact CZ-CG 3.89Å
465	K	96.7	Very high	95.5	Very high	120 Å²	120	80.4 Å²	80.4	52%	0.522	42%	0.42	S	S	.	.			trans	-139.4	125.7	177.8	-70.7	175.9	179.3	177.5	0	110.5	F467 D468 Y469	K465-F467 PolarHBondContact O-N 3.36Å; K465-D468 HydrophobicContact CB-CB 4.33Å; K465-D468 WeakPolarHBondContact CD-OD2 3.27Å; K465-D468 PolarHBondContact O-N 2.98Å; K465-Y469 PolarHBondContact O-N 2.71Å
466	W	98	Very high	95.5	Very high	16 Å²	16	83.3 Å²	83.3	6%	0.061	43%	0.432	C	S	.	.	H	α-helix	trans	-57.6	-42.2	178.5	-85.9	121	0	0	0	114	K389 L390 E391 V403 V443 L453 F464 D468 Y469 L470	K389-W466 HydrophobicContact CB-CH2 4.15Å; K389-W466 HydrophobicContact CB-CZ3 3.78Å; K389-W466 HydrophobicContact CG-CZ3 4.32Å; L390-W466 WeakPolarHBondContact O-CH2 3.25Å; E391-W466 HydrophobicContact CG-CZ2 3.59Å; E391-W466 PolarHBondContact OE1-NE1 2.87Å; V403-W466 HydrophobicContact CB-CH2 4.17Å; V403-W466 HydrophobicContact CB-CZ2 4.37Å; V403-W466 HydrophobicContact CG1-CH2 3.59Å; V403-W466 HydrophobicContact CG1-CZ2 4.26Å; V403-W466 HydrophobicContact CG1-CZ3 3.99Å; V403-W466 HydrophobicContact CG2-CH2 4Å; V403-W466 HydrophobicContact CG2-CZ2 3.81Å; V443-W466 HydrophobicContact CB-CD2 4.35Å; V443-W466 HydrophobicContact CG1-CB 3.84Å; V443-W466 HydrophobicContact CG1-CD2 3.53Å; V443-W466 HydrophobicContact CG1-CE3 3.98Å; V443-W466 HydrophobicContact CG1-CG 3.49Å; V443-W466 VanDerWaalsContact CG1-CG 3.49Å; V443-W466 HydrophobicContact CG2-CD2 4.17Å; V443-W466 HydrophobicContact CG2-CE3 4.07Å; V443-W466 HydrophobicContact CG2-CH2 3.82Å; V443-W466 HydrophobicContact CG2-CZ2 3.95Å; V443-W466 HydrophobicContact CG2-CZ3 3.91Å; L453-W466 HydrophobicContact CD2-CZ2 4.33Å; F464-W466 AromaticContact CE1-CD1 4Å; F464-W466 AromaticContact CE1-CD2 3.77Å; F464-W466 HydrophobicContact CE1-CD2 3.77Å; F464-W466 AromaticContact CE1-CE2 3.94Å; F464-W466 HydrophobicContact CE1-CE3 4.31Å; F464-W466 AromaticContact CE1-CG 3.86Å; F464-W466 HydrophobicContact CE1-CG 3.86Å; F464-W466 AromaticContact CZ-CD2 3.92Å; F464-W466 HydrophobicContact CZ-CD2 3.92Å; F464-W466 AromaticContact CZ-CE3 3.97Å; F464-W466 HydrophobicContact CZ-CE3 3.97Å; F464-W466 HydrophobicContact CZ-CG 4.36Å; F464-W466 HydrophobicContact CZ-CZ3 4.4Å; W466-D468 VanDerWaalsContact C-N 3.34Å; W466-D468 PolarHBondContact O-N 2.97Å; W466-Y469 HydrophobicContact CE3-CD1 4.33Å; W466-Y469 HydrophobicContact CZ3-CD1 4.11Å; W466-Y469 PolarHBondContact O-N 2.7Å; W466-L470 HydrophobicContact CE3-CD2 4.47Å; W466-L470 HydrophobicContact CE3-CG 4.24Å; W466-L470 WeakPolarHBondContact O-CB 3.21Å; W466-L470 WeakPolarHBondContact O-CG 3.31Å; W466-L470 PolarHBondContact O-N 3.49Å
467	F	96.8	Very high	95.6	Very high	156 Å²	156	84.6 Å²	84.6	68%	0.684	44%	0.444	S	S	*	.	H	α-helix	trans	-61.5	-40.5	179.7	178.3	-106.4	0	0	0	113.1	K465 R471	K465-F467 PolarHBondContact O-N 3.36Å; F467-R471 VanDerWaalsContact CE1-NH1 3.25Å; F467-R471 WeakPolarHBondContact O-CB 2.94Å; F467-R471 PolarHBondContact O-N 2.74Å
468	D	97.1	Very high	95.9	Very high	42 Å²	42	75.4 Å²	75.4	23%	0.225	41%	0.41	C	S	.	.	H	α-helix	trans	-74	-40	178	-63.8	-50.7	0	0	0	110.8	K465 W466 R471 E472	K465-D468 HydrophobicContact CB-CB 4.33Å; K465-D468 WeakPolarHBondContact CD-OD2 3.27Å; K465-D468 PolarHBondContact O-N 2.98Å; W466-D468 VanDerWaalsContact C-N 3.34Å; W466-D468 PolarHBondContact O-N 2.97Å; D468-R471 PolarHBondContact O-N 2.86Å; D468-R471 IonicContact OD1-CZ 2.74Å; D468-R471 VanDerWaalsContact OD1-CZ 3.22Å; D468-R471 IonicContact OD1-NH1 3.8Å; D468-R471 PolarHBondContact OD1-NH1 3.35Å; D468-R471 IonicContact OD1-NH2 3.41Å; D468-R471 PolarHBondContact OD1-NH2 2.89Å; D468-E472 VanDerWaalsContact O-CB 3.3Å; D468-E472 WeakPolarHBondContact O-CB 3.35Å; D468-E472 WeakPolarHBondContact O-CG 3.21Å; D468-E472 PolarHBondContact O-N 3.25Å
469	Y	97.9	Very high	96.2	Very high	24 Å²	24	73.8 Å²	73.8	9%	0.094	39%	0.385	C	S	.	.	H	α-helix	trans	-66.6	-42.4	178.8	-169.5	-115	0	0	0	113.9	V403 D420 P456 Y459 F464 K465 W466 R471 E472 T473	V403-Y469 HydrophobicContact CG1-CD1 4.17Å; V403-Y469 HydrophobicContact CG1-CE1 3.72Å; D420-Y469 WeakPolarHBondContact OD2-CE1 3.39Å; D420-Y469 PolarHBondContact OD2-OH 2.87Å; P456-Y469 HydrophobicContact CG-CD2 4.47Å; P456-Y469 HydrophobicContact CG-CE1 4.04Å; P456-Y469 HydrophobicContact CG-CE2 3.84Å; Y459-Y469 HydrophobicContact CD2-CD2 4.06Å; Y459-Y469 HydrophobicContact CD2-CE2 4.07Å; Y459-Y469 AromaticContact CE2-CD2 3.61Å; Y459-Y469 HydrophobicContact CE2-CD2 3.61Å; Y459-Y469 HydrophobicContact CE2-CE2 4.02Å; Y459-Y469 AromaticContact CZ-CD2 3.97Å; F464-Y469 AromaticContact CE2-CD1 3.91Å; F464-Y469 HydrophobicContact CE2-CD1 3.91Å; F464-Y469 AromaticContact CE2-CD2 3.94Å; F464-Y469 HydrophobicContact CE2-CD2 3.94Å; F464-Y469 AromaticContact CE2-CG 3.52Å; F464-Y469 HydrophobicContact CE2-CG 3.52Å; F464-Y469 AromaticContact CZ-CD1 3.93Å; F464-Y469 HydrophobicContact CZ-CD1 3.93Å; F464-Y469 AromaticContact CZ-CG 3.89Å; F464-Y469 HydrophobicContact CZ-CG 3.89Å; K465-Y469 PolarHBondContact O-N 2.71Å; W466-Y469 HydrophobicContact CE3-CD1 4.33Å; W466-Y469 HydrophobicContact CZ3-CD1 4.11Å; W466-Y469 PolarHBondContact O-N 2.7Å; Y469-R471 VanDerWaalsContact C-N 3.35Å; Y469-R471 PolarHBondContact O-N 2.58Å; Y469-E472 PolarHBondContact O-N 2.91Å; Y469-T473 HydrophobicContact CD2-CG2 4.22Å; Y469-T473 HydrophobicContact CE1-CG2 4.18Å; Y469-T473 HydrophobicContact CE2-CG2 3.75Å; Y469-T473 WeakPolarHBondContact O-CB 3.43Å; Y469-T473 WeakPolarHBondContact O-CG2 3.48Å; Y469-T473 PolarHBondContact O-N 2.82Å; Y469-T473 PolarHBondContact O-OG1 2.74Å
470	L	97.8	Very high	96.3	Very high	31 Å²	31	76.2 Å²	76.2	16%	0.162	40%	0.404	C	S	.	.	H	α-helix	trans	-61.4	-43.8	176.4	-71.6	167.7	0	0	0	111.1	K389 W466 T473 D474 S475 A477	K389-L470 HydrophobicContact CB-CD2 3.92Å; K389-L470 HydrophobicContact CG-CD2 3.69Å; W466-L470 HydrophobicContact CE3-CD2 4.47Å; W466-L470 HydrophobicContact CE3-CG 4.24Å; W466-L470 WeakPolarHBondContact O-CB 3.21Å; W466-L470 WeakPolarHBondContact O-CG 3.31Å; W466-L470 PolarHBondContact O-N 3.49Å; L470-T473 PolarHBondContact O-N 2.72Å; L470-T473 PolarHBondContact O-OG1 2.83Å; L470-D474 PolarHBondContact O-N 2.78Å; L470-D474 VanDerWaalsContact O-N 3.12Å; L470-S475 WeakPolarHBondContact CD2-O 3.32Å; L470-S475 PolarHBondContact O-N 3.2Å; L470-A477 HydrophobicContact CD1-CB 4.36Å
471	R	97.5	Very high	96.4	Very high	135 Å²	135	77.3 Å²	77.3	51%	0.509	39%	0.391	S	S	.	.	H	α-helix	trans	-66.8	-34.8	175.9	-172.3	-174.9	66.7	-114.2	-6.3	112.8	F467 D468 Y469 T473	F467-R471 VanDerWaalsContact CE1-NH1 3.25Å; F467-R471 WeakPolarHBondContact O-CB 2.94Å; F467-R471 PolarHBondContact O-N 2.74Å; D468-R471 PolarHBondContact O-N 2.86Å; D468-R471 IonicContact OD1-CZ 2.74Å; D468-R471 VanDerWaalsContact OD1-CZ 3.22Å; D468-R471 IonicContact OD1-NH1 3.8Å; D468-R471 PolarHBondContact OD1-NH1 3.35Å; D468-R471 IonicContact OD1-NH2 3.41Å; D468-R471 PolarHBondContact OD1-NH2 2.89Å; Y469-R471 VanDerWaalsContact C-N 3.35Å; Y469-R471 PolarHBondContact O-N 2.58Å; R471-T473 VanDerWaalsContact C-N 3.33Å
472	E	96.9	Very high	96.6	Very high	79 Å²	79	73.1 Å²	73.1	37%	0.369	37%	0.374	S	S	.	.	H	α-helix	trans	-78.3	-15.8	178.9	-75	170	-162.1	0	0	113.9	Y459 K461 D468 Y469	Y459-E472 PolarHBondContact OH-OE2 2.91Å; K461-E472 IonicContact NZ-OE1 2.72Å; K461-E472 PolarHBondContact NZ-OE1 3.34Å; K461-E472 IonicContact NZ-OE2 2.65Å; K461-E472 PolarHBondContact NZ-OE2 3.16Å; D468-E472 VanDerWaalsContact O-CB 3.3Å; D468-E472 WeakPolarHBondContact O-CB 3.35Å; D468-E472 WeakPolarHBondContact O-CG 3.21Å; D468-E472 PolarHBondContact O-N 3.25Å; Y469-E472 PolarHBondContact O-N 2.91Å
473	T	96.7	Very high	96.8	Very high	54 Å²	54	67.8 Å²	67.8	33%	0.331	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	7.1	179.4	54.2	0	0	0	0	113.5	Y469 L470 R471 S475	Y469-T473 HydrophobicContact CD2-CG2 4.22Å; Y469-T473 HydrophobicContact CE1-CG2 4.18Å; Y469-T473 HydrophobicContact CE2-CG2 3.75Å; Y469-T473 WeakPolarHBondContact O-CB 3.43Å; Y469-T473 WeakPolarHBondContact O-CG2 3.48Å; Y469-T473 PolarHBondContact O-N 2.82Å; Y469-T473 PolarHBondContact O-OG1 2.74Å; L470-T473 PolarHBondContact O-N 2.72Å; L470-T473 PolarHBondContact O-OG1 2.83Å; R471-T473 VanDerWaalsContact C-N 3.33Å; T473-S475 PolarHBondContact O-N 3.4Å; T473-S475 PolarHBondContact OG1-OG 3.34Å
474	D	97.6	Very high	96.5	Very high	161 Å²	161	65.8 Å²	65.8	86%	0.861	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.9	48	-172.5	-161.3	30.5	0	0	0	113.1	L470	L470-D474 PolarHBondContact O-N 2.78Å; L470-D474 VanDerWaalsContact O-N 3.12Å
475	S	97.8	Very high	95.8	Very high	23 Å²	23	70.7 Å²	70.7	16%	0.161	35%	0.35	C	S	.	.			trans	-128.4	158.9	-170.5	71.6	0	0	0	0	113	K389 L470 T473	K389-S475 WeakPolarHBondContact CE-OG 3.34Å; K389-S475 VanDerWaalsContact CG-OG 3.3Å; K389-S475 WeakPolarHBondContact CG-OG 3.32Å; L470-S475 WeakPolarHBondContact CD2-O 3.32Å; L470-S475 PolarHBondContact O-N 3.2Å; T473-S475 PolarHBondContact O-N 3.4Å; T473-S475 PolarHBondContact OG1-OG 3.34Å
476	I	97.9	Very high	95.5	Very high	109 Å²	109	70.3 Å²	70.3	56%	0.559	35%	0.35	S	S	*	.			trans	-111.4	145.2	-178.3	59.3	168.3	0	0	0	111.6	M388 K389	M388-I476 WeakPolarHBondContact CA-O 3.44Å; M388-I476 HydrophobicContact CE-CD1 3.99Å; M388-I476 HydrophobicContact CG-CD1 4.31Å; M388-I476 HydrophobicContact CG-CG1 4.19Å; K389-I476 PolarHBondContact N-O 3.11Å
477	A	98.4	Very high	95.3	Very high	37 Å²	37	73.1 Å²	73.1	31%	0.306	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-67.2	139.7	168.1	0	0	0	0	0	110.8	V443 L470	V443-A477 HydrophobicContact CB-CB 3.76Å; V443-A477 HydrophobicContact CG1-CB 4.17Å; V443-A477 HydrophobicContact CG2-CB 3.6Å; L470-A477 HydrophobicContact CD1-CB 4.36Å
478	A	98.1	Very high	95.2	Very high	2 Å²	2	67.3 Å²	67.3	2%	0.017	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-60	128.4	169.5	0	0	0	0	0	110.2	F384 M388 K389 V480 F483	F384-A478 HydrophobicContact CD1-CB 4.09Å; F384-A478 HydrophobicContact CE1-CB 3.91Å; M388-A478 HydrophobicContact CB-CB 4.15Å; M388-A478 HydrophobicContact SD-CB 4.18Å; K389-A478 PolarHBondContact O-N 3.03Å; A478-V480 PolarHBondContact O-N 3.32Å; A478-F483 HydrophobicContact CB-CE2 3.73Å; A478-F483 HydrophobicContact CB-CZ 3.79Å
479	P	96.9	Very high	95.1	Very high	43 Å²	43	72.9 Å²	72.9	28%	0.279	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-59.3	130.8	-175.8	-28.1	35	0	0	0	113.9	K481 L482	P479-K481 HydrophobicContact CB-CG 4.13Å; P479-K481 PolarHBondContact O-N 3.27Å; P479-L482 HydrophobicContact CB-CD1 4.46Å; P479-L482 HydrophobicContact CB-CG 4.3Å; P479-L482 HydrophobicContact CG-CD1 4.39Å; P479-L482 PolarHBondContact O-N 3.25Å
480	V	96	Very high	95.1	Very high	91 Å²	91	73.1 Å²	73.1	55%	0.552	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-12.3	179.6	-171	0	0	0	0	113.8	P442 A478 K485	P442-V480 HydrophobicContact CB-CB 4.41Å; P442-V480 HydrophobicContact CB-CG1 4.34Å; P442-V480 HydrophobicContact CB-CG2 3.95Å; P442-V480 HydrophobicContact CG-CG1 4.26Å; A478-V480 PolarHBondContact O-N 3.32Å; V480-K485 WeakPolarHBondContact O-CE 3.37Å; V480-K485 PolarHBondContact O-NZ 3.36Å
481	K	94	Very high	95.1	Very high	117 Å²	117	73.1 Å²	73.1	51%	0.509	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-17.6	175	69.9	-174.3	-173.3	-169.4	0	115	E382 P479	E382-K481 IonicContact OE1-NZ 2.62Å; E382-K481 PolarHBondContact OE1-NZ 2.84Å; E382-K481 WeakPolarHBondContact OE2-CE 3.47Å; E382-K481 IonicContact OE2-NZ 2.72Å; E382-K481 PolarHBondContact OE2-NZ 2.9Å; P479-K481 HydrophobicContact CB-CG 4.13Å; P479-K481 PolarHBondContact O-N 3.27Å
482	L	95.1	Very high	95.1	Very high	27 Å²	27	67.1 Å²	67.1	14%	0.141	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-24.7	-179.2	-53.4	-179.5	0	0	0	113.2	E382 F384 P479	E382-L482 WeakPolarHBondContact O-CD2 3.49Å; F384-L482 HydrophobicContact CB-CD1 4.42Å; F384-L482 HydrophobicContact CD1-CB 4.36Å; F384-L482 HydrophobicContact CD1-CD1 3.61Å; F384-L482 HydrophobicContact CD2-CB 4.18Å; F384-L482 HydrophobicContact CD2-CD1 4.09Å; F384-L482 HydrophobicContact CE1-CB 3.82Å; F384-L482 HydrophobicContact CE1-CD1 3.88Å; F384-L482 HydrophobicContact CE2-CB 3.6Å; F384-L482 HydrophobicContact CE2-CD1 4.3Å; F384-L482 HydrophobicContact CG-CD1 3.76Å; F384-L482 HydrophobicContact CZ-CB 3.42Å; F384-L482 VanDerWaalsContact CZ-CB 3.42Å; F384-L482 HydrophobicContact CZ-CD1 4.22Å; F384-L482 HydrophobicContact CZ-CG 4.47Å; P479-L482 HydrophobicContact CB-CD1 4.46Å; P479-L482 HydrophobicContact CB-CG 4.3Å; P479-L482 HydrophobicContact CG-CD1 4.39Å; P479-L482 PolarHBondContact O-N 3.25Å
483	F	95.1	Very high	95.2	Very high	11 Å²	11	68 Å²	68	5%	0.048	37%	0.371	C	S	.	.	S	Bend	trans	-78.5	146.4	179.4	-63.1	-91.4	0	0	0	111.8	F384 L390 I440 F441 P442 A478	F384-F483 HydrophobicContact CE1-CE1 4.35Å; F384-F483 HydrophobicContact CE1-CE2 4.1Å; F384-F483 AromaticContact CE1-CZ 3.93Å; F384-F483 HydrophobicContact CE1-CZ 3.93Å; F384-F483 HydrophobicContact CZ-CE1 4.38Å; F384-F483 HydrophobicContact CZ-CE2 4.44Å; F384-F483 HydrophobicContact CZ-CZ 4.33Å; L390-F483 HydrophobicContact CB-CE1 4.39Å; L390-F483 HydrophobicContact CB-CZ 3.94Å; L390-F483 HydrophobicContact CD1-CE1 4.27Å; I440-F483 HydrophobicContact CB-CE1 4.25Å; I440-F483 HydrophobicContact CD1-CE1 4.41Å; I440-F483 HydrophobicContact CG1-CD1 4.25Å; I440-F483 HydrophobicContact CG1-CE1 4.24Å; F441-F483 WeakPolarHBondContact O-CE1 3.5Å; P442-F483 HydrophobicContact CB-CD2 3.85Å; P442-F483 HydrophobicContact CB-CE2 3.85Å; P442-F483 HydrophobicContact CB-CG 4.42Å; P442-F483 HydrophobicContact CB-CZ 4.42Å; P442-F483 HydrophobicContact CG-CD2 4.39Å; A478-F483 HydrophobicContact CB-CE2 3.73Å; A478-F483 HydrophobicContact CB-CZ 3.79Å
484	N	87.2	Confident	95.3	Very high	68 Å²	68	69.9 Å²	69.9	36%	0.364	38%	0.382	S	S	.	.			trans	-64	140	174.6	-170	7.9	0	0	0	111.2	E486	N484-E486 WeakPolarHBondContact OD1-CB 3.23Å; N484-E486 PolarHBondContact OD1-N 3.37Å
485	K	82.2	Confident	95.3	Very high	138 Å²	138	63.9 Å²	63.9	60%	0.6	36%	0.359	S	S	*	.			trans	-120.9	2.7	-177.3	-62.2	173	-172.5	176.2	0	112.8	V480 V487	V480-K485 WeakPolarHBondContact O-CE 3.37Å; V480-K485 PolarHBondContact O-NZ 3.36Å; K485-V487 PolarHBondContact O-N 3.19Å
486	E	91.1	Very high	95.4	Very high	113 Å²	113	63.9 Å²	63.9	53%	0.528	36%	0.357	S	S	.	.			trans	-79.4	112	-176	-170.6	163.4	-165.9	0	0	110.7	K375 N484 R520	K375-E486 IonicContact NZ-OE2 3.34Å; K375-E486 PolarHBondContact NZ-OE2 3.37Å; K375-E486 VanDerWaalsContact NZ-OE2 3.11Å; N484-E486 WeakPolarHBondContact OD1-CB 3.23Å; N484-E486 PolarHBondContact OD1-N 3.37Å; E486-R520 PolarHBondContact O-NH1 3.12Å
487	V	93.8	Very high	95.4	Very high	74 Å²	74	59.1 Å²	59.1	45%	0.448	33%	0.332	S	S	.	.			trans	-110.2	102.9	178.2	-174	0	0	0	0	108.1	K485 H519	K485-V487 PolarHBondContact O-N 3.19Å; V487-H519 HydrophobicContact CG1-CB 4.03Å; V487-H519 HydrophobicContact CG2-CB 3.84Å
488	P	94.5	Very high	95.4	Very high	34 Å²	34	57.3 Å²	57.3	22%	0.221	32%	0.317	C	S	.	.			trans	-71	156.9	-179.7	30.3	-35.7	0	0	0	111.1	H490 E540	P488-H490 HydrophobicContact CG-CB 4.5Å; P488-H490 PolarHBondContact O-CD2 2.79Å; P488-H490 PolarHBondContact O-N 3.01Å; P488-E540 HydrophobicContact CG-CG 4.15Å
489	N	95.4	Very high	95.5	Very high	160 Å²	160	57.3 Å²	57.3	86%	0.856	32%	0.317	S	S	*	.			trans	-77	76.8	167.4	-174.2	13.7	0	0	0	109.8	G491	N489-G491 VanDerWaalsContact C-N 3.31Å; N489-G491 PolarHBondContact O-N 2.85Å
490	H	96.9	Very high	95.5	Very high	28 Å²	28	55.2 Å²	55.2	13%	0.13	30%	0.303	C	S	.	.			trans	-74.4	-12.1	-171.3	51.4	67.6	0	0	0	114.8	C159 P488 F492 H519 C539	C159-H490 PolarHBondContact SG-O 2.86Å; P488-H490 HydrophobicContact CG-CB 4.5Å; P488-H490 PolarHBondContact O-CD2 2.79Å; P488-H490 PolarHBondContact O-N 3.01Å; H490-F492 HydrophobicContact CB-CD2 4.05Å; H490-F492 AromaticContact ND1-CD2 3.93Å; H490-F492 PolarHBondContact ND1-N 3.22Å; H490-F492 PolarHBondContact O-N 3.34Å; H490-H519 PolarHBondContact NE2-O 2.87Å; H490-C539 HydrophobicContact CB-CB 3.81Å; H490-C539 VanDerWaalsContact CD2-SG 3.6Å
491	G	97.2	Very high	95.7	Very high	32 Å²	32	51 Å²	51	33%	0.33	28%	0.278	S	S	.	.			trans	74.9	-17.3	174.6	0	0	0	0	0	116.9	N489 N493	N489-G491 VanDerWaalsContact C-N 3.31Å; N489-G491 PolarHBondContact O-N 2.85Å; G491-N493 PolarHBondContact O-ND2 2.9Å
492	F	98.6	Very high	95.9	Very high	8 Å²	8	46.4 Å²	46.4	4%	0.035	26%	0.259	C	S	.	.			trans	-54.8	143.9	171.3	-68.5	-77.1	0	0	0	112.9	A155 C159 F160 H490 L498 V514 I517 L522 C539	A155-F492 HydrophobicContact CB-CD1 3.96Å; A155-F492 HydrophobicContact CB-CE1 3.8Å; C159-F492 HydrophobicContact CB-CD1 4.42Å; C159-F492 HydrophobicContact CB-CD2 4.24Å; C159-F492 HydrophobicContact CB-CE1 3.99Å; C159-F492 HydrophobicContact CB-CE2 3.78Å; C159-F492 HydrophobicContact CB-CZ 3.65Å; F160-F492 AromaticContact CD1-CZ 3.99Å; F160-F492 HydrophobicContact CD1-CZ 3.99Å; F160-F492 AromaticContact CE1-CE1 3.77Å; F160-F492 HydrophobicContact CE1-CE1 3.77Å; F160-F492 AromaticContact CE1-CZ 3.58Å; F160-F492 HydrophobicContact CE1-CZ 3.58Å; F160-F492 HydrophobicContact CE2-CE1 4.21Å; F160-F492 HydrophobicContact CE2-CZ 4.35Å; F160-F492 AromaticContact CZ-CE1 3.57Å; F160-F492 HydrophobicContact CZ-CE1 3.57Å; F160-F492 AromaticContact CZ-CZ 3.81Å; F160-F492 HydrophobicContact CZ-CZ 3.81Å; H490-F492 HydrophobicContact CB-CD2 4.05Å; H490-F492 AromaticContact ND1-CD2 3.93Å; H490-F492 PolarHBondContact ND1-N 3.22Å; H490-F492 PolarHBondContact O-N 3.34Å; F492-L498 HydrophobicContact CD1-CD2 4.3Å; F492-L498 HydrophobicContact CE1-CD2 3.73Å; F492-V514 HydrophobicContact CD1-CG2 4.07Å; F492-I517 HydrophobicContact CB-CD1 3.98Å; F492-I517 VanDerWaalsContact O-CD1 3.26Å; F492-I517 WeakPolarHBondContact O-CD1 3.48Å; F492-L522 HydrophobicContact CB-CD2 4.23Å; F492-L522 HydrophobicContact CD1-CD1 4.29Å; F492-L522 HydrophobicContact CD2-CD1 3.82Å; F492-L522 HydrophobicContact CE1-CD1 4.43Å; F492-L522 HydrophobicContact CE2-CD1 3.99Å; F492-L522 HydrophobicContact CG-CD1 3.98Å; F492-L522 HydrophobicContact CG-CD2 4.47Å; F492-L522 HydrophobicContact CZ-CD1 4.28Å; F492-C539 HydrophobicContact CD2-CB 4.06Å; F492-C539 HydrophobicContact CE2-CB 4.21Å; F492-C539 WeakPolarHBondContact CE2-O 3.37Å
493	N	98.4	Very high	95.8	Very high	97 Å²	97	47.2 Å²	47.2	52%	0.519	26%	0.263	S	S	.	.			trans	-134.1	152.8	173.9	-73.7	-95.2	0	0	0	109.7	G491 M496	G491-N493 PolarHBondContact O-ND2 2.9Å; N493-M496 HydrophobicContact CB-CE 4.08Å; N493-M496 HydrophobicContact CB-CG 4.13Å; N493-M496 HydrophobicContact CB-SD 3.98Å; N493-M496 PolarHBondContact N-SD 2.72Å; N493-M496 WeakPolarHBondContact O-CB 3.42Å; N493-M496 WeakPolarHBondContact O-CG 3.39Å; N493-M496 PolarHBondContact O-N 2.92Å
494	V	98.6	Very high	95.7	Very high	94 Å²	94	51.5 Å²	51.5	57%	0.57	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	137.5	175.5	175.1	0	0	0	0	110.2	M496 V514 T515 I517	V494-M496 VanDerWaalsContact C-N 3.35Å; V494-V514 CarbonylContact C-O 3.56Å; V494-V514 WeakPolarHBondContact CA-O 3.34Å; V494-T515 WeakPolarHBondContact CG1-O 3.15Å; V494-I517 HydrophobicContact CG2-CD1 4.43Å; V494-I517 HydrophobicContact CG2-CG1 4.04Å
495	G	98.4	Very high	96	Very high	36 Å²	36	50.7 Å²	50.7	37%	0.371	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-1.6	-174.9	0	0	0	0	0	114.8	V514	G495-V514 PolarHBondContact N-O 3.42Å
496	M	98.8	Very high	96.6	Very high	22 Å²	22	45.9 Å²	45.9	11%	0.108	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	131.6	172.4	-76.3	-176	160.1	0	0	111.6	T153 A155 N493 V494 T513 V514	T153-M496 HydrophobicContact CG2-CE 4.3Å; T153-M496 HydrophobicContact CG2-CG 4.45Å; T153-M496 WeakPolarHBondContact O-CA 3.42Å; A155-M496 HydrophobicContact CB-CB 4.22Å; A155-M496 HydrophobicContact CB-SD 4.06Å; N493-M496 HydrophobicContact CB-CE 4.08Å; N493-M496 HydrophobicContact CB-CG 4.13Å; N493-M496 HydrophobicContact CB-SD 3.98Å; N493-M496 PolarHBondContact N-SD 2.72Å; N493-M496 WeakPolarHBondContact O-CB 3.42Å; N493-M496 WeakPolarHBondContact O-CG 3.39Å; N493-M496 PolarHBondContact O-N 2.92Å; V494-M496 VanDerWaalsContact C-N 3.35Å; M496-T513 WeakPolarHBondContact O-CA 3.45Å; M496-V514 PolarHBondContact O-N 3.46Å
497	K	98.8	Very high	96.8	Very high	9 Å²	9	46.7 Å²	46.7	4%	0.039	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	143	171.4	-61.4	-61.2	-174.4	175.5	0	111.9	W143 Y146 F152 T153 A154 A155 A512 T513 D527 V547	W143-K497 HydrophobicContact CH2-CB 4.04Å; W143-K497 HydrophobicContact CZ3-CB 3.83Å; W143-K497 HydrophobicContact CZ3-CG 4.29Å; Y146-K497 HydrophobicContact CE1-CD 4.4Å; Y146-K497 PolarHBondContact OH-NZ 2.91Å; F152-K497 HydrophobicContact CB-CG 3.92Å; F152-K497 HydrophobicContact CD2-CD 4.38Å; F152-K497 HydrophobicContact CD2-CG 4.19Å; F152-K497 HydrophobicContact CG-CD 4.47Å; F152-K497 HydrophobicContact CG-CG 4.06Å; T153-K497 PolarHBondContact O-N 3.32Å; A154-K497 CarbonylContact C-O 3.58Å; A154-K497 VanDerWaalsContact CA-O 3.31Å; A154-K497 WeakPolarHBondContact CA-O 3.43Å; A155-K497 PolarHBondContact N-O 3.17Å; K497-A512 WeakPolarHBondContact CA-O 3.44Å; K497-T513 WeakPolarHBondContact CD-OG1 3.29Å; K497-T513 WeakPolarHBondContact CE-OG1 3.47Å; K497-T513 PolarHBondContact NZ-OG1 2.86Å; K497-D527 VanDerWaalsContact NZ-CG 3.25Å; K497-D527 IonicContact NZ-OD1 3.16Å; K497-D527 PolarHBondContact NZ-OD1 2.98Å; K497-D527 IonicContact NZ-OD2 2.78Å; K497-D527 PolarHBondContact NZ-OD2 3.36Å; K497-V547 HydrophobicContact CB-CG2 4.39Å
498	L	98.9	Very high	96.9	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	176.1	176.7	56.1	79.7	0	0	0	110.7	A155 F160 F492 A500 A512 V514 I524 L544 Y545	A155-L498 HydrophobicContact CB-CB 4.48Å; F160-L498 HydrophobicContact CE1-CB 4.45Å; F160-L498 HydrophobicContact CE1-CD2 4.35Å; F160-L498 HydrophobicContact CZ-CB 3.92Å; F160-L498 HydrophobicContact CZ-CD2 4.22Å; F492-L498 HydrophobicContact CD1-CD2 4.3Å; F492-L498 HydrophobicContact CE1-CD2 3.73Å; L498-A500 HydrophobicContact CD1-CB 3.72Å; L498-A512 HydrophobicContact CD1-CB 3.95Å; L498-A512 PolarHBondContact N-O 2.88Å; L498-A512 PolarHBondContact O-N 2.8Å; L498-V514 HydrophobicContact CD2-CG2 3.62Å; L498-I524 HydrophobicContact CD1-CG2 4.41Å; L498-I524 HydrophobicContact CD2-CD1 4.32Å; L498-L544 HydrophobicContact CD1-CD2 4.19Å; L498-Y545 WeakPolarHBondContact CB-O 3.32Å
499	E	98.9	Very high	97.1	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.1	170.8	-67.5	174.9	-171.9	0	0	107.7	W143 V509 C510 Y545 G548 W549 C550 L557	W143-E499 HydrophobicContact CZ2-CG 3.68Å; W143-E499 PolarHBondContact NE1-OE1 3.29Å; E499-V509 HydrophobicContact CB-CG1 3.96Å; E499-C510 WeakPolarHBondContact CA-O 3.49Å; E499-Y545 PolarHBondContact N-O 3Å; E499-Y545 PolarHBondContact O-N 3.08Å; E499-G548 WeakPolarHBondContact OE1-CA 3.37Å; E499-G548 PolarHBondContact OE1-N 2.97Å; E499-W549 WeakPolarHBondContact OE2-CB 3.49Å; E499-W549 PolarHBondContact OE2-N 2.83Å; E499-C550 WeakPolarHBondContact OE2-CB 3.41Å; E499-C550 PolarHBondContact OE2-N 2.98Å; E499-L557 HydrophobicContact CB-CD1 4.4Å; E499-L557 HydrophobicContact CG-CD1 3.84Å
500	A	98.9	Very high	97.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	140	-175.8	0	0	0	0	0	111.5	L498 V509 C510 A512 I524 F526 L544	L498-A500 HydrophobicContact CD1-CB 3.72Å; A500-V509 CarbonylContact O-C 3.45Å; A500-V509 WeakPolarHBondContact O-CA 3.35Å; A500-C510 PolarHBondContact N-O 2.97Å; A500-C510 PolarHBondContact O-N 2.91Å; A500-A512 HydrophobicContact CB-CB 3.62Å; A500-I524 HydrophobicContact CB-CG2 3.74Å; A500-F526 HydrophobicContact CB-CE1 3.9Å; A500-L544 HydrophobicContact CB-CD2 3.73Å
501	V	98.8	Very high	97.4	Very high	2 Å²	2	35 Å²	35	1%	0.012	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	136.9	167.1	178.7	0	0	0	0	109.1	R314 L503 P506 L508 V509 D543 Y545	R314-V501 VanDerWaalsContact CZ-CG2 3.44Å; V501-L503 HydrophobicContact CB-CD2 4.37Å; V501-L503 HydrophobicContact CG1-CD2 3.98Å; V501-L503 HydrophobicContact CG1-CG 4.49Å; V501-L503 PolarHBondContact O-N 3.17Å; V501-P506 HydrophobicContact CG1-CB 4Å; V501-L508 WeakPolarHBondContact CA-O 3.48Å; V501-V509 HydrophobicContact CG2-CG2 4.06Å; V501-D543 HydrophobicContact CB-CB 3.98Å; V501-D543 WeakPolarHBondContact CB-O 3.42Å; V501-D543 HydrophobicContact CG2-CB 3.81Å; V501-D543 VanDerWaalsContact CG2-O 3.29Å; V501-D543 WeakPolarHBondContact CG2-O 3.4Å; V501-D543 PolarHBondContact N-O 3.02Å; V501-Y545 HydrophobicContact CG2-CE2 3.84Å
502	D	97.7	Very high	97.4	Very high	20 Å²	20	33.5 Å²	33.5	11%	0.107	18%	0.179	C	C	.	.			trans	-76.6	106.9	161.1	-179.1	-2.5	0	0	0	108.4	M504 E505 P506 L508 F526 Q535	D502-M504 PolarHBondContact O-N 3.49Å; D502-M504 VanDerWaalsContact O-N 3.14Å; D502-M504 WeakPolarHBondContact OD1-CB 2.96Å; D502-M504 PolarHBondContact OD1-N 3.44Å; D502-E505 CarbonylContact O-C 3.53Å; D502-E505 PolarHBondContact O-N 3.1Å; D502-E505 VanDerWaalsContact O-O 3.1Å; D502-P506 VanDerWaalsContact O-CA 3.25Å; D502-P506 WeakPolarHBondContact O-CA 3.43Å; D502-P506 VanDerWaalsContact O-N 3.12Å; D502-L508 HydrophobicContact CB-CB 4.31Å; D502-L508 PolarHBondContact N-O 3.37Å; D502-F526 HydrophobicContact CB-CE1 4.47Å; D502-F526 HydrophobicContact CB-CZ 4.34Å; D502-Q535 PolarHBondContact OD1-NE2 2.54Å
503	L	94.6	Very high	97.5	Very high	44 Å²	44	33.9 Å²	33.9	23%	0.23	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-5.2	-176.3	-64.9	167.2	0	0	0	113.5	L398 V501 V537 D543	L398-L503 HydrophobicContact CD1-CB 3.93Å; L398-L503 HydrophobicContact CD2-CB 3.74Å; L398-L503 HydrophobicContact CD2-CD1 3.63Å; L398-L503 HydrophobicContact CD2-CG 4.3Å; L398-L503 HydrophobicContact CG-CB 4.42Å; V501-L503 HydrophobicContact CB-CD2 4.37Å; V501-L503 HydrophobicContact CG1-CD2 3.98Å; V501-L503 HydrophobicContact CG1-CG 4.49Å; V501-L503 PolarHBondContact O-N 3.17Å; L503-V537 HydrophobicContact CD1-CG2 4.06Å; L503-D543 HydrophobicContact CD2-CB 3.96Å
504	M	92.1	Very high	97.5	Very high	102 Å²	102	29.2 Å²	29.2	50%	0.502	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-25.3	167.9	-60.8	-60.5	-55.6	0	0	113.1	L396 L398 D502	L396-M504 WeakPolarHBondContact O-CE 3.37Å; L398-M504 HydrophobicContact CD1-SD 3.86Å; D502-M504 PolarHBondContact O-N 3.49Å; D502-M504 VanDerWaalsContact O-N 3.14Å; D502-M504 WeakPolarHBondContact OD1-CB 2.96Å; D502-M504 PolarHBondContact OD1-N 3.44Å
505	E	93.1	Very high	97.5	Very high	50 Å²	50	27.5 Å²	27.5	23%	0.234	15%	0.146	C	C	.	.	S	Bend	trans	-138.3	76.3	174.4	173.2	71	-150	0	0	108.1	D502 R507 L508	D502-E505 CarbonylContact O-C 3.53Å; D502-E505 PolarHBondContact O-N 3.1Å; D502-E505 VanDerWaalsContact O-O 3.1Å; E505-R507 PolarHBondContact O-N 2.95Å; E505-R507 IonicContact OE1-CZ 2.64Å; E505-R507 IonicContact OE1-NE 2.64Å; E505-R507 PolarHBondContact OE1-NE 3.12Å; E505-R507 IonicContact OE1-NH2 2.66Å; E505-R507 PolarHBondContact OE1-NH2 3.49Å; E505-L508 HydrophobicContact CB-CD1 4.28Å; E505-L508 HydrophobicContact CB-CG 4.47Å; E505-L508 HydrophobicContact CG-CD1 3.77Å; E505-L508 HydrophobicContact CG-CG 3.72Å; E505-L508 PolarHBondContact O-N 3.09Å
506	P	95.1	Very high	97.5	Very high	37 Å²	37	29.6 Å²	29.6	24%	0.24	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	3.4	-164.7	-25.8	37.2	0	0	0	117.1	R314 W330 V501 D502	R314-P506 PolarHBondContact NH2-O 2.95Å; W330-P506 HydrophobicContact CB-CB 4.06Å; W330-P506 WeakPolarHBondContact CB-O 3.38Å; W330-P506 WeakPolarHBondContact O-CB 3.46Å; V501-P506 HydrophobicContact CG1-CB 4Å; D502-P506 VanDerWaalsContact O-CA 3.25Å; D502-P506 WeakPolarHBondContact O-CA 3.43Å; D502-P506 VanDerWaalsContact O-N 3.12Å
507	R	95.4	Very high	97.5	Very high	130 Å²	130	30.8 Å²	30.8	49%	0.491	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-20.9	168.9	-179.7	175.4	59	122.2	-1.1	112.5	W330 E505 Y555	W330-R507 HydrophobicContact CG-CB 4.11Å; E505-R507 PolarHBondContact O-N 2.95Å; E505-R507 IonicContact OE1-CZ 2.64Å; E505-R507 IonicContact OE1-NE 2.64Å; E505-R507 PolarHBondContact OE1-NE 3.12Å; E505-R507 IonicContact OE1-NH2 2.66Å; E505-R507 PolarHBondContact OE1-NH2 3.49Å; R507-Y555 PolarHBondContact O-OH 2.72Å; R507-Y555 VanDerWaalsContact O-OH 3.09Å
508	L	97	Very high	97.4	Very high	38 Å²	38	31.4 Å²	31.4	20%	0.199	15%	0.153	C	C	.	.			trans	-91.9	130.7	176.7	-57.7	178.8	0	0	0	110.1	V501 D502 E505 Q558	V501-L508 WeakPolarHBondContact CA-O 3.48Å; D502-L508 HydrophobicContact CB-CB 4.31Å; D502-L508 PolarHBondContact N-O 3.37Å; E505-L508 HydrophobicContact CB-CD1 4.28Å; E505-L508 HydrophobicContact CB-CG 4.47Å; E505-L508 HydrophobicContact CG-CD1 3.77Å; E505-L508 HydrophobicContact CG-CG 3.72Å; E505-L508 PolarHBondContact O-N 3.09Å; L508-Q558 HydrophobicContact CB-CG 4.13Å; L508-Q558 HydrophobicContact CD2-CG 3.88Å; L508-Q558 HydrophobicContact CG-CG 4.43Å
509	V	98.5	Very high	97.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	126.8	163.2	177.6	0	0	0	0	106.9	E499 A500 V501 Y545 W549 Y555 L557 Q558	E499-V509 HydrophobicContact CB-CG1 3.96Å; A500-V509 CarbonylContact O-C 3.45Å; A500-V509 WeakPolarHBondContact O-CA 3.35Å; V501-V509 HydrophobicContact CG2-CG2 4.06Å; V509-Y545 HydrophobicContact CG1-CD2 4.26Å; V509-Y545 HydrophobicContact CG2-CE2 4.37Å; V509-W549 HydrophobicContact CG1-CZ3 4.4Å; V509-W549 HydrophobicContact CG2-CZ3 4.17Å; V509-Y555 HydrophobicContact CB-CD1 4.13Å; V509-Y555 HydrophobicContact CB-CE1 4.23Å; V509-Y555 HydrophobicContact CG2-CD1 3.82Å; V509-Y555 HydrophobicContact CG2-CE1 3.65Å; V509-L557 HydrophobicContact CG1-CD1 4.43Å; V509-L557 CarbonylContact O-C 3.15Å; V509-L557 WeakPolarHBondContact O-CA 3.35Å; V509-Q558 PolarHBondContact O-N 2.99Å
510	C	98.5	Very high	97.2	Very high	11 Å²	11	38.5 Å²	38.5	7%	0.074	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	152.2	-162.4	-64.5	0	0	0	0	111.7	E499 A500 A512 F526 Q558	E499-C510 WeakPolarHBondContact CA-O 3.49Å; A500-C510 PolarHBondContact N-O 2.97Å; A500-C510 PolarHBondContact O-N 2.91Å; C510-A512 PolarHBondContact O-N 3.37Å; C510-F526 HydrophobicContact CB-CD1 3.62Å; C510-F526 HydrophobicContact CB-CE1 4.07Å; C510-Q558 HydrophobicContact CB-CB 4.39Å
511	V	98.7	Very high	97.2	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.012	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	122.6	169.6	172.4	0	0	0	0	109.7	F141 W143 Y146 D527 L557 Q558 P560	F141-V511 HydrophobicContact CD1-CG2 4.12Å; F141-V511 HydrophobicContact CE1-CG2 3.47Å; F141-V511 VanDerWaalsContact CE1-CG2 3.47Å; F141-V511 HydrophobicContact CE2-CG2 4.19Å; F141-V511 HydrophobicContact CZ-CB 4.43Å; F141-V511 HydrophobicContact CZ-CG1 4.08Å; F141-V511 HydrophobicContact CZ-CG2 3.51Å; W143-V511 HydrophobicContact CH2-CB 4.27Å; W143-V511 HydrophobicContact CH2-CG1 3.6Å; W143-V511 HydrophobicContact CH2-CG2 4.16Å; W143-V511 HydrophobicContact CZ2-CB 4.33Å; W143-V511 HydrophobicContact CZ2-CG1 4.12Å; W143-V511 HydrophobicContact CZ2-CG2 3.82Å; W143-V511 HydrophobicContact CZ3-CG1 4.01Å; Y146-V511 HydrophobicContact CD1-CG1 4.47Å; Y146-V511 HydrophobicContact CE1-CG1 3.99Å; V511-D527 HydrophobicContact CG1-CB 4.12Å; V511-D527 WeakPolarHBondContact CG1-OD2 3.35Å; V511-D527 PolarHBondContact O-N 2.82Å; V511-L557 HydrophobicContact CG2-CD1 3.97Å; V511-L557 HydrophobicContact CG2-CD2 3.82Å; V511-L557 HydrophobicContact CG2-CG 3.97Å; V511-Q558 WeakPolarHBondContact CG2-O 3.34Å; V511-Q558 PolarHBondContact N-O 3.5Å; V511-P560 HydrophobicContact CB-CG 4.04Å; V511-P560 HydrophobicContact CG1-CG 3.73Å
512	A	98.8	Very high	97.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	162.6	-168.4	0	0	0	0	0	114.4	K497 L498 A500 C510 I524 H525 F526	K497-A512 WeakPolarHBondContact CA-O 3.44Å; L498-A512 HydrophobicContact CD1-CB 3.95Å; L498-A512 PolarHBondContact N-O 2.88Å; L498-A512 PolarHBondContact O-N 2.8Å; A500-A512 HydrophobicContact CB-CB 3.62Å; C510-A512 PolarHBondContact O-N 3.37Å; A512-I524 HydrophobicContact CB-CG2 3.92Å; A512-H525 CarbonylContact C-O 3.57Å; A512-H525 WeakPolarHBondContact CA-O 3.37Å; A512-H525 WeakPolarHBondContact CB-O 3.48Å; A512-F526 HydrophobicContact CB-CD1 4.26Å
513	T	98.8	Very high	97.2	Very high	16 Å²	16	39.4 Å²	39.4	10%	0.098	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	138.3	-177.2	-58	0	0	0	0	111.6	M496 K497 T515 H525 D527	M496-T513 WeakPolarHBondContact O-CA 3.45Å; K497-T513 WeakPolarHBondContact CD-OG1 3.29Å; K497-T513 WeakPolarHBondContact CE-OG1 3.47Å; K497-T513 PolarHBondContact NZ-OG1 2.86Å; T513-T515 PolarHBondContact O-N 3.47Å; T513-H525 PolarHBondContact N-O 2.82Å; T513-H525 PolarHBondContact O-N 2.9Å; T513-D527 PolarHBondContact OG1-OD1 2.9Å
514	V	98.9	Very high	97.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	104.3	166.9	-177.2	0	0	0	0	109.6	F492 V494 G495 M496 L498 I517 L522 R523 I524	F492-V514 HydrophobicContact CD1-CG2 4.07Å; V494-V514 CarbonylContact C-O 3.56Å; V494-V514 WeakPolarHBondContact CA-O 3.34Å; G495-V514 PolarHBondContact N-O 3.42Å; M496-V514 PolarHBondContact O-N 3.46Å; L498-V514 HydrophobicContact CD2-CG2 3.62Å; V514-I517 HydrophobicContact CG1-CD1 4.04Å; V514-I517 HydrophobicContact CG1-CG1 3.7Å; V514-L522 HydrophobicContact CG1-CD2 4.42Å; V514-R523 WeakPolarHBondContact CA-O 3.35Å; V514-I524 HydrophobicContact CG2-CD1 4.01Å
515	T	98.5	Very high	97.7	Very high	57 Å²	57	33.9 Å²	33.9	35%	0.35	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-25.5	-179.7	45.4	0	0	0	0	113.4	V494 T513 R523 H525 D534	V494-T515 WeakPolarHBondContact CG1-O 3.15Å; T513-T515 PolarHBondContact O-N 3.47Å; T515-R523 PolarHBondContact N-O 3.18Å; T515-R523 VanDerWaalsContact OG1-CG 3.26Å; T515-R523 WeakPolarHBondContact OG1-CG 3.15Å; T515-R523 PolarHBondContact OG1-O 2.99Å; T515-H525 HydrophobicContact CG2-CB 3.41Å; T515-H525 VanDerWaalsContact CG2-CB 3.41Å; T515-D534 PolarHBondContact OG1-OD2 2.76Å
516	R	98.4	Very high	98	Very high	81 Å²	81	31.9 Å²	31.9	31%	0.306	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	152	-178.7	-167.2	173.8	168.9	171.6	2.4	111.6	N449 M450 I518 L522 R523	N449-R516 PolarHBondContact O-NH2 2.74Å; M450-R516 PolarHBondContact O-NH1 3.43Å; M450-R516 PolarHBondContact O-NH2 2.63Å; R516-I518 HydrophobicContact CG-CG1 4.32Å; R516-L522 WeakPolarHBondContact O-CA 3.46Å; R516-R523 HydrophobicContact CB-CB 3.63Å; R516-R523 PolarHBondContact O-N 2.69Å
517	I	98.6	Very high	98.1	Very high	46 Å²	46	30.5 Å²	30.5	24%	0.236	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	126.7	175.6	-56.1	-174.6	0	0	0	108.2	F492 V494 V514 H519 L522	F492-I517 HydrophobicContact CB-CD1 3.98Å; F492-I517 VanDerWaalsContact O-CD1 3.26Å; F492-I517 WeakPolarHBondContact O-CD1 3.48Å; V494-I517 HydrophobicContact CG2-CD1 4.43Å; V494-I517 HydrophobicContact CG2-CG1 4.04Å; V514-I517 HydrophobicContact CG1-CD1 4.04Å; V514-I517 HydrophobicContact CG1-CG1 3.7Å; I517-H519 WeakPolarHBondContact CG2-O 3.35Å; I517-L522 HydrophobicContact CB-CD2 4.37Å; I517-L522 HydrophobicContact CD1-CD2 4.19Å; I517-L522 HydrophobicContact CG1-CD2 3.82Å; I517-L522 HydrophobicContact CG2-CD2 4.08Å
518	I	97.6	Very high	98.1	Very high	23 Å²	23	25.8 Å²	25.8	12%	0.118	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	94.1	176.9	-63.3	-63.4	0	0	0	107.3	F445 N449 I451 R516 R520 L521 W536	F445-I518 HydrophobicContact CE2-CG2 4.3Å; F445-I518 HydrophobicContact CZ-CG2 3.89Å; N449-I518 HydrophobicContact CB-CD1 4.28Å; N449-I518 HydrophobicContact CB-CG2 3.72Å; N449-I518 VanDerWaalsContact CG-CG2 3.47Å; N449-I518 WeakPolarHBondContact OD1-CG2 3.35Å; I451-I518 HydrophobicContact CD1-CG1 4.28Å; I451-I518 HydrophobicContact CD1-CG2 4.34Å; R516-I518 HydrophobicContact CG-CG1 4.32Å; I518-R520 PolarHBondContact O-N 2.97Å; I518-L521 PolarHBondContact N-O 2.62Å; I518-L521 WeakPolarHBondContact O-CB 3.38Å; I518-L521 PolarHBondContact O-N 2.88Å; I518-W536 HydrophobicContact CG1-CH2 4.47Å
519	H	96.3	Very high	98	Very high	111 Å²	111	27.7 Å²	27.7	51%	0.514	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	-123	-168	-52.5	-64.8	0	0	0	110.4	V487 H490 I517 L521	V487-H519 HydrophobicContact CG1-CB 4.03Å; V487-H519 HydrophobicContact CG2-CB 3.84Å; H490-H519 PolarHBondContact NE2-O 2.87Å; I517-H519 WeakPolarHBondContact CG2-O 3.35Å; H519-L521 VanDerWaalsContact C-N 3.32Å
520	R	97.3	Very high	97.8	Very high	39 Å²	39	33.6 Å²	33.6	15%	0.147	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-11.5	176.7	65.5	-178	-63.3	127.7	6.7	114.7	E486 I518 D538 C539 E540	E486-R520 PolarHBondContact O-NH1 3.12Å; I518-R520 PolarHBondContact O-N 2.97Å; R520-D538 WeakPolarHBondContact CG-OD1 3.26Å; R520-D538 IonicContact CZ-OD1 3.18Å; R520-D538 IonicContact CZ-OD2 3.49Å; R520-D538 IonicContact NE-OD1 3.66Å; R520-D538 PolarHBondContact NE-OD1 3.32Å; R520-D538 IonicContact NE-OD2 3.38Å; R520-D538 IonicContact NH2-OD1 2.78Å; R520-D538 PolarHBondContact NH2-OD1 2.77Å; R520-D538 IonicContact NH2-OD2 2.72Å; R520-D538 PolarHBondContact NH2-OD2 2.96Å; R520-C539 VanDerWaalsContact O-CB 3.25Å; R520-C539 WeakPolarHBondContact O-CB 3.41Å; R520-C539 PolarHBondContact O-N 3.13Å; R520-C539 PolarHBondContact O-SG 2.75Å; R520-C539 VanDerWaalsContact O-SG 3.34Å; R520-E540 IonicContact CZ-OE2 3.51Å; R520-E540 IonicContact NH1-OE2 3.97Å; R520-E540 PolarHBondContact NH1-OE2 3.23Å; R520-E540 IonicContact NH2-OE2 2.7Å; R520-E540 PolarHBondContact NH2-OE2 3.35Å
521	L	98.2	Very high	97.6	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.016	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	125.8	-177.1	-169.7	69.6	0	0	0	111.1	I393 I401 F441 F445 I518 H519 W536	I393-L521 HydrophobicContact CD1-CD1 4.05Å; I401-L521 HydrophobicContact CD1-CD2 3.99Å; F441-L521 HydrophobicContact CE1-CD2 4.2Å; F441-L521 HydrophobicContact CZ-CD1 4.14Å; F441-L521 HydrophobicContact CZ-CD2 3.8Å; F445-L521 HydrophobicContact CE1-CD2 4.19Å; F445-L521 HydrophobicContact CZ-CD2 4.25Å; I518-L521 PolarHBondContact N-O 2.62Å; I518-L521 WeakPolarHBondContact O-CB 3.38Å; I518-L521 PolarHBondContact O-N 2.88Å; H519-L521 VanDerWaalsContact C-N 3.32Å; L521-W536 HydrophobicContact CD1-CB 4.33Å; L521-W536 HydrophobicContact CD2-CD2 4.03Å; L521-W536 HydrophobicContact CD2-CE3 3.63Å; L521-W536 HydrophobicContact CD2-CG 4.49Å; L521-W536 HydrophobicContact CD2-CZ3 4.05Å; L521-W536 HydrophobicContact CG-CD2 4.43Å; L521-W536 HydrophobicContact CG-CE3 3.7Å; L521-W536 HydrophobicContact CG-CZ3 4.21Å
522	L	98.7	Very high	97.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	142.6	178.2	-50.4	-179.5	0	0	0	110.3	F492 V514 R516 I517 I524 W536 V537 C539 L544	F492-L522 HydrophobicContact CB-CD2 4.23Å; F492-L522 HydrophobicContact CD1-CD1 4.29Å; F492-L522 HydrophobicContact CD2-CD1 3.82Å; F492-L522 HydrophobicContact CE1-CD1 4.43Å; F492-L522 HydrophobicContact CE2-CD1 3.99Å; F492-L522 HydrophobicContact CG-CD1 3.98Å; F492-L522 HydrophobicContact CG-CD2 4.47Å; F492-L522 HydrophobicContact CZ-CD1 4.28Å; V514-L522 HydrophobicContact CG1-CD2 4.42Å; R516-L522 WeakPolarHBondContact O-CA 3.46Å; I517-L522 HydrophobicContact CB-CD2 4.37Å; I517-L522 HydrophobicContact CD1-CD2 4.19Å; I517-L522 HydrophobicContact CG1-CD2 3.82Å; I517-L522 HydrophobicContact CG2-CD2 4.08Å; L522-I524 HydrophobicContact CB-CD1 3.86Å; L522-I524 HydrophobicContact CB-CG1 4.37Å; L522-I524 HydrophobicContact CD1-CD1 4.23Å; L522-W536 WeakPolarHBondContact O-CA 3.36Å; L522-V537 WeakPolarHBondContact CA-O 3.31Å; L522-V537 WeakPolarHBondContact CB-O 3.37Å; L522-V537 PolarHBondContact N-O 2.86Å; L522-V537 PolarHBondContact O-N 3.18Å; L522-C539 HydrophobicContact CD1-CB 3.99Å; L522-C539 HydrophobicContact CD2-CB 4.17Å; L522-C539 HydrophobicContact CG-CB 3.99Å; L522-L544 HydrophobicContact CD1-CD1 3.98Å
523	R	98.6	Very high	97.1	Very high	38 Å²	38	44.1 Å²	44.1	14%	0.143	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	125.9	160.3	-169.2	73.4	169.3	176.8	7.1	108	S399 V514 T515 R516 D534 W536	S399-R523 PolarHBondContact O-NH1 3.05Å; V514-R523 WeakPolarHBondContact CA-O 3.35Å; T515-R523 PolarHBondContact N-O 3.18Å; T515-R523 VanDerWaalsContact OG1-CG 3.26Å; T515-R523 WeakPolarHBondContact OG1-CG 3.15Å; T515-R523 PolarHBondContact OG1-O 2.99Å; R516-R523 HydrophobicContact CB-CB 3.63Å; R516-R523 PolarHBondContact O-N 2.69Å; R523-D534 HydrophobicContact CG-CB 4.02Å; R523-D534 WeakPolarHBondContact CG-OD2 3.29Å; R523-D534 IonicContact NE-OD2 2.71Å; R523-D534 PolarHBondContact NH1-O 3.19Å; R523-D534 PolarHBondContact NH2-O 2.92Å; R523-W536 HydrophobicContact CB-CE3 4Å; R523-W536 HydrophobicContact CB-CH2 4.21Å; R523-W536 HydrophobicContact CB-CZ3 3.75Å
524	I	98.8	Very high	97	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	120.9	-177.1	-54.3	-60.7	0	0	0	108.5	L498 A500 A512 V514 L522 D534 Q535 V537 L544	L498-I524 HydrophobicContact CD1-CG2 4.41Å; L498-I524 HydrophobicContact CD2-CD1 4.32Å; A500-I524 HydrophobicContact CB-CG2 3.74Å; A512-I524 HydrophobicContact CB-CG2 3.92Å; V514-I524 HydrophobicContact CG2-CD1 4.01Å; L522-I524 HydrophobicContact CB-CD1 3.86Å; L522-I524 HydrophobicContact CB-CG1 4.37Å; L522-I524 HydrophobicContact CD1-CD1 4.23Å; I524-D534 CarbonylContact O-C 3.55Å; I524-D534 WeakPolarHBondContact O-CA 3.33Å; I524-D534 WeakPolarHBondContact O-CB 3.23Å; I524-Q535 PolarHBondContact N-O 2.73Å; I524-Q535 PolarHBondContact O-N 3.43Å; I524-V537 HydrophobicContact CG1-CB 4.05Å; I524-V537 HydrophobicContact CG1-CG2 3.97Å; I524-L544 HydrophobicContact CD1-CD1 4.06Å; I524-L544 HydrophobicContact CD1-CD2 4.25Å; I524-L544 HydrophobicContact CG1-CD1 4.31Å; I524-L544 HydrophobicContact CG1-CD2 4Å; I524-L544 HydrophobicContact CG2-CD2 4.37Å
525	H	98.8	Very high	97	Very high	29 Å²	29	44 Å²	44	13%	0.134	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	141.3	175.5	175	77.9	0	0	0	110.7	A512 T513 T515 D527 W529 D534	A512-H525 CarbonylContact C-O 3.57Å; A512-H525 WeakPolarHBondContact CA-O 3.37Å; A512-H525 WeakPolarHBondContact CB-O 3.48Å; T513-H525 PolarHBondContact N-O 2.82Å; T513-H525 PolarHBondContact O-N 2.9Å; T515-H525 HydrophobicContact CG2-CB 3.41Å; T515-H525 VanDerWaalsContact CG2-CB 3.41Å; H525-D527 IonicContact CD2-OD1 3.49Å; H525-W529 PolarHBondContact CE1-O 3.37Å; H525-D534 VanDerWaalsContact CA-OD1 3.31Å; H525-D534 WeakPolarHBondContact CA-OD1 3.49Å; H525-D534 VanDerWaalsContact CB-OD1 3.31Å; H525-D534 WeakPolarHBondContact CB-OD1 3.24Å; H525-D534 IonicContact CE1-OD1 3.33Å; H525-D534 IonicContact CG-OD1 3.13Å; H525-D534 IonicContact ND1-OD1 3.65Å; H525-D534 PolarHBondContact ND1-OD1 3.42Å
526	F	98.3	Very high	97	Very high	8 Å²	8	41.9 Å²	41.9	4%	0.035	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	117.8	174.1	-60.6	-76.3	0	0	0	109.5	A500 D502 C510 A512 G528 W529 Y533 Q535	A500-F526 HydrophobicContact CB-CE1 3.9Å; D502-F526 HydrophobicContact CB-CE1 4.47Å; D502-F526 HydrophobicContact CB-CZ 4.34Å; C510-F526 HydrophobicContact CB-CD1 3.62Å; C510-F526 HydrophobicContact CB-CE1 4.07Å; A512-F526 HydrophobicContact CB-CD1 4.26Å; F526-G528 PolarHBondContact O-N 2.84Å; F526-W529 HydrophobicContact CB-CB 4.33Å; F526-W529 HydrophobicContact CB-CG 4.26Å; F526-W529 WeakPolarHBondContact O-CB 3.42Å; F526-W529 PolarHBondContact O-N 2.99Å; F526-Y533 WeakPolarHBondContact CD2-O 3.41Å; F526-Y533 WeakPolarHBondContact CE2-O 3.35Å; F526-Q535 HydrophobicContact CE2-CG 3.98Å; F526-Q535 HydrophobicContact CZ-CG 4.47Å
527	D	97.6	Very high	97	Very high	7 Å²	7	38.4 Å²	38.4	4%	0.037	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	125.1	-164	-72.9	-10.6	0	0	0	112.2	Y146 K497 V511 T513 H525 W529 P560 A561	Y146-D527 PolarHBondContact OH-OD2 3.07Å; Y146-D527 VanDerWaalsContact OH-OD2 3.07Å; K497-D527 VanDerWaalsContact NZ-CG 3.25Å; K497-D527 IonicContact NZ-OD1 3.16Å; K497-D527 PolarHBondContact NZ-OD1 2.98Å; K497-D527 IonicContact NZ-OD2 2.78Å; K497-D527 PolarHBondContact NZ-OD2 3.36Å; V511-D527 HydrophobicContact CG1-CB 4.12Å; V511-D527 WeakPolarHBondContact CG1-OD2 3.35Å; V511-D527 PolarHBondContact O-N 2.82Å; T513-D527 PolarHBondContact OG1-OD1 2.9Å; H525-D527 IonicContact CD2-OD1 3.49Å; D527-W529 VanDerWaalsContact C-N 3.35Å; D527-P560 HydrophobicContact CB-CB 3.92Å; D527-P560 HydrophobicContact CB-CG 4.08Å; D527-P560 CarbonylContact O-C 3.58Å; D527-P560 WeakPolarHBondContact O-CA 3.28Å; D527-P560 WeakPolarHBondContact O-CB 3.28Å; D527-A561 PolarHBondContact O-N 3.2Å
528	G	94.8	Very high	97	Very high	31 Å²	31	37 Å²	37	32%	0.32	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	-4.6	-179.8	0	0	0	0	0	115.1	F526	F526-G528 PolarHBondContact O-N 2.84Å
529	W	95.1	Very high	97	Very high	79 Å²	79	36.1 Å²	36.1	30%	0.299	17%	0.173	S	C	.	.	S	Bend	trans	-89.2	175.9	170.2	-64.7	88.6	0	0	0	111.6	Y122 H525 F526 D527 Y533 A561	Y122-W529 HydrophobicContact CD1-CH2 4.03Å; Y122-W529 AromaticContact CE1-CH2 3.55Å; Y122-W529 HydrophobicContact CE1-CH2 3.55Å; Y122-W529 HydrophobicContact CE1-CZ2 4.18Å; Y122-W529 HydrophobicContact CE2-CH2 4.49Å; Y122-W529 AromaticContact CZ-CH2 3.81Å; H525-W529 PolarHBondContact CE1-O 3.37Å; F526-W529 HydrophobicContact CB-CB 4.33Å; F526-W529 HydrophobicContact CB-CG 4.26Å; F526-W529 WeakPolarHBondContact O-CB 3.42Å; F526-W529 PolarHBondContact O-N 2.99Å; D527-W529 VanDerWaalsContact C-N 3.35Å; W529-Y533 HydrophobicContact CB-CD2 4.39Å; W529-Y533 HydrophobicContact CE3-CD2 4.47Å; W529-Y533 HydrophobicContact CE3-CE2 4.38Å; W529-A561 HydrophobicContact CD2-CB 4.25Å; W529-A561 HydrophobicContact CG-CB 4.35Å; W529-A561 HydrophobicContact CZ2-CB 4.33Å
530	E	94.8	Very high	97.1	Very high	123 Å²	123	35 Å²	35	58%	0.575	17%	0.168	S	C	*	.			trans	-84.1	146.8	177.8	-54.4	180	139.7	0	0	111	E532 Y533	E530-E532 HydrophobicContact CB-CB 4.38Å; E530-E532 PolarHBondContact O-N 3.08Å; E530-Y533 HydrophobicContact CB-CD2 4.07Å; E530-Y533 HydrophobicContact CB-CE2 4.21Å; E530-Y533 WeakPolarHBondContact O-CD2 3.33Å; E530-Y533 PolarHBondContact O-N 3.26Å
531	D	94.3	Very high	97.1	Very high	113 Å²	113	34.1 Å²	34.1	60%	0.604	17%	0.167	S	C	*	.	G	3₁₀ helix	trans	-55.6	-19.3	179.5	-60.9	12.8	0	0	0	113.7	Y533 D534	D531-Y533 PolarHBondContact O-N 3.05Å; D531-D534 WeakPolarHBondContact O-CB 3.45Å; D531-D534 PolarHBondContact O-N 3.25Å
532	E	92.3	Very high	97.1	Very high	52 Å²	52	34.6 Å²	34.6	24%	0.243	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-53.4	-28.5	167.1	-84.2	60.9	-143.7	0	0	114.7	K109 E530	K109-E532 WeakPolarHBondContact CE-OE1 3.44Å; K109-E532 IonicContact NZ-OE1 2.66Å; K109-E532 PolarHBondContact NZ-OE1 3.4Å; E530-E532 HydrophobicContact CB-CB 4.38Å; E530-E532 PolarHBondContact O-N 3.08Å
533	Y	94.2	Very high	97.1	Very high	70 Å²	70	35.3 Å²	35.3	28%	0.275	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-95.6	-7	-179	-62	-86.4	0	0	0	112.8	Y119 F526 W529 E530 D531 Q535	Y119-Y533 HydrophobicContact CD2-CE1 4.47Å; F526-Y533 WeakPolarHBondContact CD2-O 3.41Å; F526-Y533 WeakPolarHBondContact CE2-O 3.35Å; W529-Y533 HydrophobicContact CB-CD2 4.39Å; W529-Y533 HydrophobicContact CE3-CD2 4.47Å; W529-Y533 HydrophobicContact CE3-CE2 4.38Å; E530-Y533 HydrophobicContact CB-CD2 4.07Å; E530-Y533 HydrophobicContact CB-CE2 4.21Å; E530-Y533 WeakPolarHBondContact O-CD2 3.33Å; E530-Y533 PolarHBondContact O-N 3.26Å; D531-Y533 PolarHBondContact O-N 3.05Å; Y533-Q535 PolarHBondContact O-N 2.68Å
534	D	98.1	Very high	97.1	Very high	7 Å²	7	33.7 Å²	33.7	4%	0.037	17%	0.168	C	C	.	.			trans	-58.9	137.4	175.9	-80.5	35.6	0	0	0	110.8	S399 T515 R523 I524 H525 D531	S399-D534 VanDerWaalsContact CA-O 3.23Å; S399-D534 WeakPolarHBondContact CA-O 3.29Å; S399-D534 WeakPolarHBondContact CB-O 3.49Å; T515-D534 PolarHBondContact OG1-OD2 2.76Å; R523-D534 HydrophobicContact CG-CB 4.02Å; R523-D534 WeakPolarHBondContact CG-OD2 3.29Å; R523-D534 IonicContact NE-OD2 2.71Å; R523-D534 PolarHBondContact NH1-O 3.19Å; R523-D534 PolarHBondContact NH2-O 2.92Å; I524-D534 CarbonylContact O-C 3.55Å; I524-D534 WeakPolarHBondContact O-CA 3.33Å; I524-D534 WeakPolarHBondContact O-CB 3.23Å; H525-D534 VanDerWaalsContact CA-OD1 3.31Å; H525-D534 WeakPolarHBondContact CA-OD1 3.49Å; H525-D534 VanDerWaalsContact CB-OD1 3.31Å; H525-D534 WeakPolarHBondContact CB-OD1 3.24Å; H525-D534 IonicContact CE1-OD1 3.33Å; H525-D534 IonicContact CG-OD1 3.13Å; H525-D534 IonicContact ND1-OD1 3.65Å; H525-D534 PolarHBondContact ND1-OD1 3.42Å; D531-D534 WeakPolarHBondContact O-CB 3.45Å; D531-D534 PolarHBondContact O-N 3.25Å
535	Q	98.4	Very high	97.2	Very high	6 Å²	6	33.6 Å²	33.6	3%	0.028	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	144.4	-176.5	-68.7	169.8	14.4	0	0	111.6	L398 D502 I524 F526 Y533 V537	L398-Q535 HydrophobicContact CB-CB 4.29Å; L398-Q535 HydrophobicContact CB-CG 4.11Å; D502-Q535 PolarHBondContact OD1-NE2 2.54Å; I524-Q535 PolarHBondContact N-O 2.73Å; I524-Q535 PolarHBondContact O-N 3.43Å; F526-Q535 HydrophobicContact CE2-CG 3.98Å; F526-Q535 HydrophobicContact CZ-CG 4.47Å; Y533-Q535 PolarHBondContact O-N 2.68Å; Q535-V537 HydrophobicContact CB-CG2 4.05Å
536	W	98.6	Very high	97.2	Very high	13 Å²	13	32.2 Å²	32.2	5%	0.049	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	119.1	168.2	-74.5	120.2	0	0	0	109.6	I393 L398 I401 I451 I518 L521 L522 R523	I393-W536 HydrophobicContact CD1-CB 3.96Å; I393-W536 HydrophobicContact CG1-CB 4.44Å; L398-W536 PolarHBondContact O-N 2.89Å; I401-W536 HydrophobicContact CD1-CD2 4.44Å; I401-W536 HydrophobicContact CD1-CG 4.35Å; I401-W536 HydrophobicContact CG1-CG 4.27Å; I451-W536 HydrophobicContact CB-CZ2 4.38Å; I451-W536 HydrophobicContact CD1-CH2 3.92Å; I451-W536 HydrophobicContact CD1-CZ2 3.98Å; I451-W536 HydrophobicContact CG1-CH2 3.99Å; I451-W536 HydrophobicContact CG1-CZ2 3.9Å; I451-W536 HydrophobicContact CG2-CZ2 3.64Å; I518-W536 HydrophobicContact CG1-CH2 4.47Å; L521-W536 HydrophobicContact CD1-CB 4.33Å; L521-W536 HydrophobicContact CD2-CD2 4.03Å; L521-W536 HydrophobicContact CD2-CE3 3.63Å; L521-W536 HydrophobicContact CD2-CG 4.49Å; L521-W536 HydrophobicContact CD2-CZ3 4.05Å; L521-W536 HydrophobicContact CG-CD2 4.43Å; L521-W536 HydrophobicContact CG-CE3 3.7Å; L521-W536 HydrophobicContact CG-CZ3 4.21Å; L522-W536 WeakPolarHBondContact O-CA 3.36Å; R523-W536 HydrophobicContact CB-CE3 4Å; R523-W536 HydrophobicContact CB-CH2 4.21Å; R523-W536 HydrophobicContact CB-CZ3 3.75Å
537	V	98.3	Very high	97.2	Very high	8 Å²	8	31.9 Å²	31.9	5%	0.048	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	142.4	-173.2	-171	0	0	0	0	109.9	L503 L522 I524 Q535 S541 L544	L503-V537 HydrophobicContact CD1-CG2 4.06Å; L522-V537 WeakPolarHBondContact CA-O 3.31Å; L522-V537 WeakPolarHBondContact CB-O 3.37Å; L522-V537 PolarHBondContact N-O 2.86Å; L522-V537 PolarHBondContact O-N 3.18Å; I524-V537 HydrophobicContact CG1-CB 4.05Å; I524-V537 HydrophobicContact CG1-CG2 3.97Å; Q535-V537 HydrophobicContact CB-CG2 4.05Å; V537-S541 VanDerWaalsContact CG1-CB 3.44Å; V537-S541 WeakPolarHBondContact CG1-OG 3.28Å; V537-L544 HydrophobicContact CB-CD1 4.24Å; V537-L544 HydrophobicContact CG1-CD1 3.74Å; V537-L544 HydrophobicContact CG1-CD2 4.15Å; V537-L544 HydrophobicContact CG1-CG 3.85Å
538	D	98.4	Very high	97.2	Very high	16 Å²	16	31.5 Å²	31.5	9%	0.086	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	146.5	176.8	-174.2	68.4	0	0	0	112.8	P438 R520 E540 S541	P438-D538 HydrophobicContact CB-CB 3.75Å; P438-D538 VanDerWaalsContact CB-CG 3.46Å; P438-D538 VanDerWaalsContact CB-OD1 3.22Å; P438-D538 WeakPolarHBondContact CB-OD1 3.37Å; P438-D538 HydrophobicContact CG-CB 3.55Å; R520-D538 WeakPolarHBondContact CG-OD1 3.26Å; R520-D538 IonicContact CZ-OD1 3.18Å; R520-D538 IonicContact CZ-OD2 3.49Å; R520-D538 IonicContact NE-OD1 3.66Å; R520-D538 PolarHBondContact NE-OD1 3.32Å; R520-D538 IonicContact NE-OD2 3.38Å; R520-D538 IonicContact NH2-OD1 2.78Å; R520-D538 PolarHBondContact NH2-OD1 2.77Å; R520-D538 IonicContact NH2-OD2 2.72Å; R520-D538 PolarHBondContact NH2-OD2 2.96Å; D538-E540 PolarHBondContact O-N 2.91Å; D538-E540 WeakPolarHBondContact OD2-CB 3.36Å; D538-E540 PolarHBondContact OD2-N 2.98Å; D538-S541 WeakPolarHBondContact O-CB 3.17Å; D538-S541 PolarHBondContact O-N 2.96Å
539	C	98.2	Very high	97.4	Very high	4 Å²	4	30.1 Å²	30.1	3%	0.027	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-15	179.4	69.1	0	0	0	0	115	H490 F492 R520 L522	H490-C539 HydrophobicContact CB-CB 3.81Å; H490-C539 VanDerWaalsContact CD2-SG 3.6Å; F492-C539 HydrophobicContact CD2-CB 4.06Å; F492-C539 HydrophobicContact CE2-CB 4.21Å; F492-C539 WeakPolarHBondContact CE2-O 3.37Å; R520-C539 VanDerWaalsContact O-CB 3.25Å; R520-C539 WeakPolarHBondContact O-CB 3.41Å; R520-C539 PolarHBondContact O-N 3.13Å; R520-C539 PolarHBondContact O-SG 2.75Å; R520-C539 VanDerWaalsContact O-SG 3.34Å; L522-C539 HydrophobicContact CD1-CB 3.99Å; L522-C539 HydrophobicContact CD2-CB 4.17Å; L522-C539 HydrophobicContact CG-CB 3.99Å
540	E	97.5	Very high	97.5	Very high	89 Å²	89	26.5 Å²	26.5	42%	0.416	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	8.3	173.5	-56.7	-175.8	115.7	0	0	112.2	P488 R520 D538	P488-E540 HydrophobicContact CG-CG 4.15Å; R520-E540 IonicContact CZ-OE2 3.51Å; R520-E540 IonicContact NH1-OE2 3.97Å; R520-E540 PolarHBondContact NH1-OE2 3.23Å; R520-E540 IonicContact NH2-OE2 2.7Å; R520-E540 PolarHBondContact NH2-OE2 3.35Å; D538-E540 PolarHBondContact O-N 2.91Å; D538-E540 WeakPolarHBondContact OD2-CB 3.36Å; D538-E540 PolarHBondContact OD2-N 2.98Å
541	S	98.2	Very high	97.6	Very high	19 Å²	19	26.7 Å²	26.7	13%	0.133	13%	0.131	C	C	.	.			trans	-54.3	138.4	-179.5	177.5	0	0	0	0	113.1	H162 V537 D538 D543	H162-S541 PolarHBondContact CE1-O 2.92Å; H162-S541 PolarHBondContact ND1-O 2.81Å; V537-S541 VanDerWaalsContact CG1-CB 3.44Å; V537-S541 WeakPolarHBondContact CG1-OG 3.28Å; D538-S541 WeakPolarHBondContact O-CB 3.17Å; D538-S541 PolarHBondContact O-N 2.96Å; S541-D543 PolarHBondContact O-N 3.04Å; S541-D543 PolarHBondContact OG-N 3.29Å
542	P	98.2	Very high	97.7	Very high	13 Å²	13	22.7 Å²	22.7	8%	0.084	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	6.3	176.6	38.1	-37.8	0	0	0	114	H332 Y545	H332-P542 HydrophobicContact CB-CB 3.73Å; H332-P542 HydrophobicContact CB-CG 4.18Å; H332-P542 WeakPolarHBondContact CB-O 3.29Å; P542-Y545 WeakPolarHBondContact O-CE1 3.12Å; P542-Y545 VanDerWaalsContact O-CZ 3.31Å; P542-Y545 PolarHBondContact O-OH 3.39Å
543	D	98.7	Very high	98	Very high	15 Å²	15	21.2 Å²	21.2	8%	0.08	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.1	14.3	-176	-68.2	-74.5	0	0	0	112.8	R314 V501 L503 S541	R314-D543 IonicContact CZ-OD1 2.69Å; R314-D543 IonicContact NH1-OD1 3.22Å; R314-D543 PolarHBondContact NH1-OD1 2.78Å; R314-D543 IonicContact NH2-OD1 2.75Å; R314-D543 PolarHBondContact NH2-OD1 2.7Å; V501-D543 HydrophobicContact CB-CB 3.98Å; V501-D543 WeakPolarHBondContact CB-O 3.42Å; V501-D543 HydrophobicContact CG2-CB 3.81Å; V501-D543 VanDerWaalsContact CG2-O 3.29Å; V501-D543 WeakPolarHBondContact CG2-O 3.4Å; V501-D543 PolarHBondContact N-O 3.02Å; L503-D543 HydrophobicContact CD2-CB 3.96Å; S541-D543 PolarHBondContact O-N 3.04Å; S541-D543 PolarHBondContact OG-N 3.29Å
544	L	98.9	Very high	98.1	Very high	4 Å²	4	21 Å²	21	2%	0.021	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	136.2	169.6	-57.3	177.8	0	0	0	109.2	F160 H162 L498 A500 L522 I524 V537	F160-L544 HydrophobicContact CD1-CB 4.31Å; F160-L544 WeakPolarHBondContact CD1-O 3.39Å; F160-L544 HydrophobicContact CE1-CB 3.98Å; H162-L544 PolarHBondContact CE1-O 2.81Å; H162-L544 PolarHBondContact NE2-O 2.76Å; H162-L544 VanDerWaalsContact NE2-O 3.14Å; L498-L544 HydrophobicContact CD1-CD2 4.19Å; A500-L544 HydrophobicContact CB-CD2 3.73Å; L522-L544 HydrophobicContact CD1-CD1 3.98Å; I524-L544 HydrophobicContact CD1-CD1 4.06Å; I524-L544 HydrophobicContact CD1-CD2 4.25Å; I524-L544 HydrophobicContact CG1-CD1 4.31Å; I524-L544 HydrophobicContact CG1-CD2 4Å; I524-L544 HydrophobicContact CG2-CD2 4.37Å; V537-L544 HydrophobicContact CB-CD1 4.24Å; V537-L544 HydrophobicContact CG1-CD1 3.74Å; V537-L544 HydrophobicContact CG1-CD2 4.15Å; V537-L544 HydrophobicContact CG1-CG 3.85Å
545	Y	98.9	Very high	98	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	153.7	-172.5	-54.2	-59.8	0	0	0	113.5	F160 H162 R314 L498 E499 V501 V509 P542 W549	F160-Y545 VanDerWaalsContact CE1-C 3.44Å; F160-Y545 WeakPolarHBondContact CZ-O 3.34Å; H162-Y545 AromaticContact CD2-CE1 3.82Å; H162-Y545 AromaticContact NE2-CD1 3.34Å; H162-Y545 VanDerWaalsContact NE2-CD1 3.34Å; H162-Y545 WeakPolarHBondContact NE2-CD1 3.26Å; H162-Y545 AromaticContact NE2-CE1 3.27Å; H162-Y545 VanDerWaalsContact NE2-CE1 3.27Å; H162-Y545 WeakPolarHBondContact NE2-CE1 3.24Å; R314-Y545 PolarHBondContact NH1-OH 2.77Å; L498-Y545 WeakPolarHBondContact CB-O 3.32Å; E499-Y545 PolarHBondContact N-O 3Å; E499-Y545 PolarHBondContact O-N 3.08Å; V501-Y545 HydrophobicContact CG2-CE2 3.84Å; V509-Y545 HydrophobicContact CG1-CD2 4.26Å; V509-Y545 HydrophobicContact CG2-CE2 4.37Å; P542-Y545 WeakPolarHBondContact O-CE1 3.12Å; P542-Y545 VanDerWaalsContact O-CZ 3.31Å; P542-Y545 PolarHBondContact O-OH 3.39Å; Y545-W549 AromaticContact CD1-CD1 3.98Å; Y545-W549 AromaticContact CD1-CD2 4Å; Y545-W549 HydrophobicContact CD1-CD2 4Å; Y545-W549 AromaticContact CD1-CE2 3.8Å; Y545-W549 HydrophobicContact CD1-CG 4.14Å; Y545-W549 HydrophobicContact CD1-CZ2 4.35Å; Y545-W549 AromaticContact CD1-NE1 3.74Å; Y545-W549 AromaticContact CD2-CD2 3.77Å; Y545-W549 HydrophobicContact CD2-CD2 3.77Å; Y545-W549 AromaticContact CD2-CE3 3.61Å; Y545-W549 HydrophobicContact CD2-CE3 3.61Å; Y545-W549 HydrophobicContact CD2-CG 4.43Å; Y545-W549 HydrophobicContact CD2-CH2 4.19Å; Y545-W549 HydrophobicContact CD2-CZ2 4.28Å; Y545-W549 AromaticContact CD2-CZ3 3.85Å; Y545-W549 HydrophobicContact CD2-CZ3 3.85Å; Y545-W549 HydrophobicContact CE1-CZ2 4.13Å; Y545-W549 HydrophobicContact CE2-CD2 4.36Å; Y545-W549 HydrophobicContact CE2-CE3 4.16Å; Y545-W549 AromaticContact CE2-CH2 3.89Å; Y545-W549 HydrophobicContact CE2-CH2 3.89Å; Y545-W549 HydrophobicContact CE2-CZ2 4.03Å; Y545-W549 AromaticContact CE2-CZ3 3.94Å; Y545-W549 HydrophobicContact CE2-CZ3 3.94Å; Y545-W549 HydrophobicContact CG-CB 4.39Å; Y545-W549 AromaticContact CG-CD2 3.58Å; Y545-W549 HydrophobicContact CG-CD2 3.58Å; Y545-W549 AromaticContact CG-CE2 3.85Å; Y545-W549 AromaticContact CG-CE3 3.91Å; Y545-W549 HydrophobicContact CG-CE3 3.91Å; Y545-W549 AromaticContact CG-CG 3.8Å; Y545-W549 HydrophobicContact CG-CG 3.8Å; Y545-W549 HydrophobicContact CG-CZ2 4.44Å; Y545-W549 AromaticContact CZ-CZ2 3.98Å
546	P	98.8	Very high	97.9	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.155	C	C	.	.			trans	-65.1	151.8	173.5	-10.1	21.8	0	0	0	112	V157 F160 A163 Y203 G548 W549	V157-P546 HydrophobicContact CB-CG 4.31Å; V157-P546 HydrophobicContact CG1-CG 4.29Å; V157-P546 HydrophobicContact CG2-CB 3.89Å; V157-P546 HydrophobicContact CG2-CG 4.08Å; F160-P546 HydrophobicContact CB-CG 4.02Å; F160-P546 HydrophobicContact CD2-CB 3.95Å; F160-P546 HydrophobicContact CD2-CG 3.46Å; F160-P546 VanDerWaalsContact CD2-CG 3.46Å; F160-P546 HydrophobicContact CE2-CB 3.94Å; F160-P546 HydrophobicContact CE2-CG 3.97Å; F160-P546 HydrophobicContact CG-CG 3.81Å; A163-P546 HydrophobicContact CB-CG 4.13Å; Y203-P546 HydrophobicContact CD2-CB 3.9Å; Y203-P546 HydrophobicContact CD2-CG 4.22Å; Y203-P546 HydrophobicContact CE2-CB 3.69Å; Y203-P546 HydrophobicContact CE2-CG 3.48Å; Y203-P546 VanDerWaalsContact CE2-CG 3.48Å; P546-G548 PolarHBondContact O-N 2.95Å; P546-W549 VanDerWaalsContact O-CB 3.25Å; P546-W549 WeakPolarHBondContact O-CB 3.31Å; P546-W549 PolarHBondContact O-N 2.98Å
547	V	98.8	Very high	97.9	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	127.6	170.1	166.1	0	0	0	0	110.9	W143 I147 A154 A201 G202 Y203 K497	W143-V547 HydrophobicContact CB-CG1 4.08Å; W143-V547 HydrophobicContact CD2-CB 4.46Å; W143-V547 HydrophobicContact CD2-CG1 3.62Å; W143-V547 HydrophobicContact CD2-CG2 4.18Å; W143-V547 HydrophobicContact CE3-CG1 4.08Å; W143-V547 HydrophobicContact CE3-CG2 4.16Å; W143-V547 HydrophobicContact CG-CG1 3.64Å; W143-V547 HydrophobicContact CH2-CG2 3.75Å; W143-V547 HydrophobicContact CZ2-CG2 3.78Å; W143-V547 HydrophobicContact CZ3-CG2 3.96Å; I147-V547 HydrophobicContact CD1-CG1 4.08Å; A154-V547 HydrophobicContact CB-CB 4Å; A154-V547 HydrophobicContact CB-CG2 3.57Å; A201-V547 WeakPolarHBondContact O-CG1 3.44Å; G202-V547 WeakPolarHBondContact CA-O 3.36Å; Y203-V547 PolarHBondContact N-O 2.87Å; K497-V547 HydrophobicContact CB-CG2 4.39Å
548	G	98.1	Very high	97.8	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.1	5.4	-176.6	0	0	0	0	0	114.9	N223 E499 P546 Q551 L552	N223-G548 PolarHBondContact ND2-O 3.32Å; E499-G548 WeakPolarHBondContact OE1-CA 3.37Å; E499-G548 PolarHBondContact OE1-N 2.97Å; P546-G548 PolarHBondContact O-N 2.95Å; G548-Q551 PolarHBondContact O-N 3.44Å; G548-L552 WeakPolarHBondContact O-CB 3.26Å; G548-L552 PolarHBondContact O-N 3Å
549	W	98.7	Very high	97.7	Very high	1 Å²	1	33.6 Å²	33.6	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-65.7	-44.2	177.2	174.5	91.8	0	0	0	111.9	Y203 G312 R314 E499 V509 Y545 P546 Q551 L552 T553 Y555	Y203-W549 HydrophobicContact CD2-CB 4.31Å; Y203-W549 HydrophobicContact CE2-CB 3.89Å; G312-W549 WeakPolarHBondContact O-CZ2 3.46Å; R314-W549 HydrophobicContact CG-CH2 3.93Å; R314-W549 HydrophobicContact CG-CZ2 4.19Å; E499-W549 WeakPolarHBondContact OE2-CB 3.49Å; E499-W549 PolarHBondContact OE2-N 2.83Å; V509-W549 HydrophobicContact CG1-CZ3 4.4Å; V509-W549 HydrophobicContact CG2-CZ3 4.17Å; Y545-W549 AromaticContact CD1-CD1 3.98Å; Y545-W549 AromaticContact CD1-CD2 4Å; Y545-W549 HydrophobicContact CD1-CD2 4Å; Y545-W549 AromaticContact CD1-CE2 3.8Å; Y545-W549 HydrophobicContact CD1-CG 4.14Å; Y545-W549 HydrophobicContact CD1-CZ2 4.35Å; Y545-W549 AromaticContact CD1-NE1 3.74Å; Y545-W549 AromaticContact CD2-CD2 3.77Å; Y545-W549 HydrophobicContact CD2-CD2 3.77Å; Y545-W549 AromaticContact CD2-CE3 3.61Å; Y545-W549 HydrophobicContact CD2-CE3 3.61Å; Y545-W549 HydrophobicContact CD2-CG 4.43Å; Y545-W549 HydrophobicContact CD2-CH2 4.19Å; Y545-W549 HydrophobicContact CD2-CZ2 4.28Å; Y545-W549 AromaticContact CD2-CZ3 3.85Å; Y545-W549 HydrophobicContact CD2-CZ3 3.85Å; Y545-W549 HydrophobicContact CE1-CZ2 4.13Å; Y545-W549 HydrophobicContact CE2-CD2 4.36Å; Y545-W549 HydrophobicContact CE2-CE3 4.16Å; Y545-W549 AromaticContact CE2-CH2 3.89Å; Y545-W549 HydrophobicContact CE2-CH2 3.89Å; Y545-W549 HydrophobicContact CE2-CZ2 4.03Å; Y545-W549 AromaticContact CE2-CZ3 3.94Å; Y545-W549 HydrophobicContact CE2-CZ3 3.94Å; Y545-W549 HydrophobicContact CG-CB 4.39Å; Y545-W549 AromaticContact CG-CD2 3.58Å; Y545-W549 HydrophobicContact CG-CD2 3.58Å; Y545-W549 AromaticContact CG-CE2 3.85Å; Y545-W549 AromaticContact CG-CE3 3.91Å; Y545-W549 HydrophobicContact CG-CE3 3.91Å; Y545-W549 AromaticContact CG-CG 3.8Å; Y545-W549 HydrophobicContact CG-CG 3.8Å; Y545-W549 HydrophobicContact CG-CZ2 4.44Å; Y545-W549 AromaticContact CZ-CZ2 3.98Å; P546-W549 VanDerWaalsContact O-CB 3.25Å; P546-W549 WeakPolarHBondContact O-CB 3.31Å; P546-W549 PolarHBondContact O-N 2.98Å; W549-Q551 VanDerWaalsContact C-N 3.29Å; W549-Q551 PolarHBondContact O-N 3.1Å; W549-L552 PolarHBondContact O-N 2.98Å; W549-L552 VanDerWaalsContact O-N 3.17Å; W549-T553 HydrophobicContact CD2-CG2 4.16Å; W549-T553 HydrophobicContact CG-CG2 4.35Å; W549-T553 HydrophobicContact CZ2-CG2 4.09Å; W549-T553 WeakPolarHBondContact O-CB 3.3Å; W549-T553 WeakPolarHBondContact O-CG2 3.29Å; W549-T553 PolarHBondContact O-N 3.18Å; W549-T553 PolarHBondContact O-OG1 2.76Å; W549-Y555 HydrophobicContact CH2-CD2 4.01Å; W549-Y555 AromaticContact CH2-CG 3.96Å; W549-Y555 HydrophobicContact CH2-CG 3.96Å; W549-Y555 HydrophobicContact CZ3-CD1 4.22Å; W549-Y555 HydrophobicContact CZ3-CD2 4.31Å; W549-Y555 AromaticContact CZ3-CG 3.79Å; W549-Y555 HydrophobicContact CZ3-CG 3.79Å
550	C	98.4	Very high	97.6	Very high	4 Å²	4	34.8 Å²	34.8	3%	0.027	20%	0.195	C	C	.	.	H	α-helix	trans	-56	-44.3	172.9	-86.2	0	0	0	0	111.5	E499 L552 T553 G554 Y555 L557	E499-C550 WeakPolarHBondContact OE2-CB 3.41Å; E499-C550 PolarHBondContact OE2-N 2.98Å; C550-L552 PolarHBondContact O-N 2.67Å; C550-T553 PolarHBondContact O-N 3.48Å; C550-G554 CarbonylContact O-C 3.57Å; C550-G554 WeakPolarHBondContact O-CA 3.5Å; C550-G554 PolarHBondContact O-N 2.72Å; C550-Y555 WeakPolarHBondContact CB-O 3.47Å; C550-Y555 PolarHBondContact O-N 3Å; C550-Y555 VanDerWaalsContact O-N 3.09Å; C550-L557 HydrophobicContact CB-CB 3.79Å
551	Q	96.6	Very high	97.3	Very high	126 Å²	126	31.4 Å²	31.4	59%	0.589	18%	0.182	S	C	*	.	H	α-helix	trans	-64.9	-38.6	177.1	-176.5	179.9	1.6	0	0	112.6	N204 G548 W549	N204-Q551 PolarHBondContact OD1-OE1 3.35Å; G548-Q551 PolarHBondContact O-N 3.44Å; W549-Q551 VanDerWaalsContact C-N 3.29Å; W549-Q551 PolarHBondContact O-N 3.1Å
552	L	96.8	Very high	96.6	Very high	30 Å²	30	36.1 Å²	36.1	16%	0.157	21%	0.213	C	C	.	.	H	α-helix	trans	-71.6	-35.8	178.3	177.2	57.4	0	0	0	112.7	P164 Y203 C225 M281 G548 W549 C550	P164-L552 HydrophobicContact CB-CD2 4.21Å; Y203-L552 HydrophobicContact CD1-CD2 3.96Å; Y203-L552 HydrophobicContact CD2-CD2 4.34Å; Y203-L552 HydrophobicContact CE1-CD2 3.85Å; Y203-L552 HydrophobicContact CE2-CD2 4.22Å; Y203-L552 HydrophobicContact CG-CD2 4.21Å; C225-L552 HydrophobicContact CB-CD1 3.5Å; C225-L552 VanDerWaalsContact CB-CD1 3.5Å; C225-L552 HydrophobicContact CB-CD2 3.83Å; C225-L552 HydrophobicContact CB-CG 4.31Å; M281-L552 HydrophobicContact CE-CD1 4.5Å; M281-L552 HydrophobicContact CE-CG 4.25Å; M281-L552 WeakPolarHBondContact CE-O 3.32Å; M281-L552 HydrophobicContact SD-CD2 4.44Å; M281-L552 HydrophobicContact SD-CG 4.2Å; G548-L552 WeakPolarHBondContact O-CB 3.26Å; G548-L552 PolarHBondContact O-N 3Å; W549-L552 PolarHBondContact O-N 2.98Å; W549-L552 VanDerWaalsContact O-N 3.17Å; C550-L552 PolarHBondContact O-N 2.67Å
553	T	96.9	Very high	95	Very high	20 Å²	20	43.5 Å²	43.5	12%	0.123	25%	0.246	C	C	.	.	H	α-helix	trans	-96.9	-11.9	-173.2	57.9	0	0	0	0	114.4	M281 G312 W549 C550 Y555	M281-T553 HydrophobicContact CE-CG2 4.19Å; M281-T553 HydrophobicContact SD-CG2 4.43Å; G312-T553 VanDerWaalsContact CA-CG2 3.5Å; W549-T553 HydrophobicContact CD2-CG2 4.16Å; W549-T553 HydrophobicContact CG-CG2 4.35Å; W549-T553 HydrophobicContact CZ2-CG2 4.09Å; W549-T553 WeakPolarHBondContact O-CB 3.3Å; W549-T553 WeakPolarHBondContact O-CG2 3.29Å; W549-T553 PolarHBondContact O-N 3.18Å; W549-T553 PolarHBondContact O-OG1 2.76Å; C550-T553 PolarHBondContact O-N 3.48Å; T553-Y555 VanDerWaalsContact C-N 3.29Å
554	G	96.1	Very high	92.5	Very high	67 Å²	67	47 Å²	47	69%	0.691	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	12.7	-172.1	0	0	0	0	0	114	C550	C550-G554 CarbonylContact O-C 3.57Å; C550-G554 WeakPolarHBondContact O-CA 3.5Å; C550-G554 PolarHBondContact O-N 2.72Å
555	Y	96.9	Very high	89.6	Confident	20 Å²	20	52.5 Å²	52.5	8%	0.078	31%	0.311	C	S	.	.			trans	-78	143.5	176.3	-151.5	-81.6	0	0	0	111.1	I311 R314 W330 R507 V509 W549 C550 T553 L557	I311-Y555 HydrophobicContact CB-CD2 3.97Å; I311-Y555 HydrophobicContact CB-CE2 4.37Å; I311-Y555 HydrophobicContact CG2-CD2 3.73Å; R314-Y555 HydrophobicContact CB-CE2 4.4Å; W330-Y555 HydrophobicContact CE3-CE2 4.28Å; W330-Y555 HydrophobicContact CH2-CE2 4.35Å; W330-Y555 AromaticContact CZ3-CE2 3.72Å; W330-Y555 HydrophobicContact CZ3-CE2 3.72Å; W330-Y555 WeakPolarHBondContact CZ3-OH 2.99Å; R507-Y555 PolarHBondContact O-OH 2.72Å; R507-Y555 VanDerWaalsContact O-OH 3.09Å; V509-Y555 HydrophobicContact CB-CD1 4.13Å; V509-Y555 HydrophobicContact CB-CE1 4.23Å; V509-Y555 HydrophobicContact CG2-CD1 3.82Å; V509-Y555 HydrophobicContact CG2-CE1 3.65Å; W549-Y555 HydrophobicContact CH2-CD2 4.01Å; W549-Y555 AromaticContact CH2-CG 3.96Å; W549-Y555 HydrophobicContact CH2-CG 3.96Å; W549-Y555 HydrophobicContact CZ3-CD1 4.22Å; W549-Y555 HydrophobicContact CZ3-CD2 4.31Å; W549-Y555 AromaticContact CZ3-CG 3.79Å; W549-Y555 HydrophobicContact CZ3-CG 3.79Å; C550-Y555 WeakPolarHBondContact CB-O 3.47Å; C550-Y555 PolarHBondContact O-N 3Å; C550-Y555 VanDerWaalsContact O-N 3.09Å; T553-Y555 VanDerWaalsContact C-N 3.29Å; Y555-L557 PolarHBondContact O-N 2.8Å
556	Q	96.8	Very high	86.9	Confident	138 Å²	138	63.4 Å²	63.4	65%	0.645	35%	0.352	S	S	*	.			trans	-77.8	111.6	-179.5	-178	60.4	61.3	0	0	111.8
557	L	97.7	Very high	83.8	Confident	22 Å²	22	70.5 Å²	70.5	12%	0.115	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	135	170.2	-175.4	61.1	0	0	0	110.9	F141 W143 E499 V509 V511 C550 Y555	F141-L557 HydrophobicContact CD1-CD2 3.96Å; F141-L557 HydrophobicContact CE1-CD2 3.83Å; W143-L557 VanDerWaalsContact NE1-CD2 3.31Å; E499-L557 HydrophobicContact CB-CD1 4.4Å; E499-L557 HydrophobicContact CG-CD1 3.84Å; V509-L557 HydrophobicContact CG1-CD1 4.43Å; V509-L557 CarbonylContact O-C 3.15Å; V509-L557 WeakPolarHBondContact O-CA 3.35Å; V511-L557 HydrophobicContact CG2-CD1 3.97Å; V511-L557 HydrophobicContact CG2-CD2 3.82Å; V511-L557 HydrophobicContact CG2-CG 3.97Å; C550-L557 HydrophobicContact CB-CB 3.79Å; Y555-L557 PolarHBondContact O-N 2.8Å
558	Q	97.5	Very high	80.8	Confident	64 Å²	64	76.3 Å²	76.3	30%	0.299	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	130.2	167.5	-54.5	-51.4	-55.8	0	0	109.9	L508 V509 C510 V511	L508-Q558 HydrophobicContact CB-CG 4.13Å; L508-Q558 HydrophobicContact CD2-CG 3.88Å; L508-Q558 HydrophobicContact CG-CG 4.43Å; V509-Q558 PolarHBondContact O-N 2.99Å; C510-Q558 HydrophobicContact CB-CB 4.39Å; V511-Q558 WeakPolarHBondContact CG2-O 3.34Å; V511-Q558 PolarHBondContact N-O 3.5Å
559	P	96.3	Very high	77.8	Confident	69 Å²	69	86 Å²	86	45%	0.448	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-70.5	165.7	177.1	33.6	-37.8	0	0	0	111.5	F141	F141-P559 HydrophobicContact CB-CB 3.74Å; F141-P559 HydrophobicContact CD2-CB 4.39Å; F141-P559 HydrophobicContact CG-CB 4.14Å
560	P	95.1	Very high	74.6	Confident	29 Å²	29	91 Å²	91	19%	0.188	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-54.8	143.4	166.4	-23.4	34.5	0	0	0	111.2	F141 Y146 V511 D527	F141-P560 VanDerWaalsContact CD2-CD 3.44Å; F141-P560 HydrophobicContact CD2-CG 4.23Å; F141-P560 VanDerWaalsContact CE2-CD 3.48Å; F141-P560 HydrophobicContact CE2-CG 3.84Å; Y146-P560 HydrophobicContact CE1-CG 4.47Å; Y146-P560 HydrophobicContact CE2-CG 4.23Å; V511-P560 HydrophobicContact CB-CG 4.04Å; V511-P560 HydrophobicContact CG1-CG 3.73Å; D527-P560 HydrophobicContact CB-CB 3.92Å; D527-P560 HydrophobicContact CB-CG 4.08Å; D527-P560 CarbonylContact O-C 3.58Å; D527-P560 WeakPolarHBondContact O-CA 3.28Å; D527-P560 WeakPolarHBondContact O-CB 3.28Å
561	A	90.6	Very high	71.2	Confident	18 Å²	18	96.5 Å²	96.5	15%	0.149	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-64.5	139.9	176.7	0	0	0	0	0	110.6	D527 W529 Q563	D527-A561 PolarHBondContact O-N 3.2Å; W529-A561 HydrophobicContact CD2-CB 4.25Å; W529-A561 HydrophobicContact CG-CB 4.35Å; W529-A561 HydrophobicContact CZ2-CB 4.33Å; A561-Q563 PolarHBondContact O-N 3.5Å; A561-Q563 VanDerWaalsContact O-N 3.09Å
562	P	84.9	Confident	67.9	Low	118 Å²	118	96.1 Å²	96.1	77%	0.766	56%	0.561	S	S	*	*			trans	-67.5	112.5	-179.1	27.1	-33.8	0	0	0	109.9	S564	P562-S564 PolarHBondContact O-N 3.24Å
563	Q	64.2	Low	64.8	Low	169 Å²	169	100.1 Å²	100.1	79%	0.79	59%	0.591	S	S	*	*			trans	-60.3	106.5	176.8	-70.6	-174.7	-12.5	0	0	110.2	A561 S565	A561-Q563 PolarHBondContact O-N 3.5Å; A561-Q563 VanDerWaalsContact O-N 3.09Å; Q563-S565 PolarHBondContact O-N 3.26Å; Q563-S565 VanDerWaalsContact O-N 3.17Å
564	S	46.8	Very low	61.4	Low	87 Å²	87	109.3 Å²	109.3	61%	0.608	63%	0.629	S	S	*	*			trans	-63.5	117.7	168.9	69.3	0	0	0	0	108.2	P562 R566	P562-S564 PolarHBondContact O-N 3.24Å; S564-R566 PolarHBondContact O-N 2.96Å
565	S	36.2	Very low	58.3	Low	121 Å²	121	115.5 Å²	115.5	85%	0.846	64%	0.64	S	S	*	*			trans	-71.7	71.7	-171.6	44.6	0	0	0	0	113.2	Q563 D567	Q563-S565 PolarHBondContact O-N 3.26Å; Q563-S565 VanDerWaalsContact O-N 3.17Å; S565-D567 PolarHBondContact O-N 3.31Å
566	R	42	Very low	54.9	Low	228 Å²	228	123.9 Å²	123.9	86%	0.86	68%	0.677	S	S	*	*			trans	-76.3	47.4	174.8	-72.2	-171	173.8	179.7	1.4	113	S564	S564-R566 PolarHBondContact O-N 2.96Å
567	D	35.5	Very low	51.4	Low	150 Å²	150	126.7 Å²	126.7	80%	0.802	69%	0.687	S	S	*	*			trans	-148.7	88.9	170.6	-116	-32.4	0	0	0	112.2	S565	S565-D567 PolarHBondContact O-N 3.31Å
568	S	35	Very low	47.8	Very low	121 Å²	121	135 Å²	135	85%	0.846	72%	0.722	S	S	*	*			trans	-168.8	33.9	162.7	-85.5	0	0	0	0	113.7
569	Q	34.2	Very low	44.3	Very low	203 Å²	203	136.8 Å²	136.8	95%	0.949	75%	0.748	S	S	*	*			trans	-138	77.2	166.1	-75	-157.7	8.3	0	0	113.1
570	S	31.3	Very low	40.9	Very low	107 Å²	107	143.7 Å²	143.7	75%	0.748	77%	0.771	S	S	*	*	S	Bend	trans	-141.1	143.3	148.6	75	0	0	0	0	111.7
571	S	28.7	Very low	37.6	Very low	119 Å²	119	148 Å²	148	83%	0.832	80%	0.802	S	S	*	*			trans	62.9	74.7	172.7	62.1	0	0	0	0	119.9
572	S	26.8	Very low	34.4	Very low	119 Å²	119	155.5 Å²	155.5	83%	0.832	83%	0.833	S	S	*	*			trans	-129.3	80.9	144.9	58.6	0	0	0	0	112
573	S	31	Very low	31.5	Very low	113 Å²	113	157.8 Å²	157.8	79%	0.79	83%	0.834	S	S	*	*			trans	8.2	111.1	160.4	57.5	0	0	0	0	120.2
574	K	26.5	Very low	29.5	Very low	214 Å²	214	160.5 Å²	160.5	93%	0.93	84%	0.838	S	S	*	*			trans	-140.3	110.8	142.5	-73.1	-165.4	177.9	176.5	0	111.7
575	Q	29.3	Very low	28.3	Very low	197 Å²	197	165.2 Å²	165.2	92%	0.921	85%	0.848	S	S	*	*			trans	-89.8	123.1	170.9	-76.2	-166.3	-0.2	0	0	112
576	K	25.4	Very low	27.7	Very low	196 Å²	196	163.3 Å²	163.3	85%	0.852	85%	0.847	S	S	*	*			trans	10.2	149.2	151.7	-76.7	178.5	171.3	172.6	0	121.7
577	K	24.1	Very low	26.8	Very low	196 Å²	196	160.9 Å²	160.9	85%	0.852	85%	0.846	S	S	*	*			trans	92.2	144.3	166.1	-57.5	167.5	-175.5	170.4	0	113.2
578	K	22.6	Very low	26.5	Very low	197 Å²	197	163.8 Å²	163.8	86%	0.857	85%	0.851	S	S	*	*			cis	-156.4	135.2	1.7	-140.2	-176.8	-179.1	-173.5	0	109.8
579	A	24.6	Very low	25.9	Very low	101 Å²	101	166.5 Å²	166.5	84%	0.835	85%	0.848	S	S	*	*			trans	-164	120.5	154	0	0	0	0	0	111.8
580	K	23.9	Very low	25.4	Very low	215 Å²	215	163.6 Å²	163.6	94%	0.935	84%	0.836	S	S	*	*			trans	-135.5	120.2	155.1	-109.9	-166.3	178.7	-173.5	0	105.3
581	S	25.3	Very low	25	Very low	119 Å²	119	163.9 Å²	163.9	83%	0.832	83%	0.833	S	S	*	*			trans	-147.6	150.8	163.6	49	0	0	0	0	107.7
582	Q	24.9	Very low	24.7	Very low	175 Å²	175	163.1 Å²	163.1	82%	0.818	83%	0.828	S	S	*	*			trans	-120.3	164.6	-173.1	-67.5	178.5	-71.9	0	0	110.6
583	Q	23	Very low	24.5	Very low	166 Å²	166	164.1 Å²	164.1	78%	0.776	82%	0.823	S	S	*	*			trans	62	124.6	155.7	-69.7	168	4.4	0	0	118.3
584	Y	21.6	Very low	24.2	Very low	226 Å²	226	166.3 Å²	166.3	89%	0.886	82%	0.821	S	S	*	*				-145.8	163.7	98.4	-141.9	-107.1	0	0	0	112.2
585	K	22.1	Very low	24.1	Very low	186 Å²	186	163.2 Å²	163.2	81%	0.809	81%	0.814	S	S	*	*			trans	-97.1	147.2	176.7	-71.9	-178	176.7	179.9	0	110.8
586	G	24.1	Very low	23.8	Very low	81 Å²	81	163.4 Å²	163.4	84%	0.835	81%	0.811	S	S	*	*			trans	-141.5	99.7	167.6	0	0	0	0	0	111.4
587	H	23.8	Very low	23.7	Very low	178 Å²	178	161.6 Å²	161.6	82%	0.824	81%	0.806	S	S	*	*			trans	-94.2	139.1	173.1	-103.3	-50.8	0	0	0	110.7
588	K	27.5	Very low	23.7	Very low	211 Å²	211	160.5 Å²	160.5	92%	0.917	80%	0.804	S	S	*	*			trans	-132.1	131.9	146.8	-80.9	-167	173	-177	0	111
589	K	23.8	Very low	23.8	Very low	177 Å²	177	157.6 Å²	157.6	77%	0.77	80%	0.797	S	S	*	*			trans	-90.7	175	169.3	-75.3	179.5	161.4	-170.8	0	108.9
590	M	23.5	Very low	23.8	Very low	143 Å²	143	159.6 Å²	159.6	70%	0.704	79%	0.793	S	S	*	*			cis	-170.9	173.4	-19	-96.5	165.8	67.8	0	0	105.8
591	T	22.8	Very low	24	Very low	112 Å²	112	156.6 Å²	156.6	69%	0.687	79%	0.787	S	S	*	*			cis	-127.4	-118.7	10.7	-34	0	0	0	0	110.8
592	S	22.5	Very low	24	Very low	103 Å²	103	153.9 Å²	153.9	72%	0.72	78%	0.778	S	S	*	*			cis	-156.1	112.9	-2.5	49.6	0	0	0	0	113.6
593	L	23.3	Very low	24.2	Very low	140 Å²	140	154.6 Å²	154.6	73%	0.733	78%	0.781	S	S	*	*			trans	47.5	102.9	132.4	-61.6	169.2	0	0	0	122.3
594	Q	23.1	Very low	24.3	Very low	160 Å²	160	155.4 Å²	155.4	75%	0.748	79%	0.785	S	S	*	*				54.4	137.1	113.8	-75.8	-179.8	-48.2	0	0	124.7
595	L	24.2	Very low	24.7	Very low	148 Å²	148	155.7 Å²	155.7	78%	0.775	79%	0.786	S	S	*	*			trans	70.4	118	141.1	-72.5	164.6	0	0	0	121.7
596	K	23.5	Very low	25	Very low	201 Å²	201	151.8 Å²	151.8	87%	0.874	78%	0.782	S	S	*	*				-163	175.5	109.2	-125.8	-164	172.2	-157.7	0	114.2
597	E	23	Very low	25.2	Very low	158 Å²	158	156.5 Å²	156.5	74%	0.738	78%	0.78	S	S	*	*			trans	-107.2	175.2	-174.6	-65.4	158	105.1	0	0	113.5
598	E	24.4	Very low	25.5	Very low	173 Å²	173	153.9 Å²	153.9	81%	0.808	77%	0.772	S	S	*	*			trans	71.2	151.4	159	-72.5	-176.8	153.8	0	0	118.1
599	L	24.4	Very low	25.6	Very low	137 Å²	137	152.6 Å²	152.6	72%	0.717	77%	0.769	S	S	*	*			cis	-150.3	-171.1	5.8	-125.9	163.3	0	0	0	111.8
600	L	26.2	Very low	25.8	Very low	143 Å²	143	147.3 Å²	147.3	75%	0.749	76%	0.764	S	S	*	*			trans	-68.6	-178.8	-174.1	-66.2	162.5	0	0	0	114.5
601	D	26.5	Very low	26.1	Very low	152 Å²	152	145 Å²	145	81%	0.813	77%	0.768	S	S	*	*			cis	-166.7	172.7	28.6	-147.5	-11.9	0	0	0	115.7
602	G	26.3	Very low	26.5	Very low	62 Å²	62	144.4 Å²	144.4	64%	0.639	77%	0.769	S	S	*	*			trans	85.3	146.6	164.7	0	0	0	0	0	117.8
603	E	28	Very low	27.1	Very low	189 Å²	189	146 Å²	146	88%	0.883	77%	0.769	S	S	*	*			cis	-143.9	122.7	-8.2	-68.7	179	141.6	0	0	107.1
604	E	26	Very low	27.4	Very low	184 Å²	184	147.8 Å²	147.8	86%	0.86	77%	0.773	S	S	*	*				101.4	129.9	96.1	-169	173	-118.7	0	0	114.3
605	Y	29.2	Very low	27.9	Very low	232 Å²	232	148.7 Å²	148.7	91%	0.91	78%	0.778	S	S	*	*			trans	-154.2	131.5	-179	-112.7	-83.7	0	0	0	111.9
606	S	28.5	Very low	28.3	Very low	103 Å²	103	147.4 Å²	147.4	72%	0.72	78%	0.781	S	S	*	*			trans	-177.9	169.9	-175.1	-94.3	0	0	0	0	111.4
607	F	28.3	Very low	28.6	Very low	181 Å²	181	146 Å²	146	79%	0.794	78%	0.783	S	S	*	*			cis	-176.4	153.7	-26.2	-117.7	-154.8	0	0	0	106.6
608	L	31.1	Very low	28.9	Very low	123 Å²	123	142.4 Å²	142.4	64%	0.644	79%	0.788	S	S	*	*			cis	-113.4	-112.5	-14.8	-79.3	165.6	0	0	0	108.3
609	Q	29	Very low	29.3	Very low	184 Å²	184	140 Å²	140	86%	0.86	79%	0.791	S	S	*	*			cis	-167.2	160.7	-19.2	-141	154.6	-7.8	0	0	106.9
610	G	28.3	Very low	29.6	Very low	65 Å²	65	138 Å²	138	67%	0.67	79%	0.794	S	S	*	*			cis	164.6	160	-8.2	0	0	0	0	0	111
611	A	30.1	Very low	29.8	Very low	96 Å²	96	136.7 Å²	136.7	79%	0.793	80%	0.797	S	S	*	*			trans	67.4	138.6	-174.3	0	0	0	0	0	115.1
612	S	31	Very low	30.1	Very low	99 Å²	99	139.7 Å²	139.7	69%	0.692	80%	0.798	S	S	*	*			cis	81.3	143.7	45.6	105.8	0	0	0	0	113.1
613	D	34.1	Very low	30.3	Very low	135 Å²	135	148 Å²	148	72%	0.722	81%	0.812	S	S	*	*			cis	-158.5	175.6	19.3	-115.9	-47.7	0	0	0	114.6
614	Q	31.3	Very low	30.7	Very low	178 Å²	178	145 Å²	145	83%	0.832	80%	0.801	S	S	*	*			trans	81.4	163.4	147.9	-84.3	175.6	11	0	0	125
615	E	32	Very low	31	Very low	180 Å²	180	146.3 Å²	146.3	84%	0.841	80%	0.803	S	S	*	*			trans	-110.5	171.1	-160.9	-48.1	162.6	107	0	0	113.5
616	S	33.1	Very low	31.5	Very low	121 Å²	121	142.1 Å²	142.1	85%	0.846	79%	0.792	S	S	*	*			trans	-173.6	158.8	131.9	31.1	0	0	0	0	113.7
617	N	30.6	Very low	31.9	Very low	171 Å²	171	144.6 Å²	144.6	91%	0.914	79%	0.793	S	S	*	*			trans	-89.3	160.6	-175.7	-68.2	-70.2	0	0	0	113.5
618	G	28.6	Very low	33.4	Very low	82 Å²	82	145.3 Å²	145.3	85%	0.845	82%	0.815	S	S	*	*			trans	-163.7	110.8	166.1	0	0	0	0	0	113.4
619	S	32.7	Very low	33.5	Very low	123 Å²	123	146.4 Å²	146.4	86%	0.86	82%	0.824	S	S	*	*			trans	-129.8	126.8	-174.6	53.2	0	0	0	0	113.7
620	A	30.7	Very low	33.8	Very low	95 Å²	95	144.4 Å²	144.4	79%	0.785	82%	0.822	S	S	*	*			trans	-159.8	132.1	160.2	0	0	0	0	0	107.6
621	S	30.5	Very low	34.1	Very low	115 Å²	115	148.8 Å²	148.8	80%	0.804	83%	0.83	S	S	*	*			cis	92.4	119.9	39	-65.5	0	0	0	0	113.5
622	Y	32.6	Very low	34.3	Very low	215 Å²	215	151.9 Å²	151.9	84%	0.843	83%	0.832	S	S	*	*			trans	-35.4	151.4	177.1	-58.5	-100.4	0	0	0	117
623	Y	31	Very low	34.5	Very low	236 Å²	236	155.3 Å²	155.3	93%	0.925	84%	0.841	S	S	*	*				-146.9	142.2	129.7	-116.8	-76.4	0	0	0	113.1
624	I	36.4	Very low	34.6	Very low	128 Å²	128	156.6 Å²	156.6	66%	0.656	85%	0.849	S	S	*	*			trans	-92.9	148.2	172.2	-63.5	167.2	0	0	0	108.6
625	K	32.7	Very low	34.8	Very low	210 Å²	210	155.1 Å²	155.1	91%	0.913	85%	0.85	S	S	*	*			trans	-142.1	124.1	153.3	-105.2	-174.1	177.4	-175.4	0	111.8
626	Q	38.3	Very low	35	Very low	145 Å²	145	153.2 Å²	153.2	68%	0.678	85%	0.851	S	S	*	*			trans	-96.8	162.1	163.5	-73.2	168.1	-109.7	0	0	109.6
627	E	36.5	Very low	35.2	Very low	155 Å²	155	155.8 Å²	155.8	72%	0.724	85%	0.851	S	S	*	*			trans	66.8	163.5	144.2	-83.8	157.4	-123.2	0	0	118.8
628	P	61.4	Low	35.6	Very low	195 Å²	195	154.5 Å²	154.5	100%	1.266	85%	0.846	S	S	*	*			cis	-81.2	0	1.3	36.4	-36.5	0	0	0	115.2

Retrieved 628 of 628 residues in 305.4 ms (Link to these results)

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