A0A087XB97_POEFO Loading...

RCC1 like

AlphaFold DB , UniProt , Accession A0A087XB97, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 448 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	34.9	Very low	34	Very low	243 Å²	243	150.7 Å²	150.7	100%	1.197	82%	0.818	S	S	*	*				0	90.4	0	-73.3	176.5	-175.6	0	0	106.6
2	A	30.9	Very low	33.5	Very low	101 Å²	101	152.3 Å²	152.3	84%	0.835	82%	0.816	S	S	*	*				72.8	101.4	90.6	0	0	0	0	0	112.9
3	L	36.2	Very low	33.2	Very low	160 Å²	160	152.8 Å²	152.8	84%	0.838	82%	0.817	S	S	*	*			trans	-60	158.2	149.6	-82.7	150.7	0	0	0	109.5
4	P	46.4	Very low	32.8	Very low	114 Å²	114	148.2 Å²	148.2	74%	0.74	81%	0.811	S	S	*	*				-148.8	143.4	91	25.6	-1.9	0	0	0	114.3
5	C	30.1	Very low	32.3	Very low	105 Å²	105	148.6 Å²	148.6	71%	0.709	81%	0.811	S	S	*	*				79.3	154	85.2	-62.4	0	0	0	0	117
6	L	30.1	Very low	31.9	Very low	160 Å²	160	155.1 Å²	155.1	84%	0.838	82%	0.82	S	S	*	*			trans	102.3	132.4	151.9	-61.5	169.3	0	0	0	116
7	C	30.9	Very low	31.6	Very low	106 Å²	106	153.4 Å²	153.4	72%	0.716	82%	0.816	S	S	*	*			cis	-178.4	-167.5	-6.1	-134.1	0	0	0	0	108.8
8	P	46.9	Very low	31.2	Very low	101 Å²	101	152.3 Å²	152.3	66%	0.656	82%	0.821	S	S	*	*				-132.8	-161.9	-128.5	38.5	-13.3	0	0	0	114.3
9	R	28.3	Very low	30.9	Very low	240 Å²	240	148 Å²	148	91%	0.906	82%	0.816	S	S	*	*			trans	-177.5	114.5	148.2	-99	164.5	-171.1	-148.5	2.6	108.3
10	H	30.3	Very low	30.8	Very low	172 Å²	172	152.2 Å²	152.2	80%	0.796	82%	0.821	S	S	*	*				49.6	137.6	76.1	-84.9	-39.4	0	0	0	114.2
11	M	28.9	Very low	30.7	Very low	156 Å²	156	149.8 Å²	149.8	77%	0.768	82%	0.822	S	S	*	*			cis	-168	170.7	10.5	-146.7	167.9	108.4	0	0	109.9
12	Q	28.4	Very low	30.4	Very low	170 Å²	170	144.3 Å²	144.3	79%	0.794	80%	0.803	S	S	*	*			trans	-71.7	162.8	-178.9	-66.4	163.7	-49.3	0	0	116.9
13	L	29	Very low	30.5	Very low	158 Å²	158	147.8 Å²	147.8	83%	0.827	81%	0.806	S	S	*	*			trans	151.7	146.6	135.3	-102.3	95.9	0	0	0	108.8
14	A	28	Very low	30.3	Very low	89 Å²	89	145.8 Å²	145.8	74%	0.736	81%	0.806	S	S	*	*			cis	-161.2	166.7	27.2	0	0	0	0	0	112.4
15	L	25.7	Very low	29.6	Very low	154 Å²	154	144.1 Å²	144.1	81%	0.806	81%	0.809	S	S	*	*			trans	-66.7	155.6	173	-76.3	102.5	0	0	0	115.1	V17	L15-V17 HydrophobicContact CD2-CG2 4.35Å
16	R	25.1	Very low	29.7	Very low	253 Å²	253	144 Å²	144	96%	0.955	82%	0.816	S	S	*	*			trans	-143.4	131.8	138.6	-91.8	-170	177.6	-170.7	-0.8	111.1
17	V	26.8	Very low	29.7	Very low	125 Å²	125	141.7 Å²	141.7	76%	0.758	81%	0.813	S	S	*	*			trans	-121.7	131.7	173.2	173	0	0	0	0	108.8	L15	L15-V17 HydrophobicContact CD2-CG2 4.35Å
18	C	24.6	Very low	29.7	Very low	134 Å²	134	147.9 Å²	147.9	91%	0.905	82%	0.821	S	S	*	*			trans	168.6	138.9	146.4	-103.9	0	0	0	0	107.1
19	G	26.5	Very low	29	Very low	71 Å²	71	149.2 Å²	149.2	73%	0.732	83%	0.83	S	S	*	*			cis	-160.4	170.4	26.2	0	0	0	0	0	113
20	Y	28	Very low	29.3	Very low	231 Å²	231	146.8 Å²	146.8	91%	0.906	83%	0.829	S	S	*	*			trans	-78	141	178.1	-79.3	-99	0	0	0	111.8
21	A	28.9	Very low	29.5	Very low	103 Å²	103	147.1 Å²	147.1	85%	0.851	83%	0.831	S	S	*	*			trans	-149.8	104.2	149.7	0	0	0	0	0	109.6
22	T	29.4	Very low	30	Very low	128 Å²	128	149.9 Å²	149.9	79%	0.785	84%	0.838	S	S	*	*			trans	-79.3	125.5	163.3	42.4	0	0	0	0	109.4
23	L	32.3	Very low	30.7	Very low	173 Å²	173	147 Å²	147	91%	0.906	84%	0.837	S	S	*	*			trans	-134.2	119	155.8	-90.4	166.7	0	0	0	109.6
24	S	32.8	Very low	31.4	Very low	119 Å²	119	142.6 Å²	142.6	83%	0.832	83%	0.83	S	S	*	*			trans	-65.7	137.4	173.7	50	0	0	0	0	112.5
25	G	29.7	Very low	31.9	Very low	79 Å²	79	146.7 Å²	146.7	81%	0.814	83%	0.834	S	S	*	*			trans	-161.7	100.8	163.3	0	0	0	0	0	109.7
26	A	33.8	Very low	32.8	Very low	102 Å²	102	144.1 Å²	144.1	84%	0.843	83%	0.826	S	S	*	*			trans	-83.2	129.1	176.1	0	0	0	0	0	110.4
27	S	29.5	Very low	33.8	Very low	111 Å²	111	138.5 Å²	138.5	78%	0.776	82%	0.82	S	S	*	*			trans	-173.8	123.3	141.7	56.8	0	0	0	0	114.4
28	R	31.3	Very low	34.8	Very low	236 Å²	236	140 Å²	140	89%	0.891	82%	0.817	S	S	*	*			trans	82.8	126.5	153.3	-65.8	-179.6	-180	-175.8	-0.2	119.8	Q30	R28-Q30 PolarHBondContact O-N 3.5Å
29	P	32.3	Very low	35.6	Very low	129 Å²	129	141.8 Å²	141.8	84%	0.838	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-77.4	119.6	167.1	31.8	-29	0	0	0	109.3
30	Q	34.4	Very low	36.8	Very low	189 Å²	189	147 Å²	147	88%	0.883	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-80	121.2	162.2	-92.3	-177.7	-25	0	0	108.5	R28 K32	R28-Q30 PolarHBondContact O-N 3.5Å; Q30-K32 PolarHBondContact O-N 3.04Å
31	E	34.9	Very low	37.5	Very low	180 Å²	180	143.3 Å²	143.3	84%	0.841	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-52.9	116.4	168.3	-72.5	174.7	145.4	0	0	110	S33	E31-S33 PolarHBondContact O-N 3.19Å
32	K	37.8	Very low	38.7	Very low	213 Å²	213	139.4 Å²	139.4	93%	0.926	78%	0.782	S	S	*	*			trans	-76.3	78.2	161	-80.8	-174.6	175.2	179.8	0	108.5	Q30 G34	Q30-K32 PolarHBondContact O-N 3.04Å; K32-G34 VanDerWaalsContact C-N 3.29Å; K32-G34 PolarHBondContact O-N 3.31Å
33	S	44.5	Very low	39.6	Very low	109 Å²	109	141.8 Å²	141.8	76%	0.762	78%	0.781	S	S	*	*			trans	-87.5	75.5	159.5	64.7	0	0	0	0	108.5	E31	E31-S33 PolarHBondContact O-N 3.19Å
34	G	42.2	Very low	40.6	Very low	66 Å²	66	142.3 Å²	142.3	68%	0.68	78%	0.778	S	S	*	*			trans	-116.1	67.6	174.2	0	0	0	0	0	109.6	K32	K32-G34 VanDerWaalsContact C-N 3.29Å; K32-G34 PolarHBondContact O-N 3.31Å
35	E	39.3	Very low	41.8	Very low	176 Å²	176	145.6 Å²	145.6	82%	0.822	77%	0.773	S	S	*	*			trans	-56.4	137.1	162	-70.3	-172.5	162.3	0	0	108.1	V37	E35-V37 PolarHBondContact O-N 2.89Å
36	P	43.8	Very low	43.7	Very low	99 Å²	99	150.3 Å²	150.3	64%	0.643	77%	0.771	S	S	*	*			trans	-62	108.1	177.9	23.9	-30.6	0	0	0	108.6	F38	P36-F38 VanDerWaalsContact C-N 3.29Å; P36-F38 HydrophobicContact CB-CD2 4.5Å; P36-F38 HydrophobicContact CB-CE2 4.2Å; P36-F38 HydrophobicContact CG-CD2 4.5Å; P36-F38 HydrophobicContact CG-CE2 3.95Å; P36-F38 WeakPolarHBondContact O-CD2 3.38Å; P36-F38 PolarHBondContact O-N 2.87Å
37	V	47.5	Very low	45.7	Very low	136 Å²	136	149 Å²	149	82%	0.824	75%	0.754	S	S	*	*			trans	-66.1	95.9	169	179.1	0	0	0	0	106.5	E35 Q39	E35-V37 PolarHBondContact O-N 2.89Å; V37-Q39 VanDerWaalsContact C-N 3.29Å; V37-Q39 PolarHBondContact O-N 2.88Å
38	F	47.6	Very low	48.3	Very low	157 Å²	157	146.8 Å²	146.8	69%	0.689	74%	0.735	S	S	*	*			trans	-65.5	95.4	167.2	-76.8	-85.3	0	0	0	107.5	P36 Y40	P36-F38 VanDerWaalsContact C-N 3.29Å; P36-F38 HydrophobicContact CB-CD2 4.5Å; P36-F38 HydrophobicContact CB-CE2 4.2Å; P36-F38 HydrophobicContact CG-CD2 4.5Å; P36-F38 HydrophobicContact CG-CE2 3.95Å; P36-F38 WeakPolarHBondContact O-CD2 3.38Å; P36-F38 PolarHBondContact O-N 2.87Å; F38-Y40 VanDerWaalsContact C-N 3.28Å; F38-Y40 HydrophobicContact CB-CE2 4.23Å; F38-Y40 VanDerWaalsContact O-CD2 3.29Å; F38-Y40 WeakPolarHBondContact O-CD2 3.29Å; F38-Y40 PolarHBondContact O-N 2.9Å
39	Q	41.3	Very low	51.2	Low	171 Å²	171	138.9 Å²	138.9	80%	0.799	71%	0.708	S	S	*	*			trans	-68.6	92.4	168.7	-170.3	175.4	8.6	0	0	107.5	V37 V41	V37-Q39 VanDerWaalsContact C-N 3.29Å; V37-Q39 PolarHBondContact O-N 2.88Å; Q39-V41 PolarHBondContact O-N 3.02Å
40	Y	50.7	Low	54.2	Low	180 Å²	180	135 Å²	135	71%	0.706	68%	0.679	S	S	*	*			trans	-57.6	112.1	173.4	-74.3	-89.5	0	0	0	109.1	F38 G42 K43	F38-Y40 VanDerWaalsContact C-N 3.28Å; F38-Y40 HydrophobicContact CB-CE2 4.23Å; F38-Y40 VanDerWaalsContact O-CD2 3.29Å; F38-Y40 WeakPolarHBondContact O-CD2 3.29Å; F38-Y40 PolarHBondContact O-N 2.9Å; Y40-G42 VanDerWaalsContact C-N 3.27Å; Y40-G42 PolarHBondContact O-N 3.48Å; Y40-K43 PolarHBondContact O-N 2.81Å
41	V	44.5	Very low	57.2	Low	153 Å²	153	126.2 Å²	126.2	93%	0.927	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	87.2	175.7	-173	0	0	0	0	107.9	Q39	Q39-V41 PolarHBondContact O-N 3.02Å
42	G	53.3	Low	60.2	Low	22 Å²	22	118 Å²	118	23%	0.227	60%	0.599	C	S	.	*	T	Hydrogen-bonded Turn	trans	165.1	-18.8	-175.3	0	0	0	0	0	116.2	Y40 H44 R45	Y40-G42 VanDerWaalsContact C-N 3.27Å; Y40-G42 PolarHBondContact O-N 3.48Å; G42-H44 PolarHBondContact O-N 3.3Å; G42-R45 PolarHBondContact O-N 3.22Å
43	K	48.6	Very low	63.1	Low	178 Å²	178	107.8 Å²	107.8	77%	0.774	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-14.7	-176	-90.9	-174.8	174.4	-179.9	0	116.2	Y40	Y40-K43 PolarHBondContact O-N 2.81Å
44	H	51.8	Low	65.7	Low	183 Å²	183	102.6 Å²	102.6	85%	0.847	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.1	6.3	179.8	-61.4	-56.9	0	0	0	114.3	G42 K46	G42-H44 PolarHBondContact O-N 3.3Å; H44-K46 PolarHBondContact O-N 2.98Å
45	R	59.8	Low	68.4	Low	188 Å²	188	99.5 Å²	99.5	71%	0.709	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-79.6	126.6	177.6	-161.7	172.8	-172.9	171.1	1.8	108.2	G42 L448	G42-R45 PolarHBondContact O-N 3.22Å; R45-L448 WeakPolarHBondContact CB-OXT 3.3Å
46	K	68.3	Low	71.2	Confident	179 Å²	179	92.3 Å²	92.3	78%	0.778	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-67.2	132.9	175.8	-71.1	-175.6	179.6	179.6	0	108.2	H44 T48	H44-K46 PolarHBondContact O-N 2.98Å; K46-T48 PolarHBondContact O-N 3.35Å
47	P	75.5	Confident	73.7	Confident	74 Å²	74	87.7 Å²	87.7	48%	0.481	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-53.8	128.7	176.8	-26.6	33.6	0	0	0	111	S446	P47-S446 WeakPolarHBondContact CA-OG 3.26Å
48	T	85.6	Confident	76	Confident	64 Å²	64	84.8 Å²	84.8	39%	0.393	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-88.8	145.8	175.7	61.5	0	0	0	0	110.2	K46 S446	K46-T48 PolarHBondContact O-N 3.35Å; T48-S446 PolarHBondContact N-OG 3.29Å; T48-S446 PolarHBondContact O-N 3.1Å
49	H	90.9	Very high	78.3	Confident	70 Å²	70	78.3 Å²	78.3	32%	0.324	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	137.1	174.4	-67.3	73.3	0	0	0	109.1	Q92 V444 K445	H49-Q92 HydrophobicContact CB-CG 3.84Å; H49-Q92 PolarHBondContact CE1-NE2 3.44Å; H49-Q92 PolarHBondContact ND1-NE2 2.83Å; H49-Q92 PolarHBondContact NE2-NE2 2.91Å; H49-V444 CarbonylContact C-O 3.54Å; H49-V444 WeakPolarHBondContact CA-O 3.25Å; H49-K445 VanDerWaalsContact NE2-CE 3.25Å; H49-K445 WeakPolarHBondContact NE2-CE 3.42Å
50	K	95.6	Very high	80.9	Confident	49 Å²	49	70.3 Å²	70.3	21%	0.213	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	149.9	-178.1	-62.5	-178.3	-177	177.3	0	109	F52 V444	K50-F52 HydrophobicContact CB-CD2 4.39Å; K50-F52 HydrophobicContact CB-CE2 3.72Å; K50-F52 HydrophobicContact CB-CZ 4.48Å; K50-F52 HydrophobicContact CD-CE2 4.26Å; K50-F52 HydrophobicContact CD-CZ 4.37Å; K50-V444 HydrophobicContact CB-CB 4.49Å; K50-V444 PolarHBondContact N-O 2.93Å; K50-V444 PolarHBondContact O-N 3.46Å
51	V	98.1	Very high	83.2	Confident	3 Å²	3	61.8 Å²	61.8	2%	0.018	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	133	174.3	-176.3	0	0	0	0	108.6	V53 L87 T89 I93 M105 V441 A442 L443	V51-V53 HydrophobicContact CG1-CG1 4.27Å; V51-L87 HydrophobicContact CB-CB 4.32Å; V51-L87 HydrophobicContact CG1-CB 4.29Å; V51-L87 HydrophobicContact CG1-CD2 4.29Å; V51-L87 PolarHBondContact O-N 3.04Å; V51-T89 HydrophobicContact CB-CG2 4.19Å; V51-T89 HydrophobicContact CG2-CG2 3.87Å; V51-I93 HydrophobicContact CG2-CB 3.93Å; V51-I93 HydrophobicContact CG2-CG1 3.79Å; V51-M105 HydrophobicContact CG1-SD 3.98Å; V51-V441 HydrophobicContact CG1-CG1 3.57Å; V51-A442 WeakPolarHBondContact CA-O 3.43Å; V51-L443 HydrophobicContact CG2-CD2 4.06Å
52	F	98.6	Very high	85.8	Confident	7 Å²	7	54.5 Å²	54.5	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	140.5	172.7	-70.8	-94.6	0	0	0	110.2	K50 W54 P84 Y85 R86 V426 P427 V441 A442 V444	K50-F52 HydrophobicContact CB-CD2 4.39Å; K50-F52 HydrophobicContact CB-CE2 3.72Å; K50-F52 HydrophobicContact CB-CZ 4.48Å; K50-F52 HydrophobicContact CD-CE2 4.26Å; K50-F52 HydrophobicContact CD-CZ 4.37Å; F52-W54 HydrophobicContact CB-CE3 4.45Å; F52-W54 HydrophobicContact CB-CZ3 4.14Å; F52-P84 HydrophobicContact CB-CB 4.15Å; F52-P84 HydrophobicContact CD1-CB 4.02Å; F52-P84 HydrophobicContact CG-CB 4.4Å; F52-Y85 CarbonylContact C-O 3.52Å; F52-Y85 VanDerWaalsContact CA-O 3.27Å; F52-Y85 WeakPolarHBondContact CA-O 3.41Å; F52-R86 HydrophobicContact CD1-CB 4.2Å; F52-R86 HydrophobicContact CE1-CB 3.73Å; F52-R86 HydrophobicContact CE1-CG 4.39Å; F52-R86 HydrophobicContact CZ-CB 4.17Å; F52-R86 HydrophobicContact CZ-CG 4.36Å; F52-V426 HydrophobicContact CB-CG1 4.42Å; F52-V426 HydrophobicContact CD1-CG1 4.36Å; F52-V426 HydrophobicContact CD2-CG1 3.84Å; F52-V426 HydrophobicContact CE2-CG1 4.2Å; F52-V426 HydrophobicContact CG-CG1 3.94Å; F52-P427 HydrophobicContact CD1-CG 4.48Å; F52-P427 HydrophobicContact CE1-CG 3.45Å; F52-P427 VanDerWaalsContact CE1-CG 3.45Å; F52-P427 HydrophobicContact CE2-CG 4.41Å; F52-P427 HydrophobicContact CZ-CG 3.43Å; F52-P427 VanDerWaalsContact CZ-CG 3.43Å; F52-V441 CarbonylContact O-C 3.18Å; F52-V441 VanDerWaalsContact O-CA 3.3Å; F52-V441 WeakPolarHBondContact O-CA 3.41Å; F52-A442 HydrophobicContact CB-CB 4.42Å; F52-A442 PolarHBondContact N-O 2.74Å; F52-A442 PolarHBondContact O-N 3.21Å; F52-V444 HydrophobicContact CD2-CB 3.87Å; F52-V444 HydrophobicContact CD2-CG1 4.35Å; F52-V444 HydrophobicContact CD2-CG2 3.5Å; F52-V444 VanDerWaalsContact CD2-CG2 3.5Å; F52-V444 HydrophobicContact CE2-CB 3.95Å; F52-V444 HydrophobicContact CE2-CG1 4.06Å; F52-V444 HydrophobicContact CE2-CG2 4.05Å; F52-V444 HydrophobicContact CG-CG2 4.47Å
53	V	98.8	Very high	87.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	144.2	-176.3	-59.8	0	0	0	0	110	V51 L62 I64 Y85 L87 M440 V441	V51-V53 HydrophobicContact CG1-CG1 4.27Å; V53-L62 HydrophobicContact CB-CB 4.17Å; V53-L62 HydrophobicContact CB-CD2 4.13Å; V53-L62 HydrophobicContact CG2-CB 3.87Å; V53-L62 WeakPolarHBondContact CG2-O 3.33Å; V53-I64 HydrophobicContact CG2-CD1 3.61Å; V53-Y85 PolarHBondContact N-O 2.88Å; V53-Y85 PolarHBondContact O-N 2.82Å; V53-L87 HydrophobicContact CG1-CB 3.99Å; V53-L87 HydrophobicContact CG1-CD2 3.99Å; V53-L87 HydrophobicContact CG2-CB 4.21Å; V53-M440 WeakPolarHBondContact CA-O 3.5Å; V53-V441 HydrophobicContact CG1-CG1 4.35Å; V53-V441 HydrophobicContact CG1-CG2 3.95Å
54	W	98.8	Very high	90.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	170.4	174.8	64.2	85.2	0	0	0	112	F52 L62 Q81 T83 P84 L399 C409 G411 H439 M440 A442	F52-W54 HydrophobicContact CB-CE3 4.45Å; F52-W54 HydrophobicContact CB-CZ3 4.14Å; W54-L62 WeakPolarHBondContact O-CD2 3.2Å; W54-Q81 HydrophobicContact CB-CG 4.18Å; W54-Q81 WeakPolarHBondContact CB-O 3.31Å; W54-T83 WeakPolarHBondContact CB-O 3.33Å; W54-P84 HydrophobicContact CD2-CG 4.27Å; W54-P84 HydrophobicContact CE3-CB 3.76Å; W54-P84 HydrophobicContact CE3-CG 3.83Å; W54-P84 HydrophobicContact CZ3-CB 4.03Å; W54-P84 HydrophobicContact CZ3-CG 4.01Å; W54-L399 HydrophobicContact CH2-CD2 3.58Å; W54-L399 HydrophobicContact CZ2-CD2 3.88Å; W54-C409 PolarHBondContact NE1-O 2.8Å; W54-G411 VanDerWaalsContact CD1-N 3.29Å; W54-H439 VanDerWaalsContact O-CA 3.28Å; W54-H439 WeakPolarHBondContact O-CA 3.36Å; W54-H439 VanDerWaalsContact O-CB 3.32Å; W54-H439 WeakPolarHBondContact O-CB 3.3Å; W54-M440 HydrophobicContact CD2-CB 4.2Å; W54-M440 HydrophobicContact CH2-CB 4.36Å; W54-M440 HydrophobicContact CZ2-CB 3.64Å; W54-M440 HydrophobicContact CZ2-CE 3.75Å; W54-M440 HydrophobicContact CZ2-CG 4.28Å; W54-M440 HydrophobicContact CZ2-SD 3.72Å; W54-M440 PolarHBondContact N-O 2.87Å; W54-M440 VanDerWaalsContact N-O 3.14Å; W54-M440 PolarHBondContact O-N 2.86Å; W54-A442 HydrophobicContact CH2-CB 3.76Å; W54-A442 HydrophobicContact CZ3-CB 3.71Å
55	G	98.4	Very high	92.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	103.5	-143.1	-176.2	0	0	0	0	0	113.1	Q81 R407 D438	G55-Q81 PolarHBondContact N-O 2.89Å; G55-Q81 PolarHBondContact O-N 3.32Å; G55-R407 CarbonylContact C-O 3.48Å; G55-D438 CarbonylContact C-O 3.58Å; G55-D438 WeakPolarHBondContact CA-O 3.45Å
56	F	97.9	Very high	93.7	Very high	26 Å²	26	32.5 Å²	32.5	11%	0.114	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	127.4	-178.5	-172	-127.6	0	0	0	112.2	F58 T59 R79 Y80 R407 D438	F56-F58 HydrophobicContact CD2-CB 4.49Å; F56-F58 HydrophobicContact CE1-CB 4.18Å; F56-F58 HydrophobicContact CE2-CB 3.65Å; F56-F58 HydrophobicContact CZ-CB 3.46Å; F56-F58 VanDerWaalsContact CZ-CB 3.46Å; F56-T59 HydrophobicContact CD1-CG2 4.18Å; F56-T59 HydrophobicContact CE1-CG2 3.7Å; F56-R79 VanDerWaalsContact CD2-O 3.24Å; F56-R79 WeakPolarHBondContact CD2-O 3.37Å; F56-Y80 AromaticContact CD2-CD1 3.95Å; F56-Y80 HydrophobicContact CD2-CD1 3.95Å; F56-Y80 AromaticContact CD2-CE1 3.78Å; F56-Y80 HydrophobicContact CD2-CE1 3.78Å; F56-Y80 HydrophobicContact CE2-CE1 4.13Å; F56-R407 HydrophobicContact CB-CB 3.97Å; F56-R407 HydrophobicContact CD2-CB 4.4Å; F56-R407 HydrophobicContact CG-CB 4.47Å; F56-D438 HydrophobicContact CB-CB 4.13Å; F56-D438 WeakPolarHBondContact CB-OD2 3.46Å; F56-D438 VanDerWaalsContact CD1-OD2 3.27Å; F56-D438 WeakPolarHBondContact CD1-OD2 3.39Å; F56-D438 PolarHBondContact N-O 3.26Å
57	S	96.2	Very high	94.9	Very high	2 Å²	2	24 Å²	24	1%	0.014	13%	0.133	C	C	.	.			trans	-110	-17.3	-173	54.9	0	0	0	0	114.6	T59 G60 V68 R78 R79	S57-T59 VanDerWaalsContact C-N 3.26Å; S57-T59 PolarHBondContact O-N 2.82Å; S57-G60 WeakPolarHBondContact O-CA 3.42Å; S57-G60 PolarHBondContact O-N 3.44Å; S57-V68 WeakPolarHBondContact O-CG2 3.3Å; S57-R78 PolarHBondContact OG-O 2.97Å; S57-R79 PolarHBondContact N-O 2.73Å; S57-R79 PolarHBondContact OG-O 2.93Å
58	F	94.8	Very high	95.6	Very high	75 Å²	75	21.8 Å²	21.8	33%	0.329	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-20.6	-166.4	-125.8	-123	0	0	0	114.8	F56 V68 P77 R79	F56-F58 HydrophobicContact CD2-CB 4.49Å; F56-F58 HydrophobicContact CE1-CB 4.18Å; F56-F58 HydrophobicContact CE2-CB 3.65Å; F56-F58 HydrophobicContact CZ-CB 3.46Å; F56-F58 VanDerWaalsContact CZ-CB 3.46Å; F58-V68 HydrophobicContact CE2-CG1 4.45Å; F58-P77 HydrophobicContact CE2-CB 3.38Å; F58-P77 HydrophobicContact CE2-CG 4.34Å; F58-P77 HydrophobicContact CZ-CB 3.73Å; F58-P77 HydrophobicContact CZ-CG 4.22Å; F58-R79 HydrophobicContact CD2-CB 4.23Å; F58-R79 HydrophobicContact CD2-CG 3.68Å; F58-R79 HydrophobicContact CE2-CG 3.66Å; F58-R79 HydrophobicContact CG-CG 4.24Å; F58-R79 HydrophobicContact CZ-CG 4.21Å
59	T	96.4	Very high	95.6	Very high	21 Å²	21	22.8 Å²	22.8	13%	0.129	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-11	171.1	57.2	0	0	0	0	112.4	F56 S57 A61 G101 G119 Y141	F56-T59 HydrophobicContact CD1-CG2 4.18Å; F56-T59 HydrophobicContact CE1-CG2 3.7Å; S57-T59 VanDerWaalsContact C-N 3.26Å; S57-T59 PolarHBondContact O-N 2.82Å; T59-A61 PolarHBondContact OG1-N 3.49Å; T59-G101 VanDerWaalsContact CB-O 3.27Å; T59-G101 WeakPolarHBondContact CB-O 3.47Å; T59-G101 PolarHBondContact OG1-O 3.18Å; T59-G119 CarbonylContact O-C 3.06Å; T59-G119 WeakPolarHBondContact O-CA 3.35Å; T59-Y141 HydrophobicContact CG2-CE1 4.29Å; T59-Y141 WeakPolarHBondContact O-CD1 3.43Å
60	G	97.2	Very high	95	Very high	3 Å²	3	22 Å²	22	3%	0.031	13%	0.125	C	C	.	.	S	Bend	trans	89.4	0.5	-171.3	0	0	0	0	0	114.3	S57 L62 G63 G119	S57-G60 WeakPolarHBondContact O-CA 3.42Å; S57-G60 PolarHBondContact O-N 3.44Å; G60-L62 PolarHBondContact O-N 3.32Å; G60-G63 PolarHBondContact O-N 2.59Å; G60-G119 VanDerWaalsContact C-CA 3.47Å; G60-G119 PolarHBondContact O-N 3.36Å
61	A	98.1	Very high	94	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.2	-173.7	0	0	0	0	0	114.2	T59 G63 T103 M118	T59-A61 PolarHBondContact OG1-N 3.49Å; A61-G63 VanDerWaalsContact C-N 3.34Å; A61-T103 PolarHBondContact O-OG1 3.3Å; A61-M118 WeakPolarHBondContact O-CE 3.31Å; A61-M118 VanDerWaalsContact O-CG 3.26Å; A61-M118 WeakPolarHBondContact O-CG 3.44Å
62	L	98.4	Very high	92.7	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-10.9	177.5	-51	-171.2	0	0	0	113.3	V53 W54 G60 I64 F67 Q81 H439	V53-L62 HydrophobicContact CB-CB 4.17Å; V53-L62 HydrophobicContact CB-CD2 4.13Å; V53-L62 HydrophobicContact CG2-CB 3.87Å; V53-L62 WeakPolarHBondContact CG2-O 3.33Å; W54-L62 WeakPolarHBondContact O-CD2 3.2Å; G60-L62 PolarHBondContact O-N 3.32Å; L62-I64 VanDerWaalsContact C-N 3.33Å; L62-I64 PolarHBondContact O-N 3.28Å; L62-F67 HydrophobicContact CB-CD2 4.49Å; L62-F67 HydrophobicContact CD1-CD2 4.03Å; L62-F67 HydrophobicContact CD1-CE2 3.98Å; L62-Q81 HydrophobicContact CD1-CB 3.6Å; L62-Q81 HydrophobicContact CD1-CG 4.32Å; L62-H439 HydrophobicContact CD2-CB 3.79Å
63	G	97.1	Very high	91.2	Very high	3 Å²	3	33.3 Å²	33.3	3%	0.031	22%	0.216	C	C	.	.			trans	69.2	25.7	177	0	0	0	0	0	114.5	G60 A61 L87 L143 P145	G60-G63 PolarHBondContact O-N 2.59Å; A61-G63 VanDerWaalsContact C-N 3.34Å; G63-L87 WeakPolarHBondContact O-CD1 3.16Å; G63-L143 CarbonylContact C-O 3.5Å; G63-L143 VanDerWaalsContact CA-O 3.29Å; G63-L143 WeakPolarHBondContact CA-O 3.49Å; G63-P145 WeakPolarHBondContact O-CD 3.33Å
64	I	96.3	Very high	89.9	Confident	16 Å²	16	35.4 Å²	35.4	8%	0.082	23%	0.231	C	C	.	.			trans	-121	98.3	-179.6	-60.3	157.4	0	0	0	108.6	V53 L62 S66 F67 Y85 L87 L143	V53-I64 HydrophobicContact CG2-CD1 3.61Å; L62-I64 VanDerWaalsContact C-N 3.33Å; L62-I64 PolarHBondContact O-N 3.28Å; I64-S66 VanDerWaalsContact C-N 3.26Å; I64-S66 WeakPolarHBondContact CG2-OG 3.41Å; I64-S66 PolarHBondContact O-N 2.87Å; I64-F67 HydrophobicContact CB-CD1 4.22Å; I64-F67 HydrophobicContact CB-CD2 3.9Å; I64-F67 HydrophobicContact CB-CE1 4.4Å; I64-F67 HydrophobicContact CB-CE2 4.1Å; I64-F67 HydrophobicContact CB-CG 3.98Å; I64-F67 HydrophobicContact CB-CZ 4.36Å; I64-F67 HydrophobicContact CD1-CD2 4.04Å; I64-F67 HydrophobicContact CD1-CE1 4.3Å; I64-F67 HydrophobicContact CD1-CE2 3.39Å; I64-F67 HydrophobicContact CD1-CZ 3.56Å; I64-F67 HydrophobicContact CG1-CE2 4.36Å; I64-F67 HydrophobicContact CG2-CD1 3.6Å; I64-F67 HydrophobicContact CG2-CD2 4.2Å; I64-F67 HydrophobicContact CG2-CE1 3.73Å; I64-F67 HydrophobicContact CG2-CE2 4.33Å; I64-F67 HydrophobicContact CG2-CG 3.87Å; I64-F67 HydrophobicContact CG2-CZ 4.12Å; I64-F67 WeakPolarHBondContact O-CB 3.25Å; I64-F67 PolarHBondContact O-N 2.87Å; I64-Y85 HydrophobicContact CD1-CD1 3.21Å; I64-Y85 HydrophobicContact CD1-CE1 3.56Å; I64-Y85 HydrophobicContact CD1-CG 4.07Å; I64-Y85 HydrophobicContact CG1-CD1 4.33Å; I64-Y85 HydrophobicContact CG1-CE1 4.27Å; I64-L87 HydrophobicContact CG1-CD1 4.04Å; I64-L143 PolarHBondContact N-O 3.32Å
65	P	94.2	Very high	88.8	Confident	48 Å²	48	45.4 Å²	45.4	31%	0.312	28%	0.275	S	S	.	.	H	α-helix	trans	-55.6	-38.3	-175.6	-30.4	36.8	0	0	0	113.9	F67 V68 V69 L143 E144	P65-F67 PolarHBondContact O-N 3.44Å; P65-F67 VanDerWaalsContact O-N 3.08Å; P65-V68 PolarHBondContact O-N 3.13Å; P65-V69 PolarHBondContact O-N 3.25Å; P65-L143 HydrophobicContact CB-CB 4.44Å; P65-L143 WeakPolarHBondContact CD-O 3.36Å; P65-L143 HydrophobicContact CG-CB 4.38Å; P65-E144 HydrophobicContact CG-CB 3.73Å
66	S	92.9	Very high	88.2	Confident	41 Å²	41	53.1 Å²	53.1	29%	0.287	31%	0.308	S	S	.	.	H	α-helix	trans	-64.2	-12.8	179.9	61	0	0	0	0	114.1	I64 V69	I64-S66 VanDerWaalsContact C-N 3.26Å; I64-S66 WeakPolarHBondContact CG2-OG 3.41Å; I64-S66 PolarHBondContact O-N 2.87Å; S66-V69 WeakPolarHBondContact CA-O 3.49Å
67	F	93.6	Very high	87.6	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.009	32%	0.32	C	S	.	.	H	α-helix	trans	-75.8	-31.3	171.3	-71.1	0.5	0	0	0	112.2	L62 I64 P65 P77 R78 Q81 Y85	L62-F67 HydrophobicContact CB-CD2 4.49Å; L62-F67 HydrophobicContact CD1-CD2 4.03Å; L62-F67 HydrophobicContact CD1-CE2 3.98Å; I64-F67 HydrophobicContact CB-CD1 4.22Å; I64-F67 HydrophobicContact CB-CD2 3.9Å; I64-F67 HydrophobicContact CB-CE1 4.4Å; I64-F67 HydrophobicContact CB-CE2 4.1Å; I64-F67 HydrophobicContact CB-CG 3.98Å; I64-F67 HydrophobicContact CB-CZ 4.36Å; I64-F67 HydrophobicContact CD1-CD2 4.04Å; I64-F67 HydrophobicContact CD1-CE1 4.3Å; I64-F67 HydrophobicContact CD1-CE2 3.39Å; I64-F67 HydrophobicContact CD1-CZ 3.56Å; I64-F67 HydrophobicContact CG1-CE2 4.36Å; I64-F67 HydrophobicContact CG2-CD1 3.6Å; I64-F67 HydrophobicContact CG2-CD2 4.2Å; I64-F67 HydrophobicContact CG2-CE1 3.73Å; I64-F67 HydrophobicContact CG2-CE2 4.33Å; I64-F67 HydrophobicContact CG2-CG 3.87Å; I64-F67 HydrophobicContact CG2-CZ 4.12Å; I64-F67 WeakPolarHBondContact O-CB 3.25Å; I64-F67 PolarHBondContact O-N 2.87Å; P65-F67 PolarHBondContact O-N 3.44Å; P65-F67 VanDerWaalsContact O-N 3.08Å; F67-P77 CarbonylContact O-C 3.46Å; F67-R78 HydrophobicContact CB-CB 4.26Å; F67-R78 HydrophobicContact CD1-CB 4.48Å; F67-R78 HydrophobicContact CG-CB 4.42Å; F67-R78 CarbonylContact O-C 3.53Å; F67-R78 WeakPolarHBondContact O-CA 3.37Å; F67-R78 PolarHBondContact O-N 3.27Å; F67-Q81 HydrophobicContact CD2-CB 4.47Å; F67-Q81 HydrophobicContact CE2-CB 3.84Å; F67-Q81 HydrophobicContact CE2-CG 3.85Å; F67-Q81 HydrophobicContact CZ-CB 4.48Å; F67-Q81 HydrophobicContact CZ-CG 4.14Å; F67-Y85 HydrophobicContact CE1-CD2 4.36Å; F67-Y85 HydrophobicContact CE1-CE2 4.27Å; F67-Y85 AromaticContact CZ-CD1 3.99Å; F67-Y85 HydrophobicContact CZ-CD1 3.99Å; F67-Y85 AromaticContact CZ-CD2 3.85Å; F67-Y85 HydrophobicContact CZ-CD2 3.85Å; F67-Y85 HydrophobicContact CZ-CE1 4.31Å; F67-Y85 HydrophobicContact CZ-CE2 4.2Å; F67-Y85 AromaticContact CZ-CG 3.72Å; F67-Y85 HydrophobicContact CZ-CG 3.72Å
68	V	89.9	Confident	87.2	Confident	27 Å²	27	59.5 Å²	59.5	16%	0.164	34%	0.338	C	S	.	.	H	α-helix	trans	-102	-44.9	-176.2	-174.1	0	0	0	0	111	S57 F58 P65 P77 L143	S57-V68 WeakPolarHBondContact O-CG2 3.3Å; F58-V68 HydrophobicContact CE2-CG1 4.45Å; P65-V68 PolarHBondContact O-N 3.13Å; V68-P77 WeakPolarHBondContact O-CB 3.32Å; V68-P77 WeakPolarHBondContact O-CG 3.23Å; V68-L143 HydrophobicContact CB-CD1 4.38Å; V68-L143 HydrophobicContact CB-CD2 4.31Å; V68-L143 HydrophobicContact CG1-CD1 4.48Å; V68-L143 HydrophobicContact CG1-CD2 4.33Å; V68-L143 HydrophobicContact CG2-CD2 4.15Å
69	V	86.7	Confident	87.1	Confident	84 Å²	84	62.9 Å²	62.9	51%	0.509	35%	0.349	S	S	.	.	S	Bend	trans	-99	111.1	177.3	-175.6	0	0	0	0	107.6	P65 S66 D71 L143	P65-V69 PolarHBondContact O-N 3.25Å; S66-V69 WeakPolarHBondContact CA-O 3.49Å; V69-D71 PolarHBondContact O-N 3.21Å; V69-L143 HydrophobicContact CG2-CD1 3.93Å
70	P	77	Confident	87	Confident	54 Å²	54	65.9 Å²	65.9	35%	0.351	36%	0.358	S	S	.	.			trans	-62.1	135.1	-177	-14.7	27	0	0	0	111.2	S74 P77	P70-S74 WeakPolarHBondContact CB-O 3.41Å; P70-P77 HydrophobicContact CG-CG 3.83Å
71	D	74.6	Confident	87	Confident	84 Å²	84	66 Å²	66	45%	0.449	36%	0.358	S	S	.	.			trans	-92.9	-179	172.4	63.3	23.6	0	0	0	111	V69 G73 S74	V69-D71 PolarHBondContact O-N 3.21Å; D71-G73 PolarHBondContact O-N 3.27Å; D71-G73 WeakPolarHBondContact OD1-CA 3.32Å; D71-G73 PolarHBondContact OD1-N 3.42Å; D71-S74 PolarHBondContact O-N 3.26Å; D71-S74 PolarHBondContact OD1-N 3.17Å
72	S	70.7	Confident	86.9	Confident	140 Å²	140	68.6 Å²	68.6	98%	0.979	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-19.9	177.9	48.4	0	0	0	0	114.4
73	G	68.4	Low	86.9	Confident	73 Å²	73	71.8 Å²	71.8	75%	0.753	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-17.3	-177.3	0	0	0	0	0	114.9	D71	D71-G73 PolarHBondContact O-N 3.27Å; D71-G73 WeakPolarHBondContact OD1-CA 3.32Å; D71-G73 PolarHBondContact OD1-N 3.42Å
74	S	71.4	Confident	87	Confident	44 Å²	44	72.7 Å²	72.7	31%	0.308	39%	0.393	S	S	.	.			trans	-134.8	131.1	177.9	-178.3	0	0	0	0	111.4	P70 D71 K76	P70-S74 WeakPolarHBondContact CB-O 3.41Å; D71-S74 PolarHBondContact O-N 3.26Å; D71-S74 PolarHBondContact OD1-N 3.17Å; S74-K76 VanDerWaalsContact C-N 3.34Å; S74-K76 PolarHBondContact OG-N 3.33Å; S74-K76 PolarHBondContact OG-O 2.99Å
75	K	75.1	Confident	87.1	Confident	210 Å²	210	76.4 Å²	76.4	91%	0.913	41%	0.407	S	S	*	.	S	Bend	trans	-82.3	-11	174.6	-65.1	-173.2	178.8	-177.5	0	113.6
76	K	85.3	Confident	87.2	Confident	162 Å²	162	79 Å²	79	70%	0.704	41%	0.411	S	S	*	.	S	Bend	trans	-128.6	139.3	-175.1	-69.5	-175.4	-179.4	178.5	0	111.6	S74	S74-K76 VanDerWaalsContact C-N 3.34Å; S74-K76 PolarHBondContact OG-N 3.33Å; S74-K76 PolarHBondContact OG-O 2.99Å
77	P	85.4	Confident	87.4	Confident	55 Å²	55	77.5 Å²	77.5	36%	0.357	40%	0.399	S	S	.	.			trans	-59.5	139.3	170.6	-24.4	34.6	0	0	0	112	F58 F67 V68 P70 R79	F58-P77 HydrophobicContact CE2-CB 3.38Å; F58-P77 HydrophobicContact CE2-CG 4.34Å; F58-P77 HydrophobicContact CZ-CB 3.73Å; F58-P77 HydrophobicContact CZ-CG 4.22Å; F67-P77 CarbonylContact O-C 3.46Å; V68-P77 WeakPolarHBondContact O-CB 3.32Å; V68-P77 WeakPolarHBondContact O-CG 3.23Å; P70-P77 HydrophobicContact CG-CG 3.83Å; P77-R79 PolarHBondContact O-N 3.02Å
78	R	88.8	Confident	87.5	Confident	106 Å²	106	83.2 Å²	83.2	40%	0.4	43%	0.426	S	S	.	.			trans	-87.7	103	172.9	-64.1	172.1	67.4	162.6	7.3	108.4	S57 F67	S57-R78 PolarHBondContact OG-O 2.97Å; F67-R78 HydrophobicContact CB-CB 4.26Å; F67-R78 HydrophobicContact CD1-CB 4.48Å; F67-R78 HydrophobicContact CG-CB 4.42Å; F67-R78 CarbonylContact O-C 3.53Å; F67-R78 WeakPolarHBondContact O-CA 3.37Å; F67-R78 PolarHBondContact O-N 3.27Å
79	R	91.1	Very high	87.5	Confident	147 Å²	147	83.8 Å²	83.8	56%	0.555	43%	0.43	S	S	*	.			trans	-73.6	-25.8	178.3	-67.8	-177.4	-178	179.2	1.4	114.4	F56 S57 F58 P77	F56-R79 VanDerWaalsContact CD2-O 3.24Å; F56-R79 WeakPolarHBondContact CD2-O 3.37Å; S57-R79 PolarHBondContact N-O 2.73Å; S57-R79 PolarHBondContact OG-O 2.93Å; F58-R79 HydrophobicContact CD2-CB 4.23Å; F58-R79 HydrophobicContact CD2-CG 3.68Å; F58-R79 HydrophobicContact CE2-CG 3.66Å; F58-R79 HydrophobicContact CG-CG 4.24Å; F58-R79 HydrophobicContact CZ-CG 4.21Å; P77-R79 PolarHBondContact O-N 3.02Å
80	Y	95.1	Very high	87.4	Confident	83 Å²	83	84.9 Å²	84.9	33%	0.325	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	133.4	-174	-46.2	-68.6	0	0	0	109	F56 Y82 R407	F56-Y80 AromaticContact CD2-CD1 3.95Å; F56-Y80 HydrophobicContact CD2-CD1 3.95Å; F56-Y80 AromaticContact CD2-CE1 3.78Å; F56-Y80 HydrophobicContact CD2-CE1 3.78Å; F56-Y80 HydrophobicContact CE2-CE1 4.13Å; Y80-Y82 VanDerWaalsContact CB-CZ 3.44Å; Y80-Y82 HydrophobicContact CD2-CE2 4.35Å; Y80-Y82 AromaticContact CD2-CZ 3.89Å; Y80-Y82 WeakPolarHBondContact CD2-OH 3.42Å; Y80-Y82 HydrophobicContact CG-CE1 4.38Å; Y80-Y82 HydrophobicContact CG-CE2 4.38Å; Y80-Y82 AromaticContact CG-CZ 3.84Å; Y80-R407 HydrophobicContact CD1-CB 3.8Å; Y80-R407 HydrophobicContact CD1-CG 4.44Å; Y80-R407 HydrophobicContact CE1-CB 3.77Å; Y80-R407 HydrophobicContact CE1-CG 3.89Å
81	Q	96.8	Very high	87.8	Confident	6 Å²	6	85.5 Å²	85.5	3%	0.028	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	97.6	169.9	178.2	52	36.5	0	0	108	W54 G55 L62 F67 T83	W54-Q81 HydrophobicContact CB-CG 4.18Å; W54-Q81 WeakPolarHBondContact CB-O 3.31Å; G55-Q81 PolarHBondContact N-O 2.89Å; G55-Q81 PolarHBondContact O-N 3.32Å; L62-Q81 HydrophobicContact CD1-CB 3.6Å; L62-Q81 HydrophobicContact CD1-CG 4.32Å; F67-Q81 HydrophobicContact CD2-CB 4.47Å; F67-Q81 HydrophobicContact CE2-CB 3.84Å; F67-Q81 HydrophobicContact CE2-CG 3.85Å; F67-Q81 HydrophobicContact CZ-CB 4.48Å; F67-Q81 HydrophobicContact CZ-CG 4.14Å; Q81-T83 VanDerWaalsContact C-N 3.29Å; Q81-T83 VanDerWaalsContact CG-O 3.26Å; Q81-T83 WeakPolarHBondContact CG-O 3.27Å; Q81-T83 PolarHBondContact NE2-O 3.36Å; Q81-T83 PolarHBondContact NE2-OG1 3.25Å; Q81-T83 PolarHBondContact O-N 2.82Å
82	Y	97.2	Very high	88.7	Confident	55 Å²	55	86.5 Å²	86.5	22%	0.216	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-7.9	-171.8	-66.7	-69.3	0	0	0	114.9	Y80 G411 I412 G413 K415	Y80-Y82 VanDerWaalsContact CB-CZ 3.44Å; Y80-Y82 HydrophobicContact CD2-CE2 4.35Å; Y80-Y82 AromaticContact CD2-CZ 3.89Å; Y80-Y82 WeakPolarHBondContact CD2-OH 3.42Å; Y80-Y82 HydrophobicContact CG-CE1 4.38Å; Y80-Y82 HydrophobicContact CG-CE2 4.38Å; Y80-Y82 AromaticContact CG-CZ 3.84Å; Y82-G411 CarbonylContact O-C 3.57Å; Y82-G411 WeakPolarHBondContact O-CA 3.41Å; Y82-I412 PolarHBondContact O-N 2.99Å; Y82-G413 WeakPolarHBondContact O-CA 3.35Å; Y82-G413 PolarHBondContact O-N 3.36Å; Y82-K415 HydrophobicContact CD1-CG 4.44Å; Y82-K415 HydrophobicContact CE1-CD 4.44Å; Y82-K415 HydrophobicContact CE1-CG 3.77Å; Y82-K415 VanDerWaalsContact OH-CE 3.23Å; Y82-K415 WeakPolarHBondContact OH-CE 3.44Å
83	T	98	Very high	90	Very high	68 Å²	68	80.3 Å²	80.3	42%	0.417	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	156.6	-179.4	54.8	0	0	0	0	110.4	W54 Q81 Y85	W54-T83 WeakPolarHBondContact CB-O 3.33Å; Q81-T83 VanDerWaalsContact C-N 3.29Å; Q81-T83 VanDerWaalsContact CG-O 3.26Å; Q81-T83 WeakPolarHBondContact CG-O 3.27Å; Q81-T83 PolarHBondContact NE2-O 3.36Å; Q81-T83 PolarHBondContact NE2-OG1 3.25Å; Q81-T83 PolarHBondContact O-N 2.82Å; T83-Y85 PolarHBondContact O-N 3.45Å; T83-Y85 VanDerWaalsContact O-N 3.15Å
84	P	98.4	Very high	91.3	Very high	22 Å²	22	79.2 Å²	79.2	14%	0.143	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.7	122.8	174.9	-26.6	34.2	0	0	0	111.5	F52 W54 G411 V424 V426	F52-P84 HydrophobicContact CB-CB 4.15Å; F52-P84 HydrophobicContact CD1-CB 4.02Å; F52-P84 HydrophobicContact CG-CB 4.4Å; W54-P84 HydrophobicContact CD2-CG 4.27Å; W54-P84 HydrophobicContact CE3-CB 3.76Å; W54-P84 HydrophobicContact CE3-CG 3.83Å; W54-P84 HydrophobicContact CZ3-CB 4.03Å; W54-P84 HydrophobicContact CZ3-CG 4.01Å; P84-G411 VanDerWaalsContact CD-O 3.27Å; P84-G411 WeakPolarHBondContact CD-O 3.34Å; P84-V424 HydrophobicContact CG-CG1 3.57Å; P84-V426 HydrophobicContact CB-CG2 4.29Å; P84-V426 HydrophobicContact CG-CG2 3.83Å
85	Y	98	Very high	92.6	Very high	93 Å²	93	77.8 Å²	77.8	37%	0.365	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	137.6	173.5	-172.8	-81.9	0	0	0	109.3	F52 V53 I64 F67 T83 L87	F52-Y85 CarbonylContact C-O 3.52Å; F52-Y85 VanDerWaalsContact CA-O 3.27Å; F52-Y85 WeakPolarHBondContact CA-O 3.41Å; V53-Y85 PolarHBondContact N-O 2.88Å; V53-Y85 PolarHBondContact O-N 2.82Å; I64-Y85 HydrophobicContact CD1-CD1 3.21Å; I64-Y85 HydrophobicContact CD1-CE1 3.56Å; I64-Y85 HydrophobicContact CD1-CG 4.07Å; I64-Y85 HydrophobicContact CG1-CD1 4.33Å; I64-Y85 HydrophobicContact CG1-CE1 4.27Å; F67-Y85 HydrophobicContact CE1-CD2 4.36Å; F67-Y85 HydrophobicContact CE1-CE2 4.27Å; F67-Y85 AromaticContact CZ-CD1 3.99Å; F67-Y85 HydrophobicContact CZ-CD1 3.99Å; F67-Y85 AromaticContact CZ-CD2 3.85Å; F67-Y85 HydrophobicContact CZ-CD2 3.85Å; F67-Y85 HydrophobicContact CZ-CE1 4.31Å; F67-Y85 HydrophobicContact CZ-CE2 4.2Å; F67-Y85 AromaticContact CZ-CG 3.72Å; F67-Y85 HydrophobicContact CZ-CG 3.72Å; T83-Y85 PolarHBondContact O-N 3.45Å; T83-Y85 VanDerWaalsContact O-N 3.15Å; Y85-L87 PolarHBondContact O-N 3.02Å
86	R	97.5	Very high	93.7	Very high	104 Å²	104	68.8 Å²	68.8	39%	0.392	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	119.5	-179	-177.4	179.5	174.4	-165	-12.3	110.1	F52 E88	F52-R86 HydrophobicContact CD1-CB 4.2Å; F52-R86 HydrophobicContact CE1-CB 3.73Å; F52-R86 HydrophobicContact CE1-CG 4.39Å; F52-R86 HydrophobicContact CZ-CB 4.17Å; F52-R86 HydrophobicContact CZ-CG 4.36Å; R86-E88 VanDerWaalsContact CD-OE1 3.3Å; R86-E88 WeakPolarHBondContact CD-OE1 3.42Å; R86-E88 VanDerWaalsContact CZ-CD 3.48Å; R86-E88 IonicContact CZ-OE1 2.97Å; R86-E88 IonicContact CZ-OE2 3.17Å; R86-E88 IonicContact NE-OE1 2.99Å; R86-E88 PolarHBondContact NE-OE1 2.91Å; R86-E88 IonicContact NE-OE2 3.25Å; R86-E88 PolarHBondContact NE-OE2 2.99Å; R86-E88 IonicContact NH1-OE1 3.36Å; R86-E88 PolarHBondContact NH1-OE1 2.91Å; R86-E88 IonicContact NH2-OE1 3.32Å; R86-E88 PolarHBondContact NH2-OE1 2.88Å; R86-E88 IonicContact NH2-OE2 2.73Å; R86-E88 PolarHBondContact NH2-OE2 3.23Å
87	L	97.2	Very high	94.4	Very high	8 Å²	8	61.5 Å²	61.5	4%	0.042	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	122.8	166.1	179.6	62.4	0	0	0	108.1	V51 V53 G63 I64 Y85 T89 M105 M118 P145	V51-L87 HydrophobicContact CB-CB 4.32Å; V51-L87 HydrophobicContact CG1-CB 4.29Å; V51-L87 HydrophobicContact CG1-CD2 4.29Å; V51-L87 PolarHBondContact O-N 3.04Å; V53-L87 HydrophobicContact CG1-CB 3.99Å; V53-L87 HydrophobicContact CG1-CD2 3.99Å; V53-L87 HydrophobicContact CG2-CB 4.21Å; G63-L87 WeakPolarHBondContact O-CD1 3.16Å; I64-L87 HydrophobicContact CG1-CD1 4.04Å; Y85-L87 PolarHBondContact O-N 3.02Å; L87-T89 HydrophobicContact CD2-CG2 4.43Å; L87-T89 HydrophobicContact CG-CG2 4.23Å; L87-T89 PolarHBondContact O-N 3.09Å; L87-M105 HydrophobicContact CD2-CE 3.53Å; L87-M105 HydrophobicContact CD2-SD 3.92Å; L87-M118 HydrophobicContact CD2-CE 3.94Å; L87-P145 HydrophobicContact CD1-CG 4Å; L87-P145 HydrophobicContact CD2-CG 3.98Å; L87-P145 HydrophobicContact CG-CG 4.38Å
88	E	94.3	Very high	95	Very high	122 Å²	122	59.1 Å²	59.1	57%	0.57	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-76	125.4	174.7	-63.9	-60.9	165.9	0	0	109.5	R86	R86-E88 VanDerWaalsContact CD-OE1 3.3Å; R86-E88 WeakPolarHBondContact CD-OE1 3.42Å; R86-E88 VanDerWaalsContact CZ-CD 3.48Å; R86-E88 IonicContact CZ-OE1 2.97Å; R86-E88 IonicContact CZ-OE2 3.17Å; R86-E88 IonicContact NE-OE1 2.99Å; R86-E88 PolarHBondContact NE-OE1 2.91Å; R86-E88 IonicContact NE-OE2 3.25Å; R86-E88 PolarHBondContact NE-OE2 2.99Å; R86-E88 IonicContact NH1-OE1 3.36Å; R86-E88 PolarHBondContact NH1-OE1 2.91Å; R86-E88 IonicContact NH2-OE1 3.32Å; R86-E88 PolarHBondContact NH2-OE1 2.88Å; R86-E88 IonicContact NH2-OE2 2.73Å; R86-E88 PolarHBondContact NH2-OE2 3.23Å
89	T	91.1	Very high	95.5	Very high	40 Å²	40	54.1 Å²	54.1	25%	0.245	28%	0.275	C	S	.	.			trans	-125.3	135	178	62.6	0	0	0	0	108.9	V51 L87 E91 I93 M105	V51-T89 HydrophobicContact CB-CG2 4.19Å; V51-T89 HydrophobicContact CG2-CG2 3.87Å; L87-T89 HydrophobicContact CD2-CG2 4.43Å; L87-T89 HydrophobicContact CG-CG2 4.23Å; L87-T89 PolarHBondContact O-N 3.09Å; T89-E91 VanDerWaalsContact C-N 3.33Å; T89-E91 PolarHBondContact OG1-O 3.36Å; T89-E91 VanDerWaalsContact OG1-O 3.06Å; T89-I93 HydrophobicContact CG2-CG1 4.09Å; T89-M105 HydrophobicContact CG2-CE 4.36Å
90	A	83.1	Confident	95.8	Very high	106 Å²	106	48.9 Å²	48.9	88%	0.876	26%	0.255	S	S	*	.	S	Bend	trans	-70.2	-35.8	175.1	0	0	0	0	0	111.5
91	E	86.4	Confident	96	Very high	68 Å²	68	45.2 Å²	45.2	32%	0.318	24%	0.243	S	C	.	.	S	Bend	trans	-103.6	155.4	-176.3	-68	-62.3	147.1	0	0	112.1	T89 I93 W116	T89-E91 VanDerWaalsContact C-N 3.33Å; T89-E91 PolarHBondContact OG1-O 3.36Å; T89-E91 VanDerWaalsContact OG1-O 3.06Å; E91-I93 PolarHBondContact O-N 2.82Å; E91-W116 HydrophobicContact CB-CH2 3.7Å; E91-W116 HydrophobicContact CB-CZ2 4.15Å; E91-W116 HydrophobicContact CB-CZ3 4.37Å; E91-W116 HydrophobicContact CG-CH2 3.61Å; E91-W116 HydrophobicContact CG-CZ2 3.77Å
92	Q	93.4	Very high	96.1	Very high	104 Å²	104	45 Å²	45	49%	0.486	24%	0.241	S	C	.	.			trans	-73.1	110.6	169.7	176.6	175.8	-13.7	0	0	109.4	H49 S107	H49-Q92 HydrophobicContact CB-CG 3.84Å; H49-Q92 PolarHBondContact CE1-NE2 3.44Å; H49-Q92 PolarHBondContact ND1-NE2 2.83Å; H49-Q92 PolarHBondContact NE2-NE2 2.91Å; Q92-S107 VanDerWaalsContact O-CB 3.26Å; Q92-S107 WeakPolarHBondContact O-CB 3.37Å; Q92-S107 PolarHBondContact O-OG 2.79Å
93	I	96.9	Very high	96.1	Very high	10 Å²	10	42.3 Å²	42.3	5%	0.051	23%	0.231	C	C	.	.			trans	-77.7	127.2	176	-55.2	-51.1	0	0	0	109.9	V51 T89 E91 S95 M105 A106 W116 L443	V51-I93 HydrophobicContact CG2-CB 3.93Å; V51-I93 HydrophobicContact CG2-CG1 3.79Å; T89-I93 HydrophobicContact CG2-CG1 4.09Å; E91-I93 PolarHBondContact O-N 2.82Å; I93-S95 WeakPolarHBondContact CG2-O 3.3Å; I93-M105 HydrophobicContact CD1-CB 4.17Å; I93-M105 HydrophobicContact CG1-CB 4.43Å; I93-M105 HydrophobicContact CG1-SD 4.31Å; I93-M105 HydrophobicContact CG2-CB 3.95Å; I93-M105 HydrophobicContact CG2-CG 4.39Å; I93-A106 WeakPolarHBondContact CG2-O 3.29Å; I93-W116 HydrophobicContact CD1-CE3 4.05Å; I93-W116 HydrophobicContact CD1-CZ3 4.03Å; I93-L443 HydrophobicContact CB-CD2 4.13Å; I93-L443 HydrophobicContact CG2-CD2 3.72Å
94	S	96.9	Very high	96.2	Very high	50 Å²	50	39.1 Å²	39.1	35%	0.35	21%	0.211	S	C	.	.			trans	-108.9	-19.9	179.9	56	0	0	0	0	113.4	A106 S108	S94-A106 PolarHBondContact N-O 3.25Å; S94-A106 PolarHBondContact OG-O 2.85Å; S94-S108 PolarHBondContact OG-N 2.85Å
95	S	98.5	Very high	96.2	Very high	15 Å²	15	38.1 Å²	38.1	11%	0.105	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	140.1	176.9	-174	0	0	0	0	110.1	I93 M105 A106 V163	I93-S95 WeakPolarHBondContact CG2-O 3.3Å; S95-M105 WeakPolarHBondContact O-CA 3.41Å; S95-A106 PolarHBondContact N-O 3.39Å; S95-A106 PolarHBondContact O-N 2.76Å; S95-V163 PolarHBondContact OG-N 3.04Å; S95-V163 VanDerWaalsContact OG-N 3.12Å
96	A	98.7	Very high	96.2	Very high	20 Å²	20	33.7 Å²	33.7	17%	0.165	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	147.5	173.9	0	0	0	0	0	109.3	L104 M105 A434 V441 L443	A96-L104 CarbonylContact C-O 3.55Å; A96-L104 VanDerWaalsContact CA-O 3.3Å; A96-L104 WeakPolarHBondContact CA-O 3.39Å; A96-M105 HydrophobicContact CB-CG 4.36Å; A96-A434 HydrophobicContact CB-CB 4.34Å; A96-A434 WeakPolarHBondContact O-CB 3.5Å; A96-V441 HydrophobicContact CB-CB 4.44Å; A96-V441 HydrophobicContact CB-CG1 4Å; A96-L443 HydrophobicContact CB-CD2 4.28Å
97	A	98.9	Very high	96.2	Very high	10 Å²	10	29 Å²	29	8%	0.083	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	136.2	175.7	0	0	0	0	0	110.1	T103 L104 V163 C165	A97-T103 VanDerWaalsContact O-CA 3.3Å; A97-T103 WeakPolarHBondContact O-CA 3.38Å; A97-T103 WeakPolarHBondContact O-CG2 3.34Å; A97-L104 PolarHBondContact N-O 3.21Å; A97-L104 PolarHBondContact O-N 2.81Å; A97-V163 HydrophobicContact CB-CB 4.31Å; A97-V163 HydrophobicContact CB-CG2 3.84Å; A97-C165 HydrophobicContact CB-CB 4.18Å
98	C	98.9	Very high	96.1	Very high	5 Å²	5	31.1 Å²	31.1	3%	0.034	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	115.4	178.2	-61.9	0	0	0	0	108.2	Y275 A434 G436 H439	C98-Y275 WeakPolarHBondContact O-CE2 3.33Å; C98-Y275 PolarHBondContact O-OH 3.39Å; C98-A434 HydrophobicContact CB-CB 4.43Å; C98-A434 VanDerWaalsContact SG-CB 3.56Å; C98-A434 PolarHBondContact SG-O 3.06Å; C98-G436 VanDerWaalsContact CB-CA 3.44Å; C98-G436 VanDerWaalsContact CB-N 3.34Å; C98-H439 WeakPolarHBondContact CB-NE2 3.4Å
99	G	98.5	Very high	96.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	17%	0.167	C	C	.	.			trans	-90.7	-160.9	170.9	0	0	0	0	0	111.7	G101 F102 C165 G166 H439	G99-G101 PolarHBondContact O-N 2.89Å; G99-F102 PolarHBondContact N-O 3.03Å; G99-C165 VanDerWaalsContact CA-CB 3.48Å; G99-G166 WeakPolarHBondContact CA-O 3.45Å; G99-H439 PolarHBondContact O-CE1 3.12Å; G99-H439 VanDerWaalsContact O-CE1 3.3Å
100	Y	98.3	Very high	96.3	Very high	38 Å²	38	29.8 Å²	29.8	15%	0.149	18%	0.178	C	C	.	.	S	Bend	trans	-84.2	83.2	179.9	-69	33.4	0	0	0	109.4	G166 R167 Q223 Y275 L387 V437	Y100-G166 PolarHBondContact N-O 2.82Å; Y100-R167 HydrophobicContact CD2-CB 3.99Å; Y100-R167 HydrophobicContact CD2-CG 3.7Å; Y100-R167 HydrophobicContact CE2-CB 4.17Å; Y100-R167 HydrophobicContact CE2-CG 4.12Å; Y100-R167 HydrophobicContact CG-CB 4.17Å; Y100-R167 HydrophobicContact CG-CG 4.17Å; Y100-Q223 HydrophobicContact CE2-CG 4.11Å; Y100-Q223 PolarHBondContact OH-OE1 3.12Å; Y100-Y275 HydrophobicContact CD1-CE1 4.26Å; Y100-Y275 AromaticContact CD1-CZ 3.92Å; Y100-Y275 VanDerWaalsContact CD1-OH 3.32Å; Y100-Y275 WeakPolarHBondContact CD1-OH 3.47Å; Y100-Y275 HydrophobicContact CE1-CD1 4.28Å; Y100-Y275 AromaticContact CE1-CE1 3.52Å; Y100-Y275 HydrophobicContact CE1-CE1 3.52Å; Y100-Y275 HydrophobicContact CE1-CE2 4.35Å; Y100-Y275 AromaticContact CE1-CZ 3.56Å; Y100-Y275 WeakPolarHBondContact CE1-OH 3.35Å; Y100-Y275 PolarHBondContact OH-O 3.17Å; Y100-L387 WeakPolarHBondContact OH-CD1 3.43Å; Y100-V437 HydrophobicContact CD1-CG2 3.46Å; Y100-V437 VanDerWaalsContact CD1-CG2 3.46Å; Y100-V437 HydrophobicContact CD2-CG2 3.71Å; Y100-V437 HydrophobicContact CE1-CG2 3.78Å; Y100-V437 HydrophobicContact CE2-CG2 4.03Å; Y100-V437 HydrophobicContact CG-CG2 3.42Å; Y100-V437 VanDerWaalsContact CG-CG2 3.42Å
101	G	98.3	Very high	96.8	Very high	6 Å²	6	28.7 Å²	28.7	6%	0.062	16%	0.157	C	C	.	.	S	Bend	trans	86.8	16.3	178.6	0	0	0	0	0	115	T59 G99 L120	T59-G101 VanDerWaalsContact CB-O 3.27Å; T59-G101 WeakPolarHBondContact CB-O 3.47Å; T59-G101 PolarHBondContact OG1-O 3.18Å; G99-G101 PolarHBondContact O-N 2.89Å; G101-L120 PolarHBondContact O-N 2.72Å
102	F	98.9	Very high	97.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	166	173.6	70.4	-83.8	0	0	0	111.3	G99 M118 L120 Q125 L126 C165 G166 S170 H439	G99-F102 PolarHBondContact N-O 3.03Å; F102-M118 CarbonylContact C-O 3.5Å; F102-M118 WeakPolarHBondContact CA-O 3.41Å; F102-M118 WeakPolarHBondContact CB-O 3.15Å; F102-L120 HydrophobicContact CB-CB 4.34Å; F102-L120 WeakPolarHBondContact CB-O 3.27Å; F102-Q125 HydrophobicContact CD1-CG 3.9Å; F102-Q125 HydrophobicContact CD2-CB 4.5Å; F102-Q125 HydrophobicContact CD2-CG 3.95Å; F102-Q125 HydrophobicContact CE1-CB 4.39Å; F102-Q125 HydrophobicContact CE1-CG 3.89Å; F102-Q125 HydrophobicContact CE2-CB 4.01Å; F102-Q125 HydrophobicContact CE2-CG 3.91Å; F102-Q125 HydrophobicContact CG-CG 3.93Å; F102-Q125 HydrophobicContact CZ-CB 3.95Å; F102-Q125 HydrophobicContact CZ-CG 3.88Å; F102-L126 HydrophobicContact CB-CD2 4.19Å; F102-L126 HydrophobicContact CD2-CD2 3.59Å; F102-L126 HydrophobicContact CE2-CD2 4.42Å; F102-L126 HydrophobicContact CG-CD2 4.28Å; F102-C165 HydrophobicContact CD2-CB 4.44Å; F102-C165 HydrophobicContact CE2-CB 3.55Å; F102-C165 VanDerWaalsContact CE2-SG 3.54Å; F102-C165 HydrophobicContact CZ-CB 3.72Å; F102-G166 WeakPolarHBondContact CE1-O 3.46Å; F102-S170 WeakPolarHBondContact CE2-OG 3.42Å; F102-H439 PolarHBondContact O-CE1 2.78Å; F102-H439 PolarHBondContact O-NE2 3.42Å
103	T	98.9	Very high	97.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	139.7	-176.2	-53	0	0	0	0	110.2	A61 A97 M105 G117 M118 H439 V441	A61-T103 PolarHBondContact O-OG1 3.3Å; A97-T103 VanDerWaalsContact O-CA 3.3Å; A97-T103 WeakPolarHBondContact O-CA 3.38Å; A97-T103 WeakPolarHBondContact O-CG2 3.34Å; T103-M105 HydrophobicContact CG2-CG 4.31Å; T103-G117 WeakPolarHBondContact O-CA 3.18Å; T103-M118 HydrophobicContact CG2-CE 3.51Å; T103-M118 HydrophobicContact CG2-SD 4.22Å; T103-M118 PolarHBondContact N-O 3.18Å; T103-M118 PolarHBondContact O-N 2.9Å; T103-H439 PolarHBondContact OG1-CD2 3.27Å; T103-H439 PolarHBondContact OG1-NE2 3.07Å; T103-V441 HydrophobicContact CG2-CG2 3.81Å
104	L	98.8	Very high	97.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	141.7	163.8	-73.7	-177.4	0	0	0	110.5	A96 A97 L115 W116 L126 V148 V163 S170 V172	A96-L104 CarbonylContact C-O 3.55Å; A96-L104 VanDerWaalsContact CA-O 3.3Å; A96-L104 WeakPolarHBondContact CA-O 3.39Å; A97-L104 PolarHBondContact N-O 3.21Å; A97-L104 PolarHBondContact O-N 2.81Å; L104-L115 HydrophobicContact CB-CD1 4.49Å; L104-L115 HydrophobicContact CD2-CD1 4.33Å; L104-W116 WeakPolarHBondContact CA-O 3.24Å; L104-L126 HydrophobicContact CD2-CD2 3.77Å; L104-L126 HydrophobicContact CG-CD2 4.31Å; L104-V148 HydrophobicContact CD2-CG2 4.31Å; L104-V163 HydrophobicContact CB-CB 4.09Å; L104-V163 HydrophobicContact CB-CG1 4.3Å; L104-V163 HydrophobicContact CB-CG2 4.12Å; L104-V163 HydrophobicContact CD1-CB 4.47Å; L104-V163 HydrophobicContact CD1-CG1 4.49Å; L104-S170 WeakPolarHBondContact CD1-OG 3.26Å; L104-V172 HydrophobicContact CD1-CG2 4.47Å
105	M	98.6	Very high	97.3	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136.7	171.2	-62.7	-170.9	-68.3	0	0	109.3	V51 L87 T89 I93 S95 A96 T103 W116 M118 P145	V51-M105 HydrophobicContact CG1-SD 3.98Å; L87-M105 HydrophobicContact CD2-CE 3.53Å; L87-M105 HydrophobicContact CD2-SD 3.92Å; T89-M105 HydrophobicContact CG2-CE 4.36Å; I93-M105 HydrophobicContact CD1-CB 4.17Å; I93-M105 HydrophobicContact CG1-CB 4.43Å; I93-M105 HydrophobicContact CG1-SD 4.31Å; I93-M105 HydrophobicContact CG2-CB 3.95Å; I93-M105 HydrophobicContact CG2-CG 4.39Å; S95-M105 WeakPolarHBondContact O-CA 3.41Å; A96-M105 HydrophobicContact CB-CG 4.36Å; T103-M105 HydrophobicContact CG2-CG 4.31Å; M105-W116 PolarHBondContact N-O 2.88Å; M105-W116 PolarHBondContact O-N 2.97Å; M105-M118 HydrophobicContact CE-CE 3.72Å; M105-M118 HydrophobicContact CE-SD 3.82Å; M105-M118 HydrophobicContact CG-CE 4.25Å; M105-M118 HydrophobicContact SD-CE 4.02Å; M105-P145 HydrophobicContact CE-CB 3.82Å; M105-P145 HydrophobicContact CE-CG 3.86Å
106	A	98.3	Very high	97.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	145.5	178	0	0	0	0	0	111.7	I93 S94 S95 K114 L115 V160 V163	I93-A106 WeakPolarHBondContact CG2-O 3.29Å; S94-A106 PolarHBondContact N-O 3.25Å; S94-A106 PolarHBondContact OG-O 2.85Å; S95-A106 PolarHBondContact N-O 3.39Å; S95-A106 PolarHBondContact O-N 2.76Å; A106-K114 WeakPolarHBondContact CA-O 3.42Å; A106-L115 HydrophobicContact CB-CD1 4.09Å; A106-V160 HydrophobicContact CB-CB 3.97Å; A106-V160 HydrophobicContact CB-CG1 3.4Å; A106-V163 HydrophobicContact CB-CG1 3.76Å
107	S	97.3	Very high	97.3	Very high	5 Å²	5	24.2 Å²	24.2	4%	0.035	13%	0.133	C	C	.	.			trans	-107.6	141	168.3	-178.3	0	0	0	0	109	Q92 T109 K114	Q92-S107 VanDerWaalsContact O-CB 3.26Å; Q92-S107 WeakPolarHBondContact O-CB 3.37Å; Q92-S107 PolarHBondContact O-OG 2.79Å; S107-T109 PolarHBondContact O-N 3.32Å; S107-T109 VanDerWaalsContact O-N 3.12Å; S107-T109 PolarHBondContact OG-N 2.85Å; S107-K114 PolarHBondContact N-O 2.8Å
108	S	95.1	Very high	97.3	Very high	53 Å²	53	23.7 Å²	23.7	37%	0.371	13%	0.129	S	C	.	.			trans	-75.1	12	171.5	61.6	0	0	0	0	112.7	S94 R159	S94-S108 PolarHBondContact OG-N 2.85Å; S108-R159 WeakPolarHBondContact O-CD 3.48Å; S108-R159 VanDerWaalsContact O-CG 3.29Å; S108-R159 WeakPolarHBondContact O-CG 3.45Å; S108-R159 PolarHBondContact O-NH1 3.08Å
109	T	95.4	Very high	97.3	Very high	29 Å²	29	23.5 Å²	23.5	18%	0.178	13%	0.127	C	C	.	.			trans	-57	153.7	175.4	-171	0	0	0	0	112.9	S107 D111 K114	S107-T109 PolarHBondContact O-N 3.32Å; S107-T109 VanDerWaalsContact O-N 3.12Å; S107-T109 PolarHBondContact OG-N 2.85Å; T109-D111 VanDerWaalsContact C-N 3.34Å; T109-D111 HydrophobicContact CG2-CB 4.02Å; T109-D111 PolarHBondContact OG1-N 2.92Å; T109-D111 VanDerWaalsContact OG1-N 3.12Å; T109-K114 HydrophobicContact CG2-CB 3.82Å
110	K	94.5	Very high	97.2	Very high	106 Å²	106	25.2 Å²	25.2	46%	0.461	14%	0.136	S	C	.	.	S	Bend	trans	-87.4	-6.3	169.5	-80.6	-175.6	172.4	-175.8	0	112.5	Q156 R159	K110-Q156 CarbonylContact O-C 3.21Å; K110-Q156 VanDerWaalsContact O-CA 3.24Å; K110-Q156 WeakPolarHBondContact O-CA 3.3Å; K110-R159 VanDerWaalsContact CE-NH2 3.34Å; K110-R159 HydrophobicContact CG-CG 4.24Å
111	D	94	Very high	97.3	Very high	82 Å²	82	23.4 Å²	23.4	44%	0.439	13%	0.129	S	C	.	.	S	Bend	trans	-62	154.8	173	-167.4	15.5	0	0	0	111.3	T109 T113 K114	T109-D111 VanDerWaalsContact C-N 3.34Å; T109-D111 HydrophobicContact CG2-CB 4.02Å; T109-D111 PolarHBondContact OG1-N 2.92Å; T109-D111 VanDerWaalsContact OG1-N 3.12Å; D111-T113 VanDerWaalsContact C-N 3.32Å; D111-T113 PolarHBondContact O-N 2.86Å; D111-K114 WeakPolarHBondContact O-CE 3.46Å; D111-K114 PolarHBondContact O-NZ 3.18Å
112	V	94.1	Very high	97.2	Very high	78 Å²	78	27.6 Å²	27.6	47%	0.473	15%	0.146	S	C	.	.	S	Bend	trans	-59.2	-44.7	-179.2	179.4	0	0	0	0	110.3	K114 P155 Q156	V112-K114 WeakPolarHBondContact O-CE 3.48Å; V112-K114 PolarHBondContact O-N 3Å; V112-P155 HydrophobicContact CG1-CB 4.3Å; V112-P155 HydrophobicContact CG2-CB 4.46Å; V112-Q156 HydrophobicContact CG2-CG 3.92Å
113	T	94.8	Very high	97.2	Very high	57 Å²	57	29.3 Å²	29.3	35%	0.35	16%	0.155	S	C	.	.			trans	-85	105.2	176.2	-57.4	0	0	0	0	110.2	D111 W116 P147	D111-T113 VanDerWaalsContact C-N 3.32Å; D111-T113 PolarHBondContact O-N 2.86Å; T113-W116 HydrophobicContact CG2-CZ2 3.67Å; T113-W116 WeakPolarHBondContact O-CH2 3.4Å; T113-P147 HydrophobicContact CG2-CB 3.79Å; T113-P147 HydrophobicContact CG2-CG 3.92Å
114	K	96.8	Very high	97.2	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.017	16%	0.156	C	C	.	.			trans	-134.1	-0.5	-173.1	66.9	-170.6	86.6	-121.3	0	114.4	A106 S107 T109 D111 V112 W116 L152 P155 T158 V160	A106-K114 WeakPolarHBondContact CA-O 3.42Å; S107-K114 PolarHBondContact N-O 2.8Å; T109-K114 HydrophobicContact CG2-CB 3.82Å; D111-K114 WeakPolarHBondContact O-CE 3.46Å; D111-K114 PolarHBondContact O-NZ 3.18Å; V112-K114 WeakPolarHBondContact O-CE 3.48Å; V112-K114 PolarHBondContact O-N 3Å; K114-W116 WeakPolarHBondContact O-CZ3 3.33Å; K114-L152 HydrophobicContact CD-CD1 3.95Å; K114-P155 WeakPolarHBondContact CE-O 3.32Å; K114-P155 PolarHBondContact NZ-O 3.39Å; K114-T158 PolarHBondContact NZ-O 3.26Å; K114-V160 HydrophobicContact CD-CG2 3.8Å; K114-V160 HydrophobicContact CG-CG2 3.79Å
115	L	98.3	Very high	97.1	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	132.4	-177.7	-177.5	67	0	0	0	109	L104 A106 P147 V148 L150 V163 V172 M182	L104-L115 HydrophobicContact CB-CD1 4.49Å; L104-L115 HydrophobicContact CD2-CD1 4.33Å; A106-L115 HydrophobicContact CB-CD1 4.09Å; L115-P147 WeakPolarHBondContact O-CA 3.38Å; L115-V148 HydrophobicContact CB-CB 4.26Å; L115-V148 HydrophobicContact CD2-CB 3.7Å; L115-V148 HydrophobicContact CD2-CG1 3.78Å; L115-V148 HydrophobicContact CD2-CG2 4.34Å; L115-V148 HydrophobicContact CG-CB 3.81Å; L115-V148 HydrophobicContact CG-CG1 4.44Å; L115-V148 HydrophobicContact CG-CG2 4.15Å; L115-V148 PolarHBondContact O-N 2.91Å; L115-L150 HydrophobicContact CB-CD1 4.35Å; L115-L150 HydrophobicContact CD2-CD1 4.01Å; L115-L150 HydrophobicContact CD2-CD2 3.78Å; L115-L150 HydrophobicContact CD2-CG 3.97Å; L115-V163 HydrophobicContact CD1-CG1 3.57Å; L115-V172 HydrophobicContact CD2-CG1 4.25Å; L115-V172 HydrophobicContact CD2-CG2 3.71Å; L115-M182 HydrophobicContact CD2-CE 4.42Å
116	W	98.5	Very high	97.1	Very high	33 Å²	33	29.4 Å²	29.4	13%	0.125	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145	176.5	-60.3	-99.4	0	0	0	110	E91 I93 L104 M105 T113 K114 P145 S146	E91-W116 HydrophobicContact CB-CH2 3.7Å; E91-W116 HydrophobicContact CB-CZ2 4.15Å; E91-W116 HydrophobicContact CB-CZ3 4.37Å; E91-W116 HydrophobicContact CG-CH2 3.61Å; E91-W116 HydrophobicContact CG-CZ2 3.77Å; I93-W116 HydrophobicContact CD1-CE3 4.05Å; I93-W116 HydrophobicContact CD1-CZ3 4.03Å; L104-W116 WeakPolarHBondContact CA-O 3.24Å; M105-W116 PolarHBondContact N-O 2.88Å; M105-W116 PolarHBondContact O-N 2.97Å; T113-W116 HydrophobicContact CG2-CZ2 3.67Å; T113-W116 WeakPolarHBondContact O-CH2 3.4Å; K114-W116 WeakPolarHBondContact O-CZ3 3.33Å; W116-P145 HydrophobicContact CB-CB 4.11Å; W116-S146 CarbonylContact C-O 2.95Å; W116-S146 VanDerWaalsContact CA-O 3.24Å; W116-S146 WeakPolarHBondContact CA-O 3.33Å
117	G	98.3	Very high	97.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	145	177.3	0	0	0	0	0	111.8	T103 S146	T103-G117 WeakPolarHBondContact O-CA 3.18Å; G117-S146 PolarHBondContact N-O 3.24Å; G117-S146 PolarHBondContact O-N 3.49Å
118	M	98.4	Very high	97	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	156.9	170.5	62.6	-86.8	-163.2	0	0	111	A61 L87 F102 T103 M105 L126 P145	A61-M118 WeakPolarHBondContact O-CE 3.31Å; A61-M118 VanDerWaalsContact O-CG 3.26Å; A61-M118 WeakPolarHBondContact O-CG 3.44Å; L87-M118 HydrophobicContact CD2-CE 3.94Å; F102-M118 CarbonylContact C-O 3.5Å; F102-M118 WeakPolarHBondContact CA-O 3.41Å; F102-M118 WeakPolarHBondContact CB-O 3.15Å; T103-M118 HydrophobicContact CG2-CE 3.51Å; T103-M118 HydrophobicContact CG2-SD 4.22Å; T103-M118 PolarHBondContact N-O 3.18Å; T103-M118 PolarHBondContact O-N 2.9Å; M105-M118 HydrophobicContact CE-CE 3.72Å; M105-M118 HydrophobicContact CE-SD 3.82Å; M105-M118 HydrophobicContact CG-CE 4.25Å; M105-M118 HydrophobicContact SD-CE 4.02Å; M118-L126 VanDerWaalsContact C-CD1 3.46Å; M118-P145 HydrophobicContact SD-CB 4.37Å; M118-P145 HydrophobicContact SD-CG 4.29Å
119	G	98.5	Very high	97	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	104.7	-152.9	-179.8	0	0	0	0	0	114.7	T59 G60 Y141 V142	T59-G119 CarbonylContact O-C 3.06Å; T59-G119 WeakPolarHBondContact O-CA 3.35Å; G60-G119 VanDerWaalsContact C-CA 3.47Å; G60-G119 PolarHBondContact O-N 3.36Å; G119-Y141 WeakPolarHBondContact O-CA 3.27Å; G119-V142 PolarHBondContact N-O 3.44Å; G119-V142 PolarHBondContact O-N 2.69Å
120	L	98.4	Very high	96.6	Very high	36 Å²	36	36.5 Å²	36.5	19%	0.188	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	134	178.5	179.2	67.8	0	0	0	111.9	G101 F102 K122 Q125 Y141	G101-L120 PolarHBondContact O-N 2.72Å; F102-L120 HydrophobicContact CB-CB 4.34Å; F102-L120 WeakPolarHBondContact CB-O 3.27Å; L120-K122 HydrophobicContact CD1-CB 4.21Å; L120-K122 HydrophobicContact CD1-CD 4.07Å; L120-K122 HydrophobicContact CD1-CG 3.81Å; L120-Q125 WeakPolarHBondContact O-CG 3.15Å; L120-Y141 HydrophobicContact CD1-CD1 4.22Å; L120-Y141 HydrophobicContact CD1-CE1 3.66Å
121	N	98.3	Very high	96.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.157	C	C	.	.			trans	-141.3	25.7	-178.8	-161.2	38.5	0	0	0	114.3	D123 S124 Q125 L126 G127 Q129 S138 Y139 D140 V142	N121-D123 PolarHBondContact O-N 3.15Å; N121-S124 PolarHBondContact O-N 2.93Å; N121-S124 VanDerWaalsContact OD1-C 3.23Å; N121-S124 WeakPolarHBondContact OD1-CA 3.33Å; N121-Q125 VanDerWaalsContact CA-OE1 3.25Å; N121-Q125 PolarHBondContact OD1-N 2.81Å; N121-L126 HydrophobicContact CB-CB 4.43Å; N121-L126 HydrophobicContact CB-CD1 4.04Å; N121-L126 HydrophobicContact CB-CG 4.25Å; N121-L126 WeakPolarHBondContact OD1-CA 3.31Å; N121-L126 VanDerWaalsContact OD1-CB 3.27Å; N121-L126 WeakPolarHBondContact OD1-CB 3.44Å; N121-L126 PolarHBondContact OD1-N 3.37Å; N121-G127 PolarHBondContact ND2-O 3.05Å; N121-Q129 WeakPolarHBondContact ND2-CG 3.39Å; N121-S138 PolarHBondContact ND2-OG 2.86Å; N121-Y139 WeakPolarHBondContact CB-O 3.38Å; N121-D140 PolarHBondContact N-O 3.38Å; N121-V142 HydrophobicContact CB-CG2 4.1Å
122	K	97.6	Very high	95.7	Very high	95 Å²	95	36.6 Å²	36.6	41%	0.413	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-22.6	-178.4	-74.9	-172.9	176.4	-173.3	0	114.3	L120 D140 S201	L120-K122 HydrophobicContact CD1-CB 4.21Å; L120-K122 HydrophobicContact CD1-CD 4.07Å; L120-K122 HydrophobicContact CD1-CG 3.81Å; K122-D140 HydrophobicContact CG-CB 4.01Å; K122-S201 WeakPolarHBondContact O-CA 3.29Å; K122-S201 WeakPolarHBondContact O-CB 3.41Å; K122-S201 PolarHBondContact O-N 3.01Å
123	D	98.1	Very high	95	Very high	35 Å²	35	41.4 Å²	41.4	19%	0.187	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	10.3	175.9	-64.7	-91	0	0	0	111.9	N121 Q125 A168 G183 N184 Y200	N121-D123 PolarHBondContact O-N 3.15Å; D123-Q125 PolarHBondContact O-N 3.31Å; D123-A168 HydrophobicContact CB-CB 4.3Å; D123-G183 CarbonylContact O-C 3.56Å; D123-G183 WeakPolarHBondContact O-CA 3.16Å; D123-N184 HydrophobicContact CB-CB 3.97Å; D123-N184 PolarHBondContact OD1-ND2 2.85Å; D123-Y200 CarbonylContact C-O 3.5Å
124	S	98.3	Very high	94.4	Very high	4 Å²	4	41.4 Å²	41.4	3%	0.028	19%	0.189	C	C	.	.			trans	59.3	32.6	-172.4	-47	0	0	0	0	113.5	N121 L126 G127 G183 Y200 G202 S203	N121-S124 PolarHBondContact O-N 2.93Å; N121-S124 VanDerWaalsContact OD1-C 3.23Å; N121-S124 WeakPolarHBondContact OD1-CA 3.33Å; S124-L126 PolarHBondContact O-N 3.21Å; S124-G127 WeakPolarHBondContact O-CA 3.16Å; S124-G127 PolarHBondContact O-N 2.83Å; S124-G183 PolarHBondContact O-N 3.13Å; S124-Y200 WeakPolarHBondContact CB-O 3.49Å; S124-Y200 PolarHBondContact OG-O 2.86Å; S124-G202 PolarHBondContact OG-N 2.84Å; S124-S203 PolarHBondContact OG-N 2.83Å
125	Q	98.4	Very high	93.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-13.7	174.1	56.5	-97	72.4	0	0	113.8	F102 L120 N121 D123 S170	F102-Q125 HydrophobicContact CD1-CG 3.9Å; F102-Q125 HydrophobicContact CD2-CB 4.5Å; F102-Q125 HydrophobicContact CD2-CG 3.95Å; F102-Q125 HydrophobicContact CE1-CB 4.39Å; F102-Q125 HydrophobicContact CE1-CG 3.89Å; F102-Q125 HydrophobicContact CE2-CB 4.01Å; F102-Q125 HydrophobicContact CE2-CG 3.91Å; F102-Q125 HydrophobicContact CG-CG 3.93Å; F102-Q125 HydrophobicContact CZ-CB 3.95Å; F102-Q125 HydrophobicContact CZ-CG 3.88Å; L120-Q125 WeakPolarHBondContact O-CG 3.15Å; N121-Q125 VanDerWaalsContact CA-OE1 3.25Å; N121-Q125 PolarHBondContact OD1-N 2.81Å; D123-Q125 PolarHBondContact O-N 3.31Å; Q125-S170 WeakPolarHBondContact O-CB 3.35Å; Q125-S170 PolarHBondContact O-OG 2.83Å
126	L	98.2	Very high	92.6	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	15.1	170	-49.7	178.4	0	0	0	111.7	F102 L104 M118 N121 S124 Q129 V142 V148	F102-L126 HydrophobicContact CB-CD2 4.19Å; F102-L126 HydrophobicContact CD2-CD2 3.59Å; F102-L126 HydrophobicContact CE2-CD2 4.42Å; F102-L126 HydrophobicContact CG-CD2 4.28Å; L104-L126 HydrophobicContact CD2-CD2 3.77Å; L104-L126 HydrophobicContact CG-CD2 4.31Å; M118-L126 VanDerWaalsContact C-CD1 3.46Å; N121-L126 HydrophobicContact CB-CB 4.43Å; N121-L126 HydrophobicContact CB-CD1 4.04Å; N121-L126 HydrophobicContact CB-CG 4.25Å; N121-L126 WeakPolarHBondContact OD1-CA 3.31Å; N121-L126 VanDerWaalsContact OD1-CB 3.27Å; N121-L126 WeakPolarHBondContact OD1-CB 3.44Å; N121-L126 PolarHBondContact OD1-N 3.37Å; S124-L126 PolarHBondContact O-N 3.21Å; L126-Q129 HydrophobicContact CB-CG 4.39Å; L126-Q129 PolarHBondContact O-NE2 3.24Å; L126-V142 HydrophobicContact CD1-CB 4.03Å; L126-V142 HydrophobicContact CD1-CG2 3.88Å; L126-V148 WeakPolarHBondContact O-CG2 3.32Å
127	G	96.8	Very high	91.9	Very high	3 Å²	3	62 Å²	62	3%	0.031	27%	0.271	C	S	.	.			trans	69.4	-171.3	-170.1	0	0	0	0	0	113	N121 S124 Q129 M182	N121-G127 PolarHBondContact ND2-O 3.05Å; S124-G127 WeakPolarHBondContact O-CA 3.16Å; S124-G127 PolarHBondContact O-N 2.83Å; G127-Q129 PolarHBondContact O-N 2.73Å; G127-M182 PolarHBondContact N-SD 3.29Å; G127-M182 VanDerWaalsContact N-SD 3.37Å
128	F	95.8	Very high	91.4	Very high	43 Å²	43	62.8 Å²	62.8	19%	0.189	28%	0.276	C	S	.	.			trans	-71.2	122.3	176.9	-176.5	-97.6	0	0	0	111.3	R130 R135 G202 H204	F128-R130 HydrophobicContact CD1-CB 4.38Å; F128-R130 HydrophobicContact CE1-CB 3.74Å; F128-R130 HydrophobicContact CE1-CG 4.21Å; F128-R135 WeakPolarHBondContact CZ-O 3.3Å; F128-G202 VanDerWaalsContact CD2-O 3.31Å; F128-G202 WeakPolarHBondContact CD2-O 3.37Å; F128-H204 AromaticContact CD1-CE1 3.24Å; F128-H204 WeakPolarHBondContact CD1-CE1 3.44Å; F128-H204 AromaticContact CD1-ND1 3.93Å; F128-H204 AromaticContact CD1-NE2 3.82Å; F128-H204 AromaticContact CD2-CD2 3.8Å; F128-H204 AromaticContact CD2-CE1 3.57Å; F128-H204 AromaticContact CD2-NE2 3.36Å; F128-H204 WeakPolarHBondContact CD2-NE2 3.38Å; F128-H204 AromaticContact CE1-CE1 3.6Å; F128-H204 AromaticContact CE1-NE2 3.89Å; F128-H204 AromaticContact CE2-CE1 3.92Å; F128-H204 AromaticContact CE2-NE2 3.46Å; F128-H204 WeakPolarHBondContact CE2-NE2 3.47Å; F128-H204 AromaticContact CG-CE1 3.21Å; F128-H204 WeakPolarHBondContact CG-CE1 3.3Å; F128-H204 AromaticContact CG-ND1 3.61Å; F128-H204 AromaticContact CG-NE2 3.54Å; F128-H204 AromaticContact CZ-CE1 3.93Å; F128-H204 AromaticContact CZ-NE2 3.73Å
129	Q	94.6	Very high	91.1	Very high	14 Å²	14	67 Å²	67	7%	0.065	29%	0.293	C	S	.	.			trans	-121.1	88.2	-175.4	-66.7	-66.5	-20.1	0	0	110.4	N121 L126 G127 T131 S138 Y139 V142 S146 P147	N121-Q129 WeakPolarHBondContact ND2-CG 3.39Å; L126-Q129 HydrophobicContact CB-CG 4.39Å; L126-Q129 PolarHBondContact O-NE2 3.24Å; G127-Q129 PolarHBondContact O-N 2.73Å; Q129-T131 PolarHBondContact O-N 3.16Å; Q129-S138 PolarHBondContact N-OG 2.84Å; Q129-S138 CarbonylContact O-C 3.56Å; Q129-S138 WeakPolarHBondContact O-CA 3.33Å; Q129-S138 PolarHBondContact O-OG 2.94Å; Q129-Y139 PolarHBondContact O-N 2.89Å; Q129-V142 HydrophobicContact CB-CG2 3.95Å; Q129-V142 HydrophobicContact CG-CG2 3.84Å; Q129-S146 VanDerWaalsContact OE1-CB 3.23Å; Q129-P147 PolarHBondContact NE2-O 2.91Å
130	R	88.8	Confident	90.9	Very high	176 Å²	176	70.3 Å²	70.3	66%	0.664	31%	0.311	S	S	*	.	B	Isolated β-bridge	trans	-55.3	129.3	-169.7	-172	176.4	65.7	-178.5	-0.2	113.4	F128 Y139	F128-R130 HydrophobicContact CD1-CB 4.38Å; F128-R130 HydrophobicContact CE1-CB 3.74Å; F128-R130 HydrophobicContact CE1-CG 4.21Å; R130-Y139 WeakPolarHBondContact O-CE2 3.47Å
131	T	85.4	Confident	90.8	Very high	21 Å²	21	73.3 Å²	73.3	13%	0.129	32%	0.32	C	S	.	.			trans	-74.7	151.2	171.2	70.3	0	0	0	0	113.1	Q129 H133 N134 K137 Y139	Q129-T131 PolarHBondContact O-N 3.16Å; T131-H133 VanDerWaalsContact C-N 3.31Å; T131-H133 PolarHBondContact O-N 2.9Å; T131-N134 PolarHBondContact OG1-N 2.96Å; T131-N134 VanDerWaalsContact OG1-N 3.14Å; T131-N134 PolarHBondContact OG1-O 3.45Å; T131-K137 HydrophobicContact CG2-CB 3.99Å; T131-K137 WeakPolarHBondContact CG2-O 3.25Å; T131-K137 PolarHBondContact N-O 2.98Å; T131-K137 PolarHBondContact OG1-O 3.36Å; T131-Y139 HydrophobicContact CG2-CD1 3.86Å; T131-Y139 HydrophobicContact CG2-CD2 4.17Å; T131-Y139 HydrophobicContact CG2-CE1 3.89Å; T131-Y139 HydrophobicContact CG2-CE2 4.21Å; T131-Y139 HydrophobicContact CG2-CG 3.99Å
132	Q	82.8	Confident	90.7	Very high	169 Å²	169	73.6 Å²	73.6	79%	0.79	32%	0.322	S	S	*	.	S	Bend	trans	-62.3	-35.9	176.5	-69.5	-179	5.6	0	0	113.3	Y139	Q132-Y139 PolarHBondContact N-OH 2.91Å
133	H	80.4	Confident	90.6	Very high	179 Å²	179	71.2 Å²	71.2	83%	0.829	31%	0.313	S	S	*	.	S	Bend	trans	-91.4	-20.7	-173.4	-60.5	-59	0	0	0	114.1	T131	T131-H133 VanDerWaalsContact C-N 3.31Å; T131-H133 PolarHBondContact O-N 2.9Å
134	N	82	Confident	90.5	Very high	57 Å²	57	75 Å²	75	31%	0.305	33%	0.33	S	S	.	.			trans	-145.2	117.5	-177.5	-173.3	-22.1	0	0	0	111.6	T131 Y136 K137	T131-N134 PolarHBondContact OG1-N 2.96Å; T131-N134 VanDerWaalsContact OG1-N 3.14Å; T131-N134 PolarHBondContact OG1-O 3.45Å; N134-Y136 PolarHBondContact O-N 2.85Å; N134-Y136 VanDerWaalsContact O-N 3.11Å; N134-Y136 WeakPolarHBondContact OD1-CB 3.48Å; N134-Y136 PolarHBondContact OD1-N 3.32Å; N134-K137 HydrophobicContact CB-CB 4.07Å; N134-K137 HydrophobicContact CB-CD 4.22Å; N134-K137 HydrophobicContact CB-CG 4.08Å; N134-K137 PolarHBondContact O-N 2.9Å; N134-K137 VanDerWaalsContact O-N 3.14Å
135	R	79.6	Confident	90.5	Very high	175 Å²	175	76.6 Å²	76.6	66%	0.66	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-17.3	-179.6	68.9	-176.7	176.6	-170.1	-1.1	114.7	F128	F128-R135 WeakPolarHBondContact CZ-O 3.3Å
136	Y	78.1	Confident	90.4	Very high	162 Å²	162	77.6 Å²	77.6	64%	0.635	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-3.8	-179.2	-55	-71.4	0	0	0	113.5	N134	N134-Y136 PolarHBondContact O-N 2.85Å; N134-Y136 VanDerWaalsContact O-N 3.11Å; N134-Y136 WeakPolarHBondContact OD1-CB 3.48Å; N134-Y136 PolarHBondContact OD1-N 3.32Å
137	K	83.8	Confident	90.3	Very high	132 Å²	132	81 Å²	81	57%	0.574	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-101.9	139	175.3	-70.4	-173.1	175.9	-171.4	0	109.9	T131 N134	T131-K137 HydrophobicContact CG2-CB 3.99Å; T131-K137 WeakPolarHBondContact CG2-O 3.25Å; T131-K137 PolarHBondContact N-O 2.98Å; T131-K137 PolarHBondContact OG1-O 3.36Å; N134-K137 HydrophobicContact CB-CB 4.07Å; N134-K137 HydrophobicContact CB-CD 4.22Å; N134-K137 HydrophobicContact CB-CG 4.08Å; N134-K137 PolarHBondContact O-N 2.9Å; N134-K137 VanDerWaalsContact O-N 3.14Å
138	S	88.1	Confident	90.3	Very high	17 Å²	17	81.4 Å²	81.4	12%	0.119	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	-99.2	150.4	170.9	-173.8	0	0	0	0	110.3	N121 Q129	N121-S138 PolarHBondContact ND2-OG 2.86Å; Q129-S138 PolarHBondContact N-OG 2.84Å; Q129-S138 CarbonylContact O-C 3.56Å; Q129-S138 WeakPolarHBondContact O-CA 3.33Å; Q129-S138 PolarHBondContact O-OG 2.94Å
139	Y	90.6	Very high	90.3	Very high	89 Å²	89	83.6 Å²	83.6	35%	0.349	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-70.3	132.8	170.3	-73.9	-68.8	0	0	0	110.8	N121 Q129 R130 T131 Q132 Y141	N121-Y139 WeakPolarHBondContact CB-O 3.38Å; Q129-Y139 PolarHBondContact O-N 2.89Å; R130-Y139 WeakPolarHBondContact O-CE2 3.47Å; T131-Y139 HydrophobicContact CG2-CD1 3.86Å; T131-Y139 HydrophobicContact CG2-CD2 4.17Å; T131-Y139 HydrophobicContact CG2-CE1 3.89Å; T131-Y139 HydrophobicContact CG2-CE2 4.21Å; T131-Y139 HydrophobicContact CG2-CG 3.99Å; Q132-Y139 PolarHBondContact N-OH 2.91Å; Y139-Y141 VanDerWaalsContact C-N 3.31Å
140	D	94.7	Very high	90.4	Very high	69 Å²	69	84.2 Å²	84.2	37%	0.369	40%	0.401	S	S	.	.	S	Bend	trans	-71.1	-28	170.1	-78.7	-2.2	0	0	0	112.6	N121 K122	N121-D140 PolarHBondContact N-O 3.38Å; K122-D140 HydrophobicContact CG-CB 4.01Å
141	Y	96.3	Very high	90.8	Very high	100 Å²	100	79.4 Å²	79.4	39%	0.392	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	119.6	178.9	-60	-80.9	0	0	0	109	T59 G119 L120 Y139	T59-Y141 HydrophobicContact CG2-CE1 4.29Å; T59-Y141 WeakPolarHBondContact O-CD1 3.43Å; G119-Y141 WeakPolarHBondContact O-CA 3.27Å; L120-Y141 HydrophobicContact CD1-CD1 4.22Å; L120-Y141 HydrophobicContact CD1-CE1 3.66Å; Y139-Y141 VanDerWaalsContact C-N 3.31Å
142	V	96.9	Very high	91.4	Very high	5 Å²	5	79.5 Å²	79.5	3%	0.03	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	111.2	-179.5	-174.5	0	0	0	0	107.8	G119 N121 L126 Q129 E144 S146	G119-V142 PolarHBondContact N-O 3.44Å; G119-V142 PolarHBondContact O-N 2.69Å; N121-V142 HydrophobicContact CB-CG2 4.1Å; L126-V142 HydrophobicContact CD1-CB 4.03Å; L126-V142 HydrophobicContact CD1-CG2 3.88Å; Q129-V142 HydrophobicContact CB-CG2 3.95Å; Q129-V142 HydrophobicContact CG-CG2 3.84Å; V142-E144 WeakPolarHBondContact CG1-O 3.2Å; V142-S146 WeakPolarHBondContact CG1-OG 3.36Å
143	L	95.8	Very high	92.1	Very high	45 Å²	45	75.7 Å²	75.7	24%	0.236	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-15.4	-166.7	-57.9	-175.5	0	0	0	114.7	G63 I64 P65 V68 V69	G63-L143 CarbonylContact C-O 3.5Å; G63-L143 VanDerWaalsContact CA-O 3.29Å; G63-L143 WeakPolarHBondContact CA-O 3.49Å; I64-L143 PolarHBondContact N-O 3.32Å; P65-L143 HydrophobicContact CB-CB 4.44Å; P65-L143 WeakPolarHBondContact CD-O 3.36Å; P65-L143 HydrophobicContact CG-CB 4.38Å; V68-L143 HydrophobicContact CB-CD1 4.38Å; V68-L143 HydrophobicContact CB-CD2 4.31Å; V68-L143 HydrophobicContact CG1-CD1 4.48Å; V68-L143 HydrophobicContact CG1-CD2 4.33Å; V68-L143 HydrophobicContact CG2-CD2 4.15Å; V69-L143 HydrophobicContact CG2-CD1 3.93Å
144	E	95.5	Very high	92.9	Very high	116 Å²	116	71.4 Å²	71.4	54%	0.542	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	160.3	178.2	59.3	-170.4	170.3	0	0	110.2	P65 V142 S146	P65-E144 HydrophobicContact CG-CB 3.73Å; V142-E144 WeakPolarHBondContact CG1-O 3.2Å; E144-S146 PolarHBondContact O-N 3.06Å; E144-S146 PolarHBondContact O-OG 2.87Å
145	P	97.3	Very high	93.6	Very high	36 Å²	36	70.9 Å²	70.9	23%	0.234	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	101	176.3	-21.6	34.7	0	0	0	110.9	G63 L87 M105 W116 M118	G63-P145 WeakPolarHBondContact O-CD 3.33Å; L87-P145 HydrophobicContact CD1-CG 4Å; L87-P145 HydrophobicContact CD2-CG 3.98Å; L87-P145 HydrophobicContact CG-CG 4.38Å; M105-P145 HydrophobicContact CE-CB 3.82Å; M105-P145 HydrophobicContact CE-CG 3.86Å; W116-P145 HydrophobicContact CB-CB 4.11Å; M118-P145 HydrophobicContact SD-CB 4.37Å; M118-P145 HydrophobicContact SD-CG 4.29Å
146	S	97	Very high	94.4	Very high	22 Å²	22	69.4 Å²	69.4	15%	0.154	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	136	-179.2	-68.3	0	0	0	0	110.7	W116 G117 Q129 V142 E144 V148	W116-S146 CarbonylContact C-O 2.95Å; W116-S146 VanDerWaalsContact CA-O 3.24Å; W116-S146 WeakPolarHBondContact CA-O 3.33Å; G117-S146 PolarHBondContact N-O 3.24Å; G117-S146 PolarHBondContact O-N 3.49Å; Q129-S146 VanDerWaalsContact OE1-CB 3.23Å; V142-S146 WeakPolarHBondContact CG1-OG 3.36Å; E144-S146 PolarHBondContact O-N 3.06Å; E144-S146 PolarHBondContact O-OG 2.87Å; S146-V148 PolarHBondContact O-N 3.2Å
147	P	97.1	Very high	95.3	Very high	72 Å²	72	67 Å²	67	47%	0.468	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.6	138.7	174.1	-29.8	37.5	0	0	0	113	T113 L115 Q129	T113-P147 HydrophobicContact CG2-CB 3.79Å; T113-P147 HydrophobicContact CG2-CG 3.92Å; L115-P147 WeakPolarHBondContact O-CA 3.38Å; Q129-P147 PolarHBondContact NE2-O 2.91Å
148	V	97	Very high	96	Very high	11 Å²	11	60.7 Å²	60.7	7%	0.067	33%	0.332	C	S	.	.			trans	-110.3	114.8	172.6	-175.7	0	0	0	0	108.2	L104 L115 L126 S146 L150 M182	L104-V148 HydrophobicContact CD2-CG2 4.31Å; L115-V148 HydrophobicContact CB-CB 4.26Å; L115-V148 HydrophobicContact CD2-CB 3.7Å; L115-V148 HydrophobicContact CD2-CG1 3.78Å; L115-V148 HydrophobicContact CD2-CG2 4.34Å; L115-V148 HydrophobicContact CG-CB 3.81Å; L115-V148 HydrophobicContact CG-CG1 4.44Å; L115-V148 HydrophobicContact CG-CG2 4.15Å; L115-V148 PolarHBondContact O-N 2.91Å; L126-V148 WeakPolarHBondContact O-CG2 3.32Å; S146-V148 PolarHBondContact O-N 3.2Å; V148-L150 PolarHBondContact O-N 3.41Å; V148-M182 HydrophobicContact CG1-CE 3.92Å; V148-M182 HydrophobicContact CG1-SD 3.85Å
149	A	94.3	Very high	96.4	Very high	89 Å²	89	64.3 Å²	64.3	74%	0.736	34%	0.343	S	S	*	.			trans	-76.2	115.7	-179.5	0	0	0	0	0	110.6	I206	A149-I206 WeakPolarHBondContact O-CD1 3.28Å
150	L	97.1	Very high	96.8	Very high	27 Å²	27	60 Å²	60	14%	0.141	33%	0.326	C	S	.	.			trans	-94	139.2	176.1	-66.5	172.1	0	0	0	110.7	L115 V148 L152 V160 V172 M182 I206	L115-L150 HydrophobicContact CB-CD1 4.35Å; L115-L150 HydrophobicContact CD2-CD1 4.01Å; L115-L150 HydrophobicContact CD2-CD2 3.78Å; L115-L150 HydrophobicContact CD2-CG 3.97Å; V148-L150 PolarHBondContact O-N 3.41Å; L150-L152 HydrophobicContact CB-CD1 4.15Å; L150-L152 HydrophobicContact CB-CD2 3.98Å; L150-L152 HydrophobicContact CB-CG 3.69Å; L150-L152 HydrophobicContact CD1-CD1 4.37Å; L150-L152 HydrophobicContact CD1-CD2 4.39Å; L150-L152 PolarHBondContact O-N 2.8Å; L150-V160 HydrophobicContact CD1-CG2 3.8Å; L150-V172 HydrophobicContact CD1-CG1 3.93Å; L150-V172 HydrophobicContact CD2-CG1 4.39Å; L150-V172 HydrophobicContact CD2-CG2 4.39Å; L150-M182 HydrophobicContact CD2-CE 3.82Å; L150-I206 HydrophobicContact CD2-CG2 4.4Å
151	P	97.4	Very high	97	Very high	75 Å²	75	60.3 Å²	60.3	49%	0.487	33%	0.33	S	S	.	.			trans	-79.6	59.2	176.9	35.1	-36.1	0	0	0	111.1	F180 I206	P151-F180 HydrophobicContact CG-CD1 4.11Å; P151-F180 HydrophobicContact CG-CE1 4.05Å; P151-I206 HydrophobicContact CG-CB 4.01Å; P151-I206 HydrophobicContact CG-CG2 3.98Å
152	L	97.8	Very high	97.1	Very high	22 Å²	22	57.6 Å²	57.6	12%	0.115	32%	0.321	C	S	.	.			trans	-76.7	141.5	-179.8	-56.4	176.9	0	0	0	110.4	K114 L150 P155 T158 T174 E177 F180	K114-L152 HydrophobicContact CD-CD1 3.95Å; L150-L152 HydrophobicContact CB-CD1 4.15Å; L150-L152 HydrophobicContact CB-CD2 3.98Å; L150-L152 HydrophobicContact CB-CG 3.69Å; L150-L152 HydrophobicContact CD1-CD1 4.37Å; L150-L152 HydrophobicContact CD1-CD2 4.39Å; L150-L152 PolarHBondContact O-N 2.8Å; L152-P155 HydrophobicContact CB-CB 4.25Å; L152-P155 HydrophobicContact CD1-CB 4.48Å; L152-T158 HydrophobicContact CD1-CG2 4.4Å; L152-T158 HydrophobicContact CD2-CG2 4.27Å; L152-T174 HydrophobicContact CD2-CG2 4.13Å; L152-E177 WeakPolarHBondContact CA-OE2 3.46Å; L152-F180 HydrophobicContact CD2-CD2 4.34Å; L152-F180 HydrophobicContact CD2-CE1 4.43Å; L152-F180 HydrophobicContact CD2-CE2 3.58Å; L152-F180 HydrophobicContact CD2-CZ 3.63Å
153	S	97.7	Very high	97.2	Very high	90 Å²	90	57.6 Å²	57.6	63%	0.629	32%	0.321	S	S	*	.	S	Bend	trans	-72.4	-34.9	172.7	-59.8	0	0	0	0	111.8	E177	S153-E177 PolarHBondContact N-OE1 2.8Å; S153-E177 PolarHBondContact N-OE2 2.81Å
154	Q	97.1	Very high	97.3	Very high	89 Å²	89	56.1 Å²	56.1	42%	0.416	32%	0.315	S	S	.	.	S	Bend	trans	-128.3	67.7	-178.9	-61.7	-176.7	-7.9	0	0	111.3	Q156 Q157 T158 E177	Q154-Q156 PolarHBondContact O-N 2.84Å; Q154-Q157 HydrophobicContact CB-CB 4.1Å; Q154-Q157 HydrophobicContact CB-CG 4.39Å; Q154-Q157 PolarHBondContact O-N 2.97Å; Q154-T158 PolarHBondContact O-N 2.76Å; Q154-T158 PolarHBondContact O-OG1 3.16Å; Q154-T158 VanDerWaalsContact O-OG1 3.06Å; Q154-E177 PolarHBondContact N-OE1 2.87Å
155	P	96.5	Very high	97.5	Very high	46 Å²	46	50.8 Å²	50.8	30%	0.299	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-21.6	-172	24.4	-34.9	0	0	0	114.3	V112 K114 L152	V112-P155 HydrophobicContact CG1-CB 4.3Å; V112-P155 HydrophobicContact CG2-CB 4.46Å; K114-P155 WeakPolarHBondContact CE-O 3.32Å; K114-P155 PolarHBondContact NZ-O 3.39Å; L152-P155 HydrophobicContact CB-CB 4.25Å; L152-P155 HydrophobicContact CD1-CB 4.48Å
156	Q	96.6	Very high	97.6	Very high	143 Å²	143	49 Å²	49	67%	0.668	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-2.4	177.1	-68.5	-179.1	-35.8	0	0	114.2	K110 V112 Q154	K110-Q156 CarbonylContact O-C 3.21Å; K110-Q156 VanDerWaalsContact O-CA 3.24Å; K110-Q156 WeakPolarHBondContact O-CA 3.3Å; V112-Q156 HydrophobicContact CG2-CG 3.92Å; Q154-Q156 PolarHBondContact O-N 2.84Å
157	Q	96.8	Very high	97.6	Very high	112 Å²	112	51.6 Å²	51.6	52%	0.523	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-43.9	-178.9	-57.3	-170.7	34.2	0	0	111.7	Q154	Q154-Q157 HydrophobicContact CB-CB 4.1Å; Q154-Q157 HydrophobicContact CB-CG 4.39Å; Q154-Q157 PolarHBondContact O-N 2.97Å
158	T	97.9	Very high	97.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.264	C	S	.	.			trans	-65.8	135.1	-179.2	-47.9	0	0	0	0	111.9	K114 L152 Q154 T174 D175 H176 E177	K114-T158 PolarHBondContact NZ-O 3.26Å; L152-T158 HydrophobicContact CD1-CG2 4.4Å; L152-T158 HydrophobicContact CD2-CG2 4.27Å; Q154-T158 PolarHBondContact O-N 2.76Å; Q154-T158 PolarHBondContact O-OG1 3.16Å; Q154-T158 VanDerWaalsContact O-OG1 3.06Å; T158-T174 HydrophobicContact CG2-CG2 3.78Å; T158-D175 WeakPolarHBondContact CG2-OD1 3.37Å; T158-H176 WeakPolarHBondContact CA-CE1 3.48Å; T158-H176 PolarHBondContact OG1-CE1 3.4Å; T158-H176 PolarHBondContact OG1-NE2 2.87Å; T158-E177 HydrophobicContact CG2-CB 4.05Å; T158-E177 HydrophobicContact CG2-CG 3.86Å; T158-E177 PolarHBondContact OG1-OE1 3.13Å
159	R	98.1	Very high	97.8	Very high	92 Å²	92	47.8 Å²	47.8	35%	0.347	26%	0.261	S	S	.	.			trans	-110.7	143	176	-59.9	179.1	-173.2	-98.2	10.9	109.3	S108 K110 T174 D175	S108-R159 WeakPolarHBondContact O-CD 3.48Å; S108-R159 VanDerWaalsContact O-CG 3.29Å; S108-R159 WeakPolarHBondContact O-CG 3.45Å; S108-R159 PolarHBondContact O-NH1 3.08Å; K110-R159 VanDerWaalsContact CE-NH2 3.34Å; K110-R159 HydrophobicContact CG-CG 4.24Å; R159-T174 CarbonylContact O-C 3.54Å; R159-T174 VanDerWaalsContact O-CA 3.23Å; R159-T174 WeakPolarHBondContact O-CA 3.5Å; R159-T174 WeakPolarHBondContact O-CB 3.3Å; R159-D175 PolarHBondContact N-OD1 3.42Å; R159-D175 PolarHBondContact O-N 3.01Å
160	V	98.5	Very high	98	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	125.9	165.8	177.2	0	0	0	0	108	A106 K114 L150 V163 V172	A106-V160 HydrophobicContact CB-CB 3.97Å; A106-V160 HydrophobicContact CB-CG1 3.4Å; K114-V160 HydrophobicContact CD-CG2 3.8Å; K114-V160 HydrophobicContact CG-CG2 3.79Å; L150-V160 HydrophobicContact CD1-CG2 3.8Å; V160-V163 HydrophobicContact CG1-CG1 4.12Å; V160-V172 HydrophobicContact CB-CG1 4.41Å; V160-V172 HydrophobicContact CG1-CG1 3.65Å; V160-V172 HydrophobicContact CG2-CG1 3.8Å
161	V	97.9	Very high	98.1	Very high	75 Å²	75	42.3 Å²	42.3	46%	0.455	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-41.9	-175.6	178.7	0	0	0	0	110.7	L173 D175	V161-L173 PolarHBondContact N-O 3.19Å; V161-D175 HydrophobicContact CG2-CB 3.74Å
162	Q	98.8	Very high	98.2	Very high	43 Å²	43	38.7 Å²	38.7	20%	0.201	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	142.5	-177.2	-163.2	-165.8	-19.5	0	0	110.8	L173 V219	Q162-L173 HydrophobicContact CB-CB 4.06Å; Q162-L173 HydrophobicContact CB-CD2 4.12Å; Q162-L173 PolarHBondContact N-O 3.13Å; Q162-L173 PolarHBondContact O-N 3.08Å; Q162-V219 HydrophobicContact CB-CG2 4.42Å; Q162-V219 HydrophobicContact CG-CG2 4.33Å; Q162-V219 PolarHBondContact NE2-O 2.96Å; Q162-V219 VanDerWaalsContact OE1-N 3.12Å
163	V	98.9	Very high	98.2	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.024	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	152.5	165.2	-68.4	0	0	0	0	110.3	S95 A97 L104 A106 L115 V160 L171 V172	S95-V163 PolarHBondContact OG-N 3.04Å; S95-V163 VanDerWaalsContact OG-N 3.12Å; A97-V163 HydrophobicContact CB-CB 4.31Å; A97-V163 HydrophobicContact CB-CG2 3.84Å; L104-V163 HydrophobicContact CB-CB 4.09Å; L104-V163 HydrophobicContact CB-CG1 4.3Å; L104-V163 HydrophobicContact CB-CG2 4.12Å; L104-V163 HydrophobicContact CD1-CB 4.47Å; L104-V163 HydrophobicContact CD1-CG1 4.49Å; A106-V163 HydrophobicContact CB-CG1 3.76Å; L115-V163 HydrophobicContact CD1-CG1 3.57Å; V160-V163 HydrophobicContact CG1-CG1 4.12Å; V163-L171 WeakPolarHBondContact CA-O 3.03Å; V163-V172 HydrophobicContact CG1-CG2 4.46Å
164	S	98.9	Very high	98.3	Very high	15 Å²	15	33.7 Å²	33.7	11%	0.105	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	146.5	172.6	-177.2	0	0	0	0	109.7	S170 L171 C221	S164-S170 CarbonylContact O-C 3.54Å; S164-S170 WeakPolarHBondContact O-CA 3.46Å; S164-L171 PolarHBondContact N-O 3.14Å; S164-L171 PolarHBondContact O-N 2.98Å; S164-C221 VanDerWaalsContact C-SG 3.51Å; S164-C221 PolarHBondContact O-SG 2.96Å; S164-C221 WeakPolarHBondContact OG-CB 3.46Å; S164-C221 PolarHBondContact OG-N 3.01Å; S164-C221 PolarHBondContact OG-SG 3.3Å
165	C	98.9	Very high	98.3	Very high	3 Å²	3	31.7 Å²	31.7	2%	0.02	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	131.1	-175	-63.1	0	0	0	0	110.1	A97 G99 F102	A97-C165 HydrophobicContact CB-CB 4.18Å; G99-C165 VanDerWaalsContact CA-CB 3.48Å; F102-C165 HydrophobicContact CD2-CB 4.44Å; F102-C165 HydrophobicContact CE2-CB 3.55Å; F102-C165 VanDerWaalsContact CE2-SG 3.54Å; F102-C165 HydrophobicContact CZ-CB 3.72Å
166	G	98.6	Very high	98.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.16	C	C	.	.			trans	-102.2	-145.6	174.8	0	0	0	0	0	112.1	G99 Y100 F102 H169 C221 G222	G99-G166 WeakPolarHBondContact CA-O 3.45Å; Y100-G166 PolarHBondContact N-O 2.82Å; F102-G166 WeakPolarHBondContact CE1-O 3.46Å; G166-H169 PolarHBondContact N-O 2.85Å; G166-C221 VanDerWaalsContact N-CB 3.28Å; G166-G222 WeakPolarHBondContact CA-O 3.39Å
167	R	98.8	Very high	98.4	Very high	76 Å²	76	27.4 Å²	27.4	29%	0.287	13%	0.13	S	C	.	.	S	Bend	trans	-65	-49.3	176.8	-173.8	177.2	62.2	72.9	4.9	113	Y100 Q223 D224	Y100-R167 HydrophobicContact CD2-CB 3.99Å; Y100-R167 HydrophobicContact CD2-CG 3.7Å; Y100-R167 HydrophobicContact CE2-CB 4.17Å; Y100-R167 HydrophobicContact CE2-CG 4.12Å; Y100-R167 HydrophobicContact CG-CB 4.17Å; Y100-R167 HydrophobicContact CG-CG 4.17Å; R167-Q223 HydrophobicContact CB-CG 3.97Å; R167-Q223 WeakPolarHBondContact CB-O 3.44Å; R167-Q223 HydrophobicContact CG-CG 4.48Å; R167-Q223 PolarHBondContact N-O 2.88Å; R167-Q223 VanDerWaalsContact N-O 3.08Å; R167-D224 IonicContact CZ-OD1 3.65Å; R167-D224 IonicContact CZ-OD2 2.88Å; R167-D224 IonicContact NE-OD1 2.69Å; R167-D224 PolarHBondContact NE-OD1 3.32Å; R167-D224 IonicContact NE-OD2 3.41Å; R167-D224 PolarHBondContact NE-OD2 3.3Å; R167-D224 VanDerWaalsContact NH2-CG 3.35Å; R167-D224 IonicContact NH2-OD1 3.12Å; R167-D224 PolarHBondContact NH2-OD1 3.49Å; R167-D224 IonicContact NH2-OD2 3.4Å; R167-D224 PolarHBondContact NH2-OD2 2.88Å
168	A	98.7	Very high	98.5	Very high	3 Å²	3	23.1 Å²	23.1	3%	0.025	12%	0.116	C	C	.	.	S	Bend	trans	-147.4	19.4	-175.6	0	0	0	0	0	112.9	D123 G183 N184	D123-A168 HydrophobicContact CB-CB 4.3Å; A168-G183 WeakPolarHBondContact O-CA 3.39Å; A168-N184 HydrophobicContact CB-CB 3.72Å; A168-N184 WeakPolarHBondContact O-CB 3.39Å; A168-N184 PolarHBondContact O-N 3.34Å
169	H	98.9	Very high	98.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	158.7	177.7	76.1	-74.1	0	0	0	110.7	G166 M182 Q189 C221 H225 S226	G166-H169 PolarHBondContact N-O 2.85Å; H169-M182 CarbonylContact C-O 3.58Å; H169-M182 WeakPolarHBondContact CA-O 3.35Å; H169-Q189 HydrophobicContact CB-CG 3.94Å; H169-C221 PolarHBondContact NE2-SG 3.49Å; H169-C221 VanDerWaalsContact NE2-SG 3.39Å; H169-H225 PolarHBondContact CE1-O 3.07Å; H169-H225 PolarHBondContact NE2-O 3.37Å; H169-S226 PolarHBondContact CD2-OG 2.82Å; H169-S226 PolarHBondContact NE2-OG 3.49Å
170	S	98.9	Very high	98.6	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	143.7	-178	-67	0	0	0	0	110.8	F102 L104 Q125 S164 S181 M182	F102-S170 WeakPolarHBondContact CE2-OG 3.42Å; L104-S170 WeakPolarHBondContact CD1-OG 3.26Å; Q125-S170 WeakPolarHBondContact O-CB 3.35Å; Q125-S170 PolarHBondContact O-OG 2.83Å; S164-S170 CarbonylContact O-C 3.54Å; S164-S170 WeakPolarHBondContact O-CA 3.46Å; S170-S181 VanDerWaalsContact O-CA 3.27Å; S170-S181 WeakPolarHBondContact O-CA 3.5Å; S170-M182 PolarHBondContact N-O 2.55Å; S170-M182 PolarHBondContact O-N 2.71Å; S170-M182 VanDerWaalsContact O-N 3.1Å
171	L	98.9	Very high	98.6	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	138.9	170.5	-62.7	179.6	0	0	0	110.3	V163 S164 V179 F180 I209 V219 C221 S226 F228	V163-L171 WeakPolarHBondContact CA-O 3.03Å; S164-L171 PolarHBondContact N-O 3.14Å; S164-L171 PolarHBondContact O-N 2.98Å; L171-V179 HydrophobicContact CB-CG1 4.4Å; L171-V179 HydrophobicContact CD2-CG1 4.27Å; L171-F180 CarbonylContact C-O 3.5Å; L171-F180 WeakPolarHBondContact CA-O 3.49Å; L171-I209 HydrophobicContact CD2-CD1 3.95Å; L171-V219 HydrophobicContact CB-CB 4.21Å; L171-V219 HydrophobicContact CB-CG2 4.16Å; L171-V219 HydrophobicContact CD1-CB 3.89Å; L171-V219 HydrophobicContact CD1-CG1 4.35Å; L171-C221 VanDerWaalsContact CG-SG 3.58Å; L171-S226 WeakPolarHBondContact CD1-OG 3.21Å; L171-F228 HydrophobicContact CD1-CD1 4.42Å; L171-F228 HydrophobicContact CD1-CE1 3.71Å; L171-F228 HydrophobicContact CD1-CZ 4.18Å; L171-F228 HydrophobicContact CD2-CE1 4.05Å; L171-F228 HydrophobicContact CD2-CZ 4.35Å
172	V	98.9	Very high	98.6	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	110	178.4	-175	0	0	0	0	108	L104 L115 L150 V160 V163 V179 F180 M182	L104-V172 HydrophobicContact CD1-CG2 4.47Å; L115-V172 HydrophobicContact CD2-CG1 4.25Å; L115-V172 HydrophobicContact CD2-CG2 3.71Å; L150-V172 HydrophobicContact CD1-CG1 3.93Å; L150-V172 HydrophobicContact CD2-CG1 4.39Å; L150-V172 HydrophobicContact CD2-CG2 4.39Å; V160-V172 HydrophobicContact CB-CG1 4.41Å; V160-V172 HydrophobicContact CG1-CG1 3.65Å; V160-V172 HydrophobicContact CG2-CG1 3.8Å; V163-V172 HydrophobicContact CG1-CG2 4.46Å; V172-V179 WeakPolarHBondContact O-CA 3.1Å; V172-F180 HydrophobicContact CB-CB 4.36Å; V172-F180 PolarHBondContact N-O 2.91Å; V172-F180 PolarHBondContact O-N 2.85Å; V172-M182 HydrophobicContact CG2-CE 4.13Å
173	L	98.9	Very high	98.6	Very high	3 Å²	3	13.7 Å²	13.7	2%	0.016	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.9	176.5	175.8	62.2	0	0	0	109.9	V161 Q162 V179 V216 V217 V219	V161-L173 PolarHBondContact N-O 3.19Å; Q162-L173 HydrophobicContact CB-CB 4.06Å; Q162-L173 HydrophobicContact CB-CD2 4.12Å; Q162-L173 PolarHBondContact N-O 3.13Å; Q162-L173 PolarHBondContact O-N 3.08Å; L173-V179 HydrophobicContact CD1-CG2 3.85Å; L173-V216 HydrophobicContact CD1-CB 4.01Å; L173-V216 HydrophobicContact CD1-CG1 3.95Å; L173-V216 WeakPolarHBondContact CD1-O 3.23Å; L173-V217 VanDerWaalsContact CD2-C 3.5Å; L173-V217 WeakPolarHBondContact CD2-O 3.32Å; L173-V219 HydrophobicContact CB-CG1 4.11Å; L173-V219 HydrophobicContact CB-CG2 4.07Å
174	T	98.8	Very high	98.6	Very high	3 Å²	3	14.1 Å²	14.1	2%	0.018	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	163.4	172	66	0	0	0	0	111.5	L152 T158 R159 E177 G178 F180	L152-T174 HydrophobicContact CD2-CG2 4.13Å; T158-T174 HydrophobicContact CG2-CG2 3.78Å; R159-T174 CarbonylContact O-C 3.54Å; R159-T174 VanDerWaalsContact O-CA 3.23Å; R159-T174 WeakPolarHBondContact O-CA 3.5Å; R159-T174 WeakPolarHBondContact O-CB 3.3Å; T174-E177 VanDerWaalsContact OG1-C 3.26Å; T174-E177 VanDerWaalsContact OG1-CA 3.29Å; T174-E177 WeakPolarHBondContact OG1-CA 3.36Å; T174-E177 WeakPolarHBondContact OG1-CB 3.43Å; T174-E177 PolarHBondContact OG1-N 3.27Å; T174-G178 PolarHBondContact N-O 3.27Å; T174-G178 PolarHBondContact OG1-N 2.9Å; T174-G178 PolarHBondContact OG1-O 3.32Å; T174-F180 HydrophobicContact CG2-CD2 3.97Å; T174-F180 HydrophobicContact CG2-CE2 3.79Å
175	D	97.8	Very high	98.6	Very high	48 Å²	48	13.4 Å²	13.4	26%	0.257	7%	0.071	S	C	.	.	S	Bend	trans	-67	-35.2	179.3	60.7	-30.4	0	0	0	113.6	T158 R159 V161	T158-D175 WeakPolarHBondContact CG2-OD1 3.37Å; R159-D175 PolarHBondContact N-OD1 3.42Å; R159-D175 PolarHBondContact O-N 3.01Å; V161-D175 HydrophobicContact CG2-CB 3.74Å
176	H	96.5	Very high	98.6	Very high	89 Å²	89	15 Å²	15	41%	0.412	8%	0.084	S	C	.	.	S	Bend	trans	-142.6	-13.7	-177.7	61	-98.2	0	0	0	116.2	T158 G178	T158-H176 WeakPolarHBondContact CA-CE1 3.48Å; T158-H176 PolarHBondContact OG1-CE1 3.4Å; T158-H176 PolarHBondContact OG1-NE2 2.87Å; H176-G178 VanDerWaalsContact C-N 3.33Å
177	E	98.1	Very high	98.6	Very high	9 Å²	9	18.6 Å²	18.6	4%	0.042	10%	0.098	C	C	.	.	S	Bend	trans	-86.9	-2.9	177	-71	-158.3	-153.3	0	0	113.5	L152 S153 Q154 T158 T174 F180 R208	L152-E177 WeakPolarHBondContact CA-OE2 3.46Å; S153-E177 PolarHBondContact N-OE1 2.8Å; S153-E177 PolarHBondContact N-OE2 2.81Å; Q154-E177 PolarHBondContact N-OE1 2.87Å; T158-E177 HydrophobicContact CG2-CB 4.05Å; T158-E177 HydrophobicContact CG2-CG 3.86Å; T158-E177 PolarHBondContact OG1-OE1 3.13Å; T174-E177 VanDerWaalsContact OG1-C 3.26Å; T174-E177 VanDerWaalsContact OG1-CA 3.29Å; T174-E177 WeakPolarHBondContact OG1-CA 3.36Å; T174-E177 WeakPolarHBondContact OG1-CB 3.43Å; T174-E177 PolarHBondContact OG1-N 3.27Å; E177-F180 HydrophobicContact CB-CE2 4Å; E177-F180 HydrophobicContact CB-CZ 4.18Å; E177-R208 PolarHBondContact O-NE 2.99Å; E177-R208 PolarHBondContact O-NH2 3.49Å
178	G	98.2	Very high	98.6	Very high	23 Å²	23	15 Å²	15	24%	0.237	9%	0.085	C	C	.	.			trans	88.1	-148.6	-179.5	0	0	0	0	0	112.7	T174 H176	T174-G178 PolarHBondContact N-O 3.27Å; T174-G178 PolarHBondContact OG1-N 2.9Å; T174-G178 PolarHBondContact OG1-O 3.32Å; H176-G178 VanDerWaalsContact C-N 3.33Å
179	V	98.9	Very high	98.6	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135	-173.7	-168.8	0	0	0	0	110.7	L171 V172 L173 I209 F212 V216 V219 F228	L171-V179 HydrophobicContact CB-CG1 4.4Å; L171-V179 HydrophobicContact CD2-CG1 4.27Å; V172-V179 WeakPolarHBondContact O-CA 3.1Å; L173-V179 HydrophobicContact CD1-CG2 3.85Å; V179-I209 HydrophobicContact CB-CB 4.5Å; V179-I209 HydrophobicContact CB-CD1 4.5Å; V179-I209 HydrophobicContact CG1-CD1 4.16Å; V179-I209 PolarHBondContact O-N 2.94Å; V179-F212 HydrophobicContact CG2-CE2 4.34Å; V179-V216 HydrophobicContact CG2-CB 3.76Å; V179-V216 HydrophobicContact CG2-CG1 3.75Å; V179-V216 HydrophobicContact CG2-CG2 3.9Å; V179-V219 HydrophobicContact CG1-CG1 3.91Å; V179-V219 HydrophobicContact CG2-CG1 3.96Å; V179-F228 HydrophobicContact CG1-CD1 4.37Å; V179-F228 HydrophobicContact CG1-CE1 4.06Å; V179-F228 HydrophobicContact CG2-CD1 4.3Å
180	F	98.9	Very high	98.5	Very high	1 Å²	1	15 Å²	15	0%	0.004	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	141.2	171.6	-62	-97.8	0	0	0	109.8	P151 L152 L171 V172 T174 E177 I206 H207 R208	P151-F180 HydrophobicContact CG-CD1 4.11Å; P151-F180 HydrophobicContact CG-CE1 4.05Å; L152-F180 HydrophobicContact CD2-CD2 4.34Å; L152-F180 HydrophobicContact CD2-CE1 4.43Å; L152-F180 HydrophobicContact CD2-CE2 3.58Å; L152-F180 HydrophobicContact CD2-CZ 3.63Å; L171-F180 CarbonylContact C-O 3.5Å; L171-F180 WeakPolarHBondContact CA-O 3.49Å; V172-F180 HydrophobicContact CB-CB 4.36Å; V172-F180 PolarHBondContact N-O 2.91Å; V172-F180 PolarHBondContact O-N 2.85Å; T174-F180 HydrophobicContact CG2-CD2 3.97Å; T174-F180 HydrophobicContact CG2-CE2 3.79Å; E177-F180 HydrophobicContact CB-CE2 4Å; E177-F180 HydrophobicContact CB-CZ 4.18Å; F180-I206 HydrophobicContact CB-CG2 3.92Å; F180-I206 HydrophobicContact CD1-CG2 4.11Å; F180-I206 HydrophobicContact CG-CG2 4.46Å; F180-H207 CarbonylContact C-O 3.58Å; F180-H207 VanDerWaalsContact CA-O 3.26Å; F180-H207 WeakPolarHBondContact CA-O 3.29Å; F180-R208 HydrophobicContact CD1-CB 3.9Å; F180-R208 HydrophobicContact CD1-CG 4.23Å; F180-R208 HydrophobicContact CE1-CB 3.74Å; F180-R208 HydrophobicContact CE1-CG 3.83Å; F180-R208 HydrophobicContact CZ-CB 4.45Å; F180-R208 HydrophobicContact CZ-CG 4.03Å
181	S	98.9	Very high	98.5	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.007	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	149.3	176	56.7	0	0	0	0	111.6	S170 C190 I206 H207	S170-S181 VanDerWaalsContact O-CA 3.27Å; S170-S181 WeakPolarHBondContact O-CA 3.5Å; S181-C190 WeakPolarHBondContact CB-O 3.32Å; S181-C190 WeakPolarHBondContact OG-CB 3.4Å; S181-C190 PolarHBondContact OG-O 3.1Å; S181-I206 CarbonylContact O-C 2.99Å; S181-I206 WeakPolarHBondContact O-CA 3.16Å; S181-H207 PolarHBondContact N-O 3.19Å; S181-H207 PolarHBondContact O-N 3.48Å; S181-H207 PolarHBondContact OG-O 2.88Å
182	M	98.8	Very high	98.5	Very high	2 Å²	2	16.6 Å²	16.6	1%	0.01	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	160	175.4	64.2	-170.8	74.1	0	0	110	L115 G127 V148 L150 H169 S170 V172 I206	L115-M182 HydrophobicContact CD2-CE 4.42Å; G127-M182 PolarHBondContact N-SD 3.29Å; G127-M182 VanDerWaalsContact N-SD 3.37Å; V148-M182 HydrophobicContact CG1-CE 3.92Å; V148-M182 HydrophobicContact CG1-SD 3.85Å; L150-M182 HydrophobicContact CD2-CE 3.82Å; H169-M182 CarbonylContact C-O 3.58Å; H169-M182 WeakPolarHBondContact CA-O 3.35Å; S170-M182 PolarHBondContact N-O 2.55Å; S170-M182 PolarHBondContact O-N 2.71Å; S170-M182 VanDerWaalsContact O-N 3.1Å; V172-M182 HydrophobicContact CG2-CE 4.13Å; M182-I206 HydrophobicContact CB-CG1 4.15Å; M182-I206 HydrophobicContact CE-CD1 3.85Å; M182-I206 HydrophobicContact CE-CG1 4.02Å; M182-I206 HydrophobicContact CE-CG2 4.01Å
183	G	98.6	Very high	98.5	Very high	8 Å²	8	24.6 Å²	24.6	8%	0.082	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	108.2	-157.6	-176.4	0	0	0	0	0	113.6	D123 S124 A168	D123-G183 CarbonylContact O-C 3.56Å; D123-G183 WeakPolarHBondContact O-CA 3.16Å; S124-G183 PolarHBondContact O-N 3.13Å; A168-G183 WeakPolarHBondContact O-CA 3.39Å
184	N	98.7	Very high	98.4	Very high	13 Å²	13	27.2 Å²	27.2	7%	0.07	14%	0.14	C	C	.	.			trans	-62.1	137.9	177.7	-170.4	-86.9	0	0	0	111.6	D123 A168 A186 Q189 C190 Y200	D123-N184 HydrophobicContact CB-CB 3.97Å; D123-N184 PolarHBondContact OD1-ND2 2.85Å; A168-N184 HydrophobicContact CB-CB 3.72Å; A168-N184 WeakPolarHBondContact O-CB 3.39Å; A168-N184 PolarHBondContact O-N 3.34Å; N184-A186 VanDerWaalsContact OD1-CB 3.32Å; N184-A186 WeakPolarHBondContact OD1-CB 3.49Å; N184-A186 PolarHBondContact OD1-N 3.04Å; N184-Q189 VanDerWaalsContact O-CD 3.31Å; N184-Q189 WeakPolarHBondContact O-CG 3.35Å; N184-Q189 PolarHBondContact OD1-NE2 3.02Å; N184-Q189 VanDerWaalsContact OD1-NE2 3.11Å; N184-C190 PolarHBondContact O-SG 2.79Å; N184-Y200 WeakPolarHBondContact ND2-CD2 3.46Å; N184-Y200 WeakPolarHBondContact ND2-CE2 3.26Å
185	N	98.7	Very high	98.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.			trans	-130.1	24.8	175.3	-167.3	59.7	0	0	0	112.6	Y187 G188 Q189 C190 R192 K193 Y200	N185-Y187 PolarHBondContact O-N 2.83Å; N185-G188 PolarHBondContact O-N 3.45Å; N185-G188 WeakPolarHBondContact OD1-CA 3.19Å; N185-Q189 VanDerWaalsContact CA-OE1 3.23Å; N185-Q189 PolarHBondContact OD1-N 3.42Å; N185-C190 HydrophobicContact CB-CB 4.06Å; N185-C190 WeakPolarHBondContact OD1-CA 3.26Å; N185-C190 VanDerWaalsContact OD1-CB 3.26Å; N185-C190 WeakPolarHBondContact OD1-CB 3.45Å; N185-C190 PolarHBondContact OD1-N 3Å; N185-R192 VanDerWaalsContact ND2-CG 3.32Å; N185-R192 WeakPolarHBondContact ND2-CG 3.35Å; N185-R192 PolarHBondContact ND2-NH1 2.67Å; N185-R192 PolarHBondContact ND2-O 3.49Å; N185-K193 PolarHBondContact ND2-O 3.25Å; N185-Y200 HydrophobicContact CB-CE1 3.89Å
186	A	98.4	Very high	98.3	Very high	37 Å²	37	36 Å²	36	31%	0.306	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-22.5	-175.8	0	0	0	0	0	112.7	N184 Y200	N184-A186 VanDerWaalsContact OD1-CB 3.32Å; N184-A186 WeakPolarHBondContact OD1-CB 3.49Å; N184-A186 PolarHBondContact OD1-N 3.04Å; A186-Y200 WeakPolarHBondContact CA-OH 3.29Å; A186-Y200 HydrophobicContact CB-CE2 4.49Å; A186-Y200 PolarHBondContact N-OH 3.2Å; A186-Y200 VanDerWaalsContact N-OH 3.09Å
187	Y	98.6	Very high	98.3	Very high	75 Å²	75	40 Å²	40	29%	0.294	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.6	14.8	179.1	-48.3	-62.8	0	0	0	112.3	N185 Q189 D224 G239 W240 I253	N185-Y187 PolarHBondContact O-N 2.83Å; Y187-Q189 VanDerWaalsContact C-N 3.28Å; Y187-Q189 PolarHBondContact O-N 2.92Å; Y187-D224 HydrophobicContact CD2-CB 3.72Å; Y187-D224 HydrophobicContact CE2-CB 4.24Å; Y187-G239 CarbonylContact O-C 3.47Å; Y187-G239 WeakPolarHBondContact O-CA 3.15Å; Y187-W240 HydrophobicContact CD1-CD2 4.18Å; Y187-W240 AromaticContact CD1-CE3 3.27Å; Y187-W240 HydrophobicContact CD1-CE3 3.27Å; Y187-W240 AromaticContact CD1-CZ3 3.68Å; Y187-W240 HydrophobicContact CD1-CZ3 3.68Å; Y187-W240 HydrophobicContact CD2-CB 4.47Å; Y187-W240 AromaticContact CE1-CE3 3.72Å; Y187-W240 HydrophobicContact CE1-CE3 3.72Å; Y187-W240 AromaticContact CE1-CZ3 3.77Å; Y187-W240 HydrophobicContact CE1-CZ3 3.77Å; Y187-W240 HydrophobicContact CG-CB 4.11Å; Y187-W240 HydrophobicContact CG-CD2 4.4Å; Y187-W240 AromaticContact CG-CE3 3.83Å; Y187-W240 HydrophobicContact CG-CE3 3.83Å; Y187-W240 PolarHBondContact O-N 2.98Å; Y187-I253 HydrophobicContact CD1-CD1 4.21Å; Y187-I253 WeakPolarHBondContact O-CG2 3.4Å
188	G	98.6	Very high	98.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	75.7	12.1	-179.9	0	0	0	0	0	114.7	N185 C190 G191 C238	N185-G188 PolarHBondContact O-N 3.45Å; N185-G188 WeakPolarHBondContact OD1-CA 3.19Å; G188-C190 PolarHBondContact O-N 2.82Å; G188-G191 PolarHBondContact O-N 3.38Å; G188-C238 PolarHBondContact O-SG 2.74Å
189	Q	98.8	Very high	98.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-15.3	-176.8	67.1	-86.8	55.8	0	0	114	H169 N184 N185 Y187 G191 D224 S226	H169-Q189 HydrophobicContact CB-CG 3.94Å; N184-Q189 VanDerWaalsContact O-CD 3.31Å; N184-Q189 WeakPolarHBondContact O-CG 3.35Å; N184-Q189 PolarHBondContact OD1-NE2 3.02Å; N184-Q189 VanDerWaalsContact OD1-NE2 3.11Å; N185-Q189 VanDerWaalsContact CA-OE1 3.23Å; N185-Q189 PolarHBondContact OD1-N 3.42Å; Y187-Q189 VanDerWaalsContact C-N 3.28Å; Y187-Q189 PolarHBondContact O-N 2.92Å; Q189-G191 VanDerWaalsContact C-N 3.28Å; Q189-D224 WeakPolarHBondContact CB-O 3.38Å; Q189-D224 PolarHBondContact NE2-OD1 3.46Å; Q189-S226 PolarHBondContact O-OG 3.18Å
190	C	98.8	Very high	98.1	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.014	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	3.3	168.7	-69.7	0	0	0	0	113.1	S181 N184 N185 G188 R192 H207	S181-C190 WeakPolarHBondContact CB-O 3.32Å; S181-C190 WeakPolarHBondContact OG-CB 3.4Å; S181-C190 PolarHBondContact OG-O 3.1Å; N184-C190 PolarHBondContact O-SG 2.79Å; N185-C190 HydrophobicContact CB-CB 4.06Å; N185-C190 WeakPolarHBondContact OD1-CA 3.26Å; N185-C190 VanDerWaalsContact OD1-CB 3.26Å; N185-C190 WeakPolarHBondContact OD1-CB 3.45Å; N185-C190 PolarHBondContact OD1-N 3Å; G188-C190 PolarHBondContact O-N 2.82Å; C190-R192 VanDerWaalsContact C-N 3.34Å; C190-R192 HydrophobicContact CB-CG 4.46Å; C190-R192 PolarHBondContact O-N 3.21Å; C190-H207 PolarHBondContact O-CD2 3.02Å
191	G	98.5	Very high	97.9	Very high	5 Å²	5	49.2 Å²	49.2	5%	0.052	26%	0.255	C	S	.	.	S	Bend	trans	71.4	26.4	175.4	0	0	0	0	0	114.4	G188 Q189 H207 C238 S255	G188-G191 PolarHBondContact O-N 3.38Å; Q189-G191 VanDerWaalsContact C-N 3.28Å; G191-H207 PolarHBondContact O-NE2 2.98Å; G191-C238 VanDerWaalsContact CA-SG 3.57Å; G191-S255 CarbonylContact C-O 3.2Å
192	R	98.4	Very high	97.7	Very high	29 Å²	29	50 Å²	50	11%	0.109	26%	0.264	C	S	.	.	S	Bend	trans	-132.1	160.1	174.8	66.6	-179.6	174.6	82.2	-7.9	111.1	N185 C190 I194 E198 S255	N185-R192 VanDerWaalsContact ND2-CG 3.32Å; N185-R192 WeakPolarHBondContact ND2-CG 3.35Å; N185-R192 PolarHBondContact ND2-NH1 2.67Å; N185-R192 PolarHBondContact ND2-O 3.49Å; C190-R192 VanDerWaalsContact C-N 3.34Å; C190-R192 HydrophobicContact CB-CG 4.46Å; C190-R192 PolarHBondContact O-N 3.21Å; R192-I194 PolarHBondContact O-N 3.12Å; R192-E198 IonicContact CZ-OE1 3.86Å; R192-E198 IonicContact CZ-OE2 2.72Å; R192-E198 IonicContact NH1-OE1 3.36Å; R192-E198 PolarHBondContact NH1-OE1 2.95Å; R192-E198 IonicContact NH1-OE2 2.74Å; R192-E198 PolarHBondContact NH1-OE2 3.18Å; R192-E198 VanDerWaalsContact NH2-CD 3.29Å; R192-E198 IonicContact NH2-OE1 3.49Å; R192-E198 PolarHBondContact NH2-OE1 3.12Å; R192-E198 IonicContact NH2-OE2 3.91Å; R192-E198 PolarHBondContact NH2-OE2 2.69Å; R192-E198 VanDerWaalsContact NH2-OE2 3.12Å; R192-S255 CarbonylContact C-O 3.11Å; R192-S255 VanDerWaalsContact CA-O 3.26Å; R192-S255 WeakPolarHBondContact CA-O 3.49Å; R192-S255 PolarHBondContact N-O 3.05Å
193	K	97.9	Very high	97.5	Very high	169 Å²	169	51 Å²	51	74%	0.735	27%	0.271	S	S	*	.			trans	-47.5	134.5	175.3	-175.9	176.9	179	-176.6	0	111.4	N185	N185-K193 PolarHBondContact ND2-O 3.25Å
194	I	98.4	Very high	97.4	Very high	58 Å²	58	56.9 Å²	56.9	30%	0.297	30%	0.296	S	S	.	.			trans	-74.4	128.4	175.1	-59.4	168.1	0	0	0	108.1	R192 I253	R192-I194 PolarHBondContact O-N 3.12Å; I194-I253 HydrophobicContact CD1-CG2 3.55Å
195	I	98.1	Very high	97.3	Very high	91 Å²	91	59.9 Å²	59.9	47%	0.467	31%	0.311	S	S	.	.			trans	-105.2	124.2	175.1	-61	171.3	0	0	0	106	E198	I195-E198 HydrophobicContact CB-CB 4.03Å; I195-E198 HydrophobicContact CB-CG 4.47Å; I195-E198 HydrophobicContact CG2-CB 4.22Å; I195-E198 WeakPolarHBondContact O-CB 3.36Å; I195-E198 PolarHBondContact O-N 2.8Å
196	D	96.3	Very high	97.3	Very high	144 Å²	144	61.3 Å²	61.3	77%	0.77	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	140.3	178.3	-164.1	23.1	0	0	0	110.3	E198	D196-E198 PolarHBondContact O-N 3.02Å; D196-E198 VanDerWaalsContact O-N 3.1Å
197	E	95.2	Very high	97.3	Very high	173 Å²	173	62.2 Å²	62.2	81%	0.808	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	26.2	-176.7	-53.8	-173.7	161.9	0	0	115.3	V199	E197-V199 PolarHBondContact O-N 3.35Å
198	E	97.8	Very high	97.3	Very high	27 Å²	27	62.8 Å²	62.8	13%	0.126	32%	0.318	C	S	.	.			trans	-61.3	124.9	178.1	-171.2	178	170.6	0	0	112	R192 I195 D196 Y200 I205	R192-E198 IonicContact CZ-OE1 3.86Å; R192-E198 IonicContact CZ-OE2 2.72Å; R192-E198 IonicContact NH1-OE1 3.36Å; R192-E198 PolarHBondContact NH1-OE1 2.95Å; R192-E198 IonicContact NH1-OE2 2.74Å; R192-E198 PolarHBondContact NH1-OE2 3.18Å; R192-E198 VanDerWaalsContact NH2-CD 3.29Å; R192-E198 IonicContact NH2-OE1 3.49Å; R192-E198 PolarHBondContact NH2-OE1 3.12Å; R192-E198 IonicContact NH2-OE2 3.91Å; R192-E198 PolarHBondContact NH2-OE2 2.69Å; R192-E198 VanDerWaalsContact NH2-OE2 3.12Å; I195-E198 HydrophobicContact CB-CB 4.03Å; I195-E198 HydrophobicContact CB-CG 4.47Å; I195-E198 HydrophobicContact CG2-CB 4.22Å; I195-E198 WeakPolarHBondContact O-CB 3.36Å; I195-E198 PolarHBondContact O-N 2.8Å; D196-E198 PolarHBondContact O-N 3.02Å; D196-E198 VanDerWaalsContact O-N 3.1Å; E198-Y200 HydrophobicContact CB-CE1 4.04Å; E198-Y200 HydrophobicContact CB-CE2 4.42Å; E198-Y200 VanDerWaalsContact CD-CE1 3.43Å; E198-Y200 HydrophobicContact CG-CD1 4.17Å; E198-Y200 HydrophobicContact CG-CE1 3.8Å; E198-Y200 WeakPolarHBondContact O-CD2 3.3Å; E198-Y200 VanDerWaalsContact O-CE2 3.31Å; E198-Y200 WeakPolarHBondContact O-CE2 3.48Å; E198-Y200 PolarHBondContact O-N 2.83Å; E198-Y200 WeakPolarHBondContact OE2-CE1 3.35Å; E198-I205 WeakPolarHBondContact OE1-CD1 3.43Å
199	V	97.1	Very high	97.3	Very high	113 Å²	113	63 Å²	63	69%	0.685	32%	0.319	S	S	*	.			trans	-86.7	105.9	174.6	-178.1	0	0	0	0	109.5	E197	E197-V199 PolarHBondContact O-N 3.35Å
200	Y	97.1	Very high	97.2	Very high	25 Å²	25	68.5 Å²	68.5	10%	0.098	34%	0.343	C	S	.	.			trans	-79.6	-22.6	-178.5	-56.3	-72.7	0	0	0	114	D123 S124 N184 N185 A186 E198 G202 S203	D123-Y200 CarbonylContact C-O 3.5Å; S124-Y200 WeakPolarHBondContact CB-O 3.49Å; S124-Y200 PolarHBondContact OG-O 2.86Å; N184-Y200 WeakPolarHBondContact ND2-CD2 3.46Å; N184-Y200 WeakPolarHBondContact ND2-CE2 3.26Å; N185-Y200 HydrophobicContact CB-CE1 3.89Å; A186-Y200 WeakPolarHBondContact CA-OH 3.29Å; A186-Y200 HydrophobicContact CB-CE2 4.49Å; A186-Y200 PolarHBondContact N-OH 3.2Å; A186-Y200 VanDerWaalsContact N-OH 3.09Å; E198-Y200 HydrophobicContact CB-CE1 4.04Å; E198-Y200 HydrophobicContact CB-CE2 4.42Å; E198-Y200 VanDerWaalsContact CD-CE1 3.43Å; E198-Y200 HydrophobicContact CG-CD1 4.17Å; E198-Y200 HydrophobicContact CG-CE1 3.8Å; E198-Y200 WeakPolarHBondContact O-CD2 3.3Å; E198-Y200 VanDerWaalsContact O-CE2 3.31Å; E198-Y200 WeakPolarHBondContact O-CE2 3.48Å; E198-Y200 PolarHBondContact O-N 2.83Å; E198-Y200 WeakPolarHBondContact OE2-CE1 3.35Å; Y200-G202 PolarHBondContact O-N 2.88Å; Y200-S203 VanDerWaalsContact O-CB 3.27Å; Y200-S203 WeakPolarHBondContact O-CB 3.39Å; Y200-S203 PolarHBondContact O-N 2.9Å
201	S	95.3	Very high	97.1	Very high	61 Å²	61	71.2 Å²	71.2	43%	0.427	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	128.4	-178.3	-176.4	0	0	0	0	111.8	K122 S203	K122-S201 WeakPolarHBondContact O-CA 3.29Å; K122-S201 WeakPolarHBondContact O-CB 3.41Å; K122-S201 PolarHBondContact O-N 3.01Å; S201-S203 PolarHBondContact O-N 2.88Å
202	G	93.9	Very high	97.1	Very high	19 Å²	19	73 Å²	73	20%	0.196	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	64	23.6	-178.7	0	0	0	0	0	114.4	S124 F128 Y200	S124-G202 PolarHBondContact OG-N 2.84Å; F128-G202 VanDerWaalsContact CD2-O 3.31Å; F128-G202 WeakPolarHBondContact CD2-O 3.37Å; Y200-G202 PolarHBondContact O-N 2.88Å
203	S	95.1	Very high	97	Very high	21 Å²	21	75 Å²	75	15%	0.147	40%	0.396	C	S	.	.			trans	-74.7	141.3	176.3	-176.1	0	0	0	0	111.4	S124 Y200 S201 I205	S124-S203 PolarHBondContact OG-N 2.83Å; Y200-S203 VanDerWaalsContact O-CB 3.27Å; Y200-S203 WeakPolarHBondContact O-CB 3.39Å; Y200-S203 PolarHBondContact O-N 2.9Å; S201-S203 PolarHBondContact O-N 2.88Å; S203-I205 VanDerWaalsContact C-N 3.34Å; S203-I205 WeakPolarHBondContact OG-CB 3.26Å; S203-I205 WeakPolarHBondContact OG-CG1 3.35Å; S203-I205 PolarHBondContact OG-N 2.89Å; S203-I205 VanDerWaalsContact OG-N 3.15Å
204	H	95.9	Very high	97	Very high	133 Å²	133	68.5 Å²	68.5	62%	0.616	37%	0.372	S	S	*	.			trans	-91.6	2.9	171.1	-71	-93.5	0	0	0	112.7	F128 I206	F128-H204 AromaticContact CD1-CE1 3.24Å; F128-H204 WeakPolarHBondContact CD1-CE1 3.44Å; F128-H204 AromaticContact CD1-ND1 3.93Å; F128-H204 AromaticContact CD1-NE2 3.82Å; F128-H204 AromaticContact CD2-CD2 3.8Å; F128-H204 AromaticContact CD2-CE1 3.57Å; F128-H204 AromaticContact CD2-NE2 3.36Å; F128-H204 WeakPolarHBondContact CD2-NE2 3.38Å; F128-H204 AromaticContact CE1-CE1 3.6Å; F128-H204 AromaticContact CE1-NE2 3.89Å; F128-H204 AromaticContact CE2-CE1 3.92Å; F128-H204 AromaticContact CE2-NE2 3.46Å; F128-H204 WeakPolarHBondContact CE2-NE2 3.47Å; F128-H204 AromaticContact CG-CE1 3.21Å; F128-H204 WeakPolarHBondContact CG-CE1 3.3Å; F128-H204 AromaticContact CG-ND1 3.61Å; F128-H204 AromaticContact CG-NE2 3.54Å; F128-H204 AromaticContact CZ-CE1 3.93Å; F128-H204 AromaticContact CZ-NE2 3.73Å; H204-I206 PolarHBondContact O-N 3.12Å
205	I	97.6	Very high	96.9	Very high	75 Å²	75	72.2 Å²	72.2	39%	0.385	38%	0.382	S	S	.	.			trans	-71.5	117	-174.5	-63.9	171.1	0	0	0	109.8	E198 S203	E198-I205 WeakPolarHBondContact OE1-CD1 3.43Å; S203-I205 VanDerWaalsContact C-N 3.34Å; S203-I205 WeakPolarHBondContact OG-CB 3.26Å; S203-I205 WeakPolarHBondContact OG-CG1 3.35Å; S203-I205 PolarHBondContact OG-N 2.89Å; S203-I205 VanDerWaalsContact OG-N 3.15Å
206	I	98.4	Very high	97	Very high	31 Å²	31	68.2 Å²	68.2	16%	0.159	36%	0.362	C	S	.	.			trans	-125.2	109.7	165.3	-60	175.3	0	0	0	106.5	A149 L150 P151 F180 S181 M182 H204	A149-I206 WeakPolarHBondContact O-CD1 3.28Å; L150-I206 HydrophobicContact CD2-CG2 4.4Å; P151-I206 HydrophobicContact CG-CB 4.01Å; P151-I206 HydrophobicContact CG-CG2 3.98Å; F180-I206 HydrophobicContact CB-CG2 3.92Å; F180-I206 HydrophobicContact CD1-CG2 4.11Å; F180-I206 HydrophobicContact CG-CG2 4.46Å; S181-I206 CarbonylContact O-C 2.99Å; S181-I206 WeakPolarHBondContact O-CA 3.16Å; M182-I206 HydrophobicContact CB-CG1 4.15Å; M182-I206 HydrophobicContact CE-CD1 3.85Å; M182-I206 HydrophobicContact CE-CG1 4.02Å; M182-I206 HydrophobicContact CE-CG2 4.01Å; H204-I206 PolarHBondContact O-N 3.12Å
207	H	98.6	Very high	97.1	Very high	56 Å²	56	63.9 Å²	63.9	26%	0.259	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	126.6	-173	178.1	67	0	0	0	110.9	F180 S181 C190 G191 I209	F180-H207 CarbonylContact C-O 3.58Å; F180-H207 VanDerWaalsContact CA-O 3.26Å; F180-H207 WeakPolarHBondContact CA-O 3.29Å; S181-H207 PolarHBondContact N-O 3.19Å; S181-H207 PolarHBondContact O-N 3.48Å; S181-H207 PolarHBondContact OG-O 2.88Å; C190-H207 PolarHBondContact O-CD2 3.02Å; G191-H207 PolarHBondContact O-NE2 2.98Å; H207-I209 PolarHBondContact O-N 3.43Å
208	R	98.6	Very high	97.3	Very high	87 Å²	87	57.2 Å²	57.2	33%	0.328	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	104.1	170.7	-173.4	178.2	178.1	-167.1	2	109.1	E177 F180	E177-R208 PolarHBondContact O-NE 2.99Å; E177-R208 PolarHBondContact O-NH2 3.49Å; F180-R208 HydrophobicContact CD1-CB 3.9Å; F180-R208 HydrophobicContact CD1-CG 4.23Å; F180-R208 HydrophobicContact CE1-CB 3.74Å; F180-R208 HydrophobicContact CE1-CG 3.83Å; F180-R208 HydrophobicContact CZ-CB 4.45Å; F180-R208 HydrophobicContact CZ-CG 4.03Å
209	I	98.5	Very high	97.3	Very high	4 Å²	4	56 Å²	56	2%	0.021	30%	0.304	C	S	.	.			trans	-65.4	136.2	-175.2	-58.1	176.9	0	0	0	110.4	L171 V179 H207 F212 F228 P257	L171-I209 HydrophobicContact CD2-CD1 3.95Å; V179-I209 HydrophobicContact CB-CB 4.5Å; V179-I209 HydrophobicContact CB-CD1 4.5Å; V179-I209 HydrophobicContact CG1-CD1 4.16Å; V179-I209 PolarHBondContact O-N 2.94Å; H207-I209 PolarHBondContact O-N 3.43Å; I209-F212 HydrophobicContact CB-CE2 4.1Å; I209-F212 HydrophobicContact CB-CZ 4.32Å; I209-F212 HydrophobicContact CG2-CE2 3.6Å; I209-F212 HydrophobicContact CG2-CZ 3.52Å; I209-F228 HydrophobicContact CD1-CE1 3.62Å; I209-F228 HydrophobicContact CD1-CZ 3.64Å; I209-P257 HydrophobicContact CG2-CG 3.2Å
210	K	96.8	Very high	97.4	Very high	116 Å²	116	51 Å²	51	50%	0.504	27%	0.274	S	S	.	.			trans	-123.4	172.3	177.8	-55.8	-60.8	178.1	177.7	0	110.4
211	G	95.3	Very high	97.5	Very high	59 Å²	59	49.8 Å²	49.8	61%	0.608	27%	0.27	S	S	*	.			trans	100.8	7	174.8	0	0	0	0	0	115.5
212	F	97.9	Very high	97.7	Very high	42 Å²	42	46.9 Å²	46.9	18%	0.184	25%	0.249	C	C	.	.			trans	-82	143.5	172.8	-51.4	-66.8	0	0	0	111.2	V179 I209 S214 V216 F228 Y236 P257	V179-F212 HydrophobicContact CG2-CE2 4.34Å; I209-F212 HydrophobicContact CB-CE2 4.1Å; I209-F212 HydrophobicContact CB-CZ 4.32Å; I209-F212 HydrophobicContact CG2-CE2 3.6Å; I209-F212 HydrophobicContact CG2-CZ 3.52Å; F212-S214 VanDerWaalsContact C-N 3.34Å; F212-S214 WeakPolarHBondContact CB-O 3.43Å; F212-V216 HydrophobicContact CB-CG2 4.37Å; F212-V216 HydrophobicContact CD1-CG2 3.89Å; F212-V216 HydrophobicContact CD2-CG2 3.6Å; F212-V216 HydrophobicContact CE1-CG2 4.02Å; F212-V216 HydrophobicContact CE2-CG2 3.73Å; F212-V216 HydrophobicContact CG-CG2 3.67Å; F212-V216 HydrophobicContact CZ-CG2 3.93Å; F212-F228 HydrophobicContact CD1-CB 4.46Å; F212-F228 HydrophobicContact CE1-CB 3.64Å; F212-F228 HydrophobicContact CE1-CD1 4.1Å; F212-F228 AromaticContact CE1-CD2 3.8Å; F212-F228 HydrophobicContact CE1-CD2 3.8Å; F212-F228 AromaticContact CE1-CG 3.57Å; F212-F228 HydrophobicContact CE1-CG 3.57Å; F212-F228 HydrophobicContact CZ-CB 4.11Å; F212-F228 AromaticContact CZ-CD1 3.72Å; F212-F228 HydrophobicContact CZ-CD1 3.72Å; F212-F228 HydrophobicContact CZ-CD2 4.08Å; F212-F228 HydrophobicContact CZ-CE1 4.15Å; F212-F228 HydrophobicContact CZ-CE2 4.48Å; F212-F228 AromaticContact CZ-CG 3.69Å; F212-F228 HydrophobicContact CZ-CG 3.69Å; F212-Y236 HydrophobicContact CD1-CD1 4.13Å; F212-Y236 AromaticContact CD1-CD2 3.94Å; F212-Y236 HydrophobicContact CD1-CD2 3.94Å; F212-Y236 HydrophobicContact CD1-CE2 4.5Å; F212-Y236 AromaticContact CD1-CG 3.77Å; F212-Y236 HydrophobicContact CD1-CG 3.77Å; F212-Y236 HydrophobicContact CE1-CG 4.17Å; F212-P257 HydrophobicContact CD1-CB 4.27Å; F212-P257 HydrophobicContact CE1-CB 3.62Å; F212-P257 HydrophobicContact CE1-CG 3.91Å; F212-P257 HydrophobicContact CZ-CB 4.11Å; F212-P257 HydrophobicContact CZ-CG 3.85Å
213	S	96.8	Very high	97.9	Very high	72 Å²	72	48.6 Å²	48.6	50%	0.503	25%	0.252	S	S	.	.	S	Bend	trans	-74.2	-23.5	174.9	55	0	0	0	0	113.8	K234 Y236	S213-K234 WeakPolarHBondContact OG-CD 3.34Å; S213-Y236 VanDerWaalsContact CB-OH 3.25Å; S213-Y236 WeakPolarHBondContact CB-OH 3.34Å; S213-Y236 PolarHBondContact N-OH 2.96Å; S213-Y236 PolarHBondContact OG-OH 3.22Å
214	S	97.6	Very high	98.1	Very high	32 Å²	32	48.1 Å²	48.1	22%	0.224	25%	0.248	C	C	.	.	S	Bend	trans	-151.4	-178.4	-179	56.1	0	0	0	0	111	F212 V216 T230 D231 T232	F212-S214 VanDerWaalsContact C-N 3.34Å; F212-S214 WeakPolarHBondContact CB-O 3.43Å; S214-V216 PolarHBondContact O-N 2.93Å; S214-T230 WeakPolarHBondContact OG-CB 3.29Å; S214-T230 PolarHBondContact OG-OG1 2.9Å; S214-D231 WeakPolarHBondContact CB-OD1 3.26Å; S214-T232 PolarHBondContact OG-OG1 2.96Å
215	R	98.2	Very high	98.2	Very high	135 Å²	135	41.8 Å²	41.8	51%	0.509	22%	0.219	S	C	.	.			trans	-71.7	129.5	-173	178.2	-178.4	59.7	107.7	7.9	110.1	T230 D231	R215-T230 CarbonylContact O-C 3.37Å; R215-T230 VanDerWaalsContact O-CA 3.23Å; R215-T230 WeakPolarHBondContact O-CA 3.4Å; R215-D231 IonicContact CZ-OD2 2.97Å; R215-D231 IonicContact NE-OD2 2.79Å; R215-D231 PolarHBondContact NE-OD2 3.39Å; R215-D231 VanDerWaalsContact NE-OD2 3.11Å; R215-D231 IonicContact NH2-OD2 3.87Å; R215-D231 PolarHBondContact NH2-OD2 3.01Å; R215-D231 PolarHBondContact O-N 2.78Å
216	V	98.8	Very high	98.3	Very high	7 Å²	7	38.2 Å²	38.2	4%	0.042	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	133.9	173.6	-178.2	0	0	0	0	109.8	L173 V179 F212 S214 Q218 V219 F228 L229	L173-V216 HydrophobicContact CD1-CB 4.01Å; L173-V216 HydrophobicContact CD1-CG1 3.95Å; L173-V216 WeakPolarHBondContact CD1-O 3.23Å; V179-V216 HydrophobicContact CG2-CB 3.76Å; V179-V216 HydrophobicContact CG2-CG1 3.75Å; V179-V216 HydrophobicContact CG2-CG2 3.9Å; F212-V216 HydrophobicContact CB-CG2 4.37Å; F212-V216 HydrophobicContact CD1-CG2 3.89Å; F212-V216 HydrophobicContact CD2-CG2 3.6Å; F212-V216 HydrophobicContact CE1-CG2 4.02Å; F212-V216 HydrophobicContact CE2-CG2 3.73Å; F212-V216 HydrophobicContact CG-CG2 3.67Å; F212-V216 HydrophobicContact CZ-CG2 3.93Å; S214-V216 PolarHBondContact O-N 2.93Å; V216-Q218 WeakPolarHBondContact CG1-O 3.42Å; V216-V219 HydrophobicContact CG1-CG1 3.96Å; V216-F228 HydrophobicContact CG1-CB 4.18Å; V216-F228 HydrophobicContact CG2-CB 4.36Å; V216-L229 CarbonylContact C-O 3.33Å; V216-L229 WeakPolarHBondContact CA-O 3.47Å; V216-L229 WeakPolarHBondContact CG1-O 3.45Å
217	V	98.7	Very high	98.3	Very high	54 Å²	54	36.8 Å²	36.8	33%	0.327	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	-16.8	178.8	-65.3	0	0	0	0	113.5	L173 L229 D231	L173-V217 VanDerWaalsContact CD2-C 3.5Å; L173-V217 WeakPolarHBondContact CD2-O 3.32Å; V217-L229 HydrophobicContact CG2-CD2 4.36Å; V217-L229 HydrophobicContact CG2-CG 4.08Å; V217-L229 WeakPolarHBondContact CG2-O 3.25Å; V217-L229 PolarHBondContact N-O 3.49Å; V217-D231 HydrophobicContact CG1-CB 3.6Å
218	Q	98.9	Very high	98.3	Very high	33 Å²	33	34.1 Å²	34.1	15%	0.154	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	143.4	173.7	-157.8	-166.5	-15.5	0	0	110.7	V216 L229 I272	V216-Q218 WeakPolarHBondContact CG1-O 3.42Å; Q218-L229 HydrophobicContact CB-CB 3.92Å; Q218-L229 HydrophobicContact CB-CD2 4.22Å; Q218-L229 PolarHBondContact N-O 2.48Å; Q218-L229 PolarHBondContact O-N 2.89Å; Q218-I272 HydrophobicContact CB-CG1 4.28Å; Q218-I272 HydrophobicContact CG-CG1 4.23Å; Q218-I272 PolarHBondContact NE2-O 2.83Å
219	V	98.9	Very high	98.3	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.006	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	148	171.3	-65	0	0	0	0	110.6	Q162 L171 L173 V179 V216 L227 F228	Q162-V219 HydrophobicContact CB-CG2 4.42Å; Q162-V219 HydrophobicContact CG-CG2 4.33Å; Q162-V219 PolarHBondContact NE2-O 2.96Å; Q162-V219 VanDerWaalsContact OE1-N 3.12Å; L171-V219 HydrophobicContact CB-CB 4.21Å; L171-V219 HydrophobicContact CB-CG2 4.16Å; L171-V219 HydrophobicContact CD1-CB 3.89Å; L171-V219 HydrophobicContact CD1-CG1 4.35Å; L173-V219 HydrophobicContact CB-CG1 4.11Å; L173-V219 HydrophobicContact CB-CG2 4.07Å; V179-V219 HydrophobicContact CG1-CG1 3.91Å; V179-V219 HydrophobicContact CG2-CG1 3.96Å; V216-V219 HydrophobicContact CG1-CG1 3.96Å; V219-L227 WeakPolarHBondContact CA-O 3.48Å; V219-F228 HydrophobicContact CG1-CD1 3.98Å
220	A	98.9	Very high	98.3	Very high	7 Å²	7	30 Å²	30	6%	0.058	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	134.3	171.6	0	0	0	0	0	110.4	L227 I272 T274	A220-L227 HydrophobicContact CB-CB 4.39Å; A220-L227 PolarHBondContact N-O 3.21Å; A220-L227 PolarHBondContact O-N 2.87Å; A220-I272 HydrophobicContact CB-CD1 4.27Å; A220-I272 HydrophobicContact CB-CG1 4.45Å; A220-T274 HydrophobicContact CB-CG2 3.97Å
221	C	98.9	Very high	98.4	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.007	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	126.5	175.6	-65.9	0	0	0	0	108.2	S164 G166 H169 L171	S164-C221 VanDerWaalsContact C-SG 3.51Å; S164-C221 PolarHBondContact O-SG 2.96Å; S164-C221 WeakPolarHBondContact OG-CB 3.46Å; S164-C221 PolarHBondContact OG-N 3.01Å; S164-C221 PolarHBondContact OG-SG 3.3Å; G166-C221 VanDerWaalsContact N-CB 3.28Å; H169-C221 PolarHBondContact NE2-SG 3.49Å; H169-C221 VanDerWaalsContact NE2-SG 3.39Å; L171-C221 VanDerWaalsContact CG-SG 3.58Å
222	G	98.7	Very high	98.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.151	C	C	.	.			trans	-85.9	-156.8	161.9	0	0	0	0	0	110.3	G166 H225 Y275 G276	G166-G222 WeakPolarHBondContact CA-O 3.39Å; G222-H225 PolarHBondContact N-O 2.86Å; G222-Y275 CarbonylContact C-O 2.93Å; G222-Y275 WeakPolarHBondContact CA-O 3.27Å; G222-G276 WeakPolarHBondContact CA-O 3.45Å
223	Q	98.6	Very high	98.5	Very high	55 Å²	55	26.5 Å²	26.5	26%	0.257	14%	0.144	S	C	.	.	S	Bend	trans	-64.3	-57	178.4	-169.8	161.1	-74.2	0	0	110.5	Y100 R167 Y275 G276	Y100-Q223 HydrophobicContact CE2-CG 4.11Å; Y100-Q223 PolarHBondContact OH-OE1 3.12Å; R167-Q223 HydrophobicContact CB-CG 3.97Å; R167-Q223 WeakPolarHBondContact CB-O 3.44Å; R167-Q223 HydrophobicContact CG-CG 4.48Å; R167-Q223 PolarHBondContact N-O 2.88Å; R167-Q223 VanDerWaalsContact N-O 3.08Å; Q223-Y275 PolarHBondContact N-O 2.99Å; Q223-Y275 VanDerWaalsContact N-O 3.1Å; Q223-G276 PolarHBondContact N-O 3.41Å; Q223-G276 VanDerWaalsContact N-O 3.16Å
224	D	98.8	Very high	98.6	Very high	11 Å²	11	26.8 Å²	26.8	6%	0.059	14%	0.136	C	C	.	.	S	Bend	trans	-136.8	26.2	-176.9	-76.8	-59.5	0	0	0	112.9	R167 Y187 Q189 W240	R167-D224 IonicContact CZ-OD1 3.65Å; R167-D224 IonicContact CZ-OD2 2.88Å; R167-D224 IonicContact NE-OD1 2.69Å; R167-D224 PolarHBondContact NE-OD1 3.32Å; R167-D224 IonicContact NE-OD2 3.41Å; R167-D224 PolarHBondContact NE-OD2 3.3Å; R167-D224 VanDerWaalsContact NH2-CG 3.35Å; R167-D224 IonicContact NH2-OD1 3.12Å; R167-D224 PolarHBondContact NH2-OD1 3.49Å; R167-D224 IonicContact NH2-OD2 3.4Å; R167-D224 PolarHBondContact NH2-OD2 2.88Å; Y187-D224 HydrophobicContact CD2-CB 3.72Å; Y187-D224 HydrophobicContact CE2-CB 4.24Å; Q189-D224 WeakPolarHBondContact CB-O 3.38Å; Q189-D224 PolarHBondContact NE2-OD1 3.46Å; D224-W240 HydrophobicContact CB-CB 3.88Å; D224-W240 WeakPolarHBondContact O-CB 3.24Å; D224-W240 PolarHBondContact O-N 3.22Å
225	H	98.9	Very high	98.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	167.5	171.1	73.3	-64.8	0	0	0	111.7	H169 G222 C238 Q245 T246 T274 G276 S279	H169-H225 PolarHBondContact CE1-O 3.07Å; H169-H225 PolarHBondContact NE2-O 3.37Å; G222-H225 PolarHBondContact N-O 2.86Å; H225-C238 CarbonylContact C-O 3.51Å; H225-C238 WeakPolarHBondContact CA-O 3.43Å; H225-C238 WeakPolarHBondContact CB-O 3.49Å; H225-Q245 HydrophobicContact CB-CG 4.05Å; H225-Q245 PolarHBondContact CD2-O 2.9Å; H225-Q245 PolarHBondContact NE2-O 2.72Å; H225-T246 HydrophobicContact CB-CG2 4.39Å; H225-T274 PolarHBondContact CE1-OG1 2.85Å; H225-T274 VanDerWaalsContact CE1-OG1 3.24Å; H225-T274 PolarHBondContact NE2-OG1 3.01Å; H225-G276 PolarHBondContact CE1-O 3.18Å; H225-G276 VanDerWaalsContact CE1-O 3.31Å; H225-S279 PolarHBondContact NE2-OG 3.41Å
226	S	98.9	Very high	98.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	138.5	-178.7	-80.5	0	0	0	0	110.3	H169 L171 Q189 S237 C238	H169-S226 PolarHBondContact CD2-OG 2.82Å; H169-S226 PolarHBondContact NE2-OG 3.49Å; L171-S226 WeakPolarHBondContact CD1-OG 3.21Å; Q189-S226 PolarHBondContact O-OG 3.18Å; S226-S237 VanDerWaalsContact O-CA 3.24Å; S226-S237 WeakPolarHBondContact O-CA 3.4Å; S226-C238 PolarHBondContact N-O 2.67Å; S226-C238 PolarHBondContact O-N 2.69Å; S226-C238 VanDerWaalsContact O-N 3.09Å
227	L	98.9	Very high	98.7	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	143.5	174.2	-58.3	-177.4	0	0	0	110.2	V219 A220 Y236 I272 T274 W291	V219-L227 WeakPolarHBondContact CA-O 3.48Å; A220-L227 HydrophobicContact CB-CB 4.39Å; A220-L227 PolarHBondContact N-O 3.21Å; A220-L227 PolarHBondContact O-N 2.87Å; L227-Y236 WeakPolarHBondContact CA-O 3.27Å; L227-I272 HydrophobicContact CB-CD1 3.67Å; L227-I272 WeakPolarHBondContact O-CD1 3.49Å; L227-T274 HydrophobicContact CD1-CG2 3.69Å; L227-T274 HydrophobicContact CG-CG2 3.95Å; L227-W291 HydrophobicContact CD1-CZ2 4.13Å; L227-W291 HydrophobicContact CD2-CZ2 4.12Å
228	F	98.9	Very high	98.7	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	130.8	-180	-43.5	-92.6	0	0	0	109.3	L171 V179 I209 F212 V216 V219 V235 Y236 P257	L171-F228 HydrophobicContact CD1-CD1 4.42Å; L171-F228 HydrophobicContact CD1-CE1 3.71Å; L171-F228 HydrophobicContact CD1-CZ 4.18Å; L171-F228 HydrophobicContact CD2-CE1 4.05Å; L171-F228 HydrophobicContact CD2-CZ 4.35Å; V179-F228 HydrophobicContact CG1-CD1 4.37Å; V179-F228 HydrophobicContact CG1-CE1 4.06Å; V179-F228 HydrophobicContact CG2-CD1 4.3Å; I209-F228 HydrophobicContact CD1-CE1 3.62Å; I209-F228 HydrophobicContact CD1-CZ 3.64Å; F212-F228 HydrophobicContact CD1-CB 4.46Å; F212-F228 HydrophobicContact CE1-CB 3.64Å; F212-F228 HydrophobicContact CE1-CD1 4.1Å; F212-F228 AromaticContact CE1-CD2 3.8Å; F212-F228 HydrophobicContact CE1-CD2 3.8Å; F212-F228 AromaticContact CE1-CG 3.57Å; F212-F228 HydrophobicContact CE1-CG 3.57Å; F212-F228 HydrophobicContact CZ-CB 4.11Å; F212-F228 AromaticContact CZ-CD1 3.72Å; F212-F228 HydrophobicContact CZ-CD1 3.72Å; F212-F228 HydrophobicContact CZ-CD2 4.08Å; F212-F228 HydrophobicContact CZ-CE1 4.15Å; F212-F228 HydrophobicContact CZ-CE2 4.48Å; F212-F228 AromaticContact CZ-CG 3.69Å; F212-F228 HydrophobicContact CZ-CG 3.69Å; V216-F228 HydrophobicContact CG1-CB 4.18Å; V216-F228 HydrophobicContact CG2-CB 4.36Å; V219-F228 HydrophobicContact CG1-CD1 3.98Å; F228-V235 CarbonylContact O-C 3.5Å; F228-V235 WeakPolarHBondContact O-CA 3.32Å; F228-Y236 PolarHBondContact N-O 3.17Å; F228-Y236 PolarHBondContact O-N 3.38Å; F228-P257 HydrophobicContact CD2-CB 4.49Å; F228-P257 HydrophobicContact CE2-CB 4.45Å; F228-P257 HydrophobicContact CE2-CG 4.36Å
229	L	98.9	Very high	98.7	Very high	3 Å²	3	15 Å²	15	2%	0.016	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	130.5	175	175	62.5	0	0	0	109	V216 V217 Q218 K234 V235 V269 I272	V216-L229 CarbonylContact C-O 3.33Å; V216-L229 WeakPolarHBondContact CA-O 3.47Å; V216-L229 WeakPolarHBondContact CG1-O 3.45Å; V217-L229 HydrophobicContact CG2-CD2 4.36Å; V217-L229 HydrophobicContact CG2-CG 4.08Å; V217-L229 WeakPolarHBondContact CG2-O 3.25Å; V217-L229 PolarHBondContact N-O 3.49Å; Q218-L229 HydrophobicContact CB-CB 3.92Å; Q218-L229 HydrophobicContact CB-CD2 4.22Å; Q218-L229 PolarHBondContact N-O 2.48Å; Q218-L229 PolarHBondContact O-N 2.89Å; L229-K234 WeakPolarHBondContact CA-O 3.49Å; L229-V235 HydrophobicContact CD1-CG2 4.12Å; L229-V269 HydrophobicContact CD1-CB 3.74Å; L229-V269 HydrophobicContact CD1-CG1 3.72Å; L229-V269 HydrophobicContact CD2-CG1 4.3Å; L229-I272 HydrophobicContact CB-CD1 3.91Å; L229-I272 HydrophobicContact CB-CG1 3.97Å; L229-I272 HydrophobicContact CB-CG2 4.18Å
230	T	98.8	Very high	98.7	Very high	2 Å²	2	19 Å²	19	1%	0.012	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	163.6	175.8	74.4	0	0	0	0	113	S214 R215 T232 G233 K234 Y236	S214-T230 WeakPolarHBondContact OG-CB 3.29Å; S214-T230 PolarHBondContact OG-OG1 2.9Å; R215-T230 CarbonylContact O-C 3.37Å; R215-T230 VanDerWaalsContact O-CA 3.23Å; R215-T230 WeakPolarHBondContact O-CA 3.4Å; T230-T232 PolarHBondContact O-N 3.48Å; T230-T232 PolarHBondContact OG1-OG1 2.87Å; T230-G233 PolarHBondContact O-N 2.82Å; T230-K234 PolarHBondContact N-O 2.81Å; T230-K234 PolarHBondContact OG1-N 2.92Å; T230-K234 PolarHBondContact OG1-O 2.89Å; T230-Y236 HydrophobicContact CG2-CD2 3.89Å; T230-Y236 HydrophobicContact CG2-CE2 3.72Å
231	D	98	Very high	98.7	Very high	64 Å²	64	18.7 Å²	18.7	34%	0.342	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.9	177.4	53.2	9.1	0	0	0	114.2	S214 R215 V217 G233	S214-D231 WeakPolarHBondContact CB-OD1 3.26Å; R215-D231 IonicContact CZ-OD2 2.97Å; R215-D231 IonicContact NE-OD2 2.79Å; R215-D231 PolarHBondContact NE-OD2 3.39Å; R215-D231 VanDerWaalsContact NE-OD2 3.11Å; R215-D231 IonicContact NH2-OD2 3.87Å; R215-D231 PolarHBondContact NH2-OD2 3.01Å; R215-D231 PolarHBondContact O-N 2.78Å; V217-D231 HydrophobicContact CG1-CB 3.6Å; D231-G233 VanDerWaalsContact C-N 3.28Å
232	T	97.8	Very high	98.7	Very high	78 Å²	78	20.1 Å²	20.1	48%	0.479	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	11.5	172	62.5	0	0	0	0	113.1	S214 T230 K234	S214-T232 PolarHBondContact OG-OG1 2.96Å; T230-T232 PolarHBondContact O-N 3.48Å; T230-T232 PolarHBondContact OG1-OG1 2.87Å; T232-K234 VanDerWaalsContact C-N 3.31Å; T232-K234 PolarHBondContact O-N 2.71Å
233	G	98.2	Very high	98.6	Very high	2 Å²	2	21.3 Å²	21.3	2%	0.021	11%	0.109	C	C	.	.	S	Bend	trans	76.7	11.2	177.1	0	0	0	0	0	115	T230 D231 V269	T230-G233 PolarHBondContact O-N 2.82Å; D231-G233 VanDerWaalsContact C-N 3.28Å; G233-V269 WeakPolarHBondContact CA-O 3.24Å; G233-V269 WeakPolarHBondContact O-CB 3.15Å; G233-V269 PolarHBondContact O-N 3.23Å
234	K	98.6	Very high	98.6	Very high	77 Å²	77	18.7 Å²	18.7	34%	0.335	10%	0.097	S	C	.	.			trans	-88.9	141.2	179.7	-66.6	178.9	165.5	-134.5	0	111.3	S213 L229 T230 T232 Y236 E259	S213-K234 WeakPolarHBondContact OG-CD 3.34Å; L229-K234 WeakPolarHBondContact CA-O 3.49Å; T230-K234 PolarHBondContact N-O 2.81Å; T230-K234 PolarHBondContact OG1-N 2.92Å; T230-K234 PolarHBondContact OG1-O 2.89Å; T232-K234 VanDerWaalsContact C-N 3.31Å; T232-K234 PolarHBondContact O-N 2.71Å; K234-Y236 HydrophobicContact CB-CE2 3.97Å; K234-E259 WeakPolarHBondContact CD-OE1 3.47Å; K234-E259 WeakPolarHBondContact CE-OE1 3.49Å; K234-E259 VanDerWaalsContact NZ-CD 3.31Å; K234-E259 IonicContact NZ-OE1 3.01Å; K234-E259 PolarHBondContact NZ-OE1 3.33Å; K234-E259 IonicContact NZ-OE2 3.89Å; K234-E259 PolarHBondContact NZ-OE2 2.85Å
235	V	98.9	Very high	98.6	Very high	4 Å²	4	18.2 Å²	18.2	2%	0.024	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	135.3	177.8	-177.2	0	0	0	0	109.7	F228 L229 V260 L264 V269 I272 W291	F228-V235 CarbonylContact O-C 3.5Å; F228-V235 WeakPolarHBondContact O-CA 3.32Å; L229-V235 HydrophobicContact CD1-CG2 4.12Å; V235-V260 HydrophobicContact CB-CB 4.2Å; V235-V260 HydrophobicContact CB-CG2 4.45Å; V235-V260 HydrophobicContact CG1-CB 4.21Å; V235-V260 HydrophobicContact CG1-CG2 3.97Å; V235-V260 PolarHBondContact O-N 2.96Å; V235-L264 HydrophobicContact CG2-CD1 4.41Å; V235-V269 HydrophobicContact CG2-CB 4.04Å; V235-V269 HydrophobicContact CG2-CG1 3.94Å; V235-V269 HydrophobicContact CG2-CG2 3.89Å; V235-I272 HydrophobicContact CG1-CG2 4.01Å; V235-I272 HydrophobicContact CG2-CG2 3.75Å; V235-W291 HydrophobicContact CG1-CH2 4.46Å; V235-W291 HydrophobicContact CG1-CZ2 4.49Å
236	Y	98.9	Very high	98.6	Very high	11 Å²	11	18.2 Å²	18.2	4%	0.043	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	153	171.7	-68.6	-104.6	0	0	0	109.8	F212 S213 L227 F228 T230 K234 P257 V258 E259	F212-Y236 HydrophobicContact CD1-CD1 4.13Å; F212-Y236 AromaticContact CD1-CD2 3.94Å; F212-Y236 HydrophobicContact CD1-CD2 3.94Å; F212-Y236 HydrophobicContact CD1-CE2 4.5Å; F212-Y236 AromaticContact CD1-CG 3.77Å; F212-Y236 HydrophobicContact CD1-CG 3.77Å; F212-Y236 HydrophobicContact CE1-CG 4.17Å; S213-Y236 VanDerWaalsContact CB-OH 3.25Å; S213-Y236 WeakPolarHBondContact CB-OH 3.34Å; S213-Y236 PolarHBondContact N-OH 2.96Å; S213-Y236 PolarHBondContact OG-OH 3.22Å; L227-Y236 WeakPolarHBondContact CA-O 3.27Å; F228-Y236 PolarHBondContact N-O 3.17Å; F228-Y236 PolarHBondContact O-N 3.38Å; T230-Y236 HydrophobicContact CG2-CD2 3.89Å; T230-Y236 HydrophobicContact CG2-CE2 3.72Å; K234-Y236 HydrophobicContact CB-CE2 3.97Å; Y236-P257 HydrophobicContact CD1-CB 4.35Å; Y236-V258 CarbonylContact C-O 3.54Å; Y236-V258 WeakPolarHBondContact CA-O 3.23Å; Y236-V258 VanDerWaalsContact CD1-C 3.49Å; Y236-E259 HydrophobicContact CD1-CB 4.06Å; Y236-E259 VanDerWaalsContact CD1-N 3.33Å; Y236-E259 HydrophobicContact CE1-CB 3.61Å; Y236-E259 HydrophobicContact CE1-CG 4.3Å; Y236-E259 HydrophobicContact CE2-CG 4.43Å; Y236-E259 PolarHBondContact OH-OE2 2.9Å
237	S	98.9	Very high	98.6	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	154.7	176.4	69.9	0	0	0	0	112.9	S226 T246 L248 P257 V258 V260	S226-S237 VanDerWaalsContact O-CA 3.24Å; S226-S237 WeakPolarHBondContact O-CA 3.4Å; S237-T246 VanDerWaalsContact CB-O 3.24Å; S237-T246 WeakPolarHBondContact CB-O 3.31Å; S237-T246 PolarHBondContact OG-O 2.82Å; S237-L248 WeakPolarHBondContact OG-CD2 3.41Å; S237-P257 WeakPolarHBondContact O-CA 3.49Å; S237-V258 PolarHBondContact N-O 3.34Å; S237-V258 PolarHBondContact O-N 2.7Å; S237-V260 WeakPolarHBondContact OG-CG2 3.5Å
238	C	98.9	Very high	98.6	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	163.1	167.9	70.1	0	0	0	0	109.9	G188 G191 H225 S226 S254 S256	G188-C238 PolarHBondContact O-SG 2.74Å; G191-C238 VanDerWaalsContact CA-SG 3.57Å; H225-C238 CarbonylContact C-O 3.51Å; H225-C238 WeakPolarHBondContact CA-O 3.43Å; H225-C238 WeakPolarHBondContact CB-O 3.49Å; S226-C238 PolarHBondContact N-O 2.67Å; S226-C238 PolarHBondContact O-N 2.69Å; S226-C238 VanDerWaalsContact O-N 3.09Å; C238-S254 WeakPolarHBondContact CB-O 3.35Å; C238-S256 WeakPolarHBondContact CB-O 3.44Å
239	G	98.8	Very high	98.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	122.3	-158.2	178.9	0	0	0	0	0	114.1	Y187 S254	Y187-G239 CarbonylContact O-C 3.47Å; Y187-G239 WeakPolarHBondContact O-CA 3.15Å; G239-S254 PolarHBondContact N-O 3.23Å; G239-S254 PolarHBondContact O-N 3.45Å
240	W	98.8	Very high	98.5	Very high	85 Å²	85	24.8 Å²	24.8	32%	0.322	14%	0.138	S	C	.	.			trans	-61.5	136	173.1	-175.4	-113.7	0	0	0	111	Y187 D224 A242 Q245 T246 I253	Y187-W240 HydrophobicContact CD1-CD2 4.18Å; Y187-W240 AromaticContact CD1-CE3 3.27Å; Y187-W240 HydrophobicContact CD1-CE3 3.27Å; Y187-W240 AromaticContact CD1-CZ3 3.68Å; Y187-W240 HydrophobicContact CD1-CZ3 3.68Å; Y187-W240 HydrophobicContact CD2-CB 4.47Å; Y187-W240 AromaticContact CE1-CE3 3.72Å; Y187-W240 HydrophobicContact CE1-CE3 3.72Å; Y187-W240 AromaticContact CE1-CZ3 3.77Å; Y187-W240 HydrophobicContact CE1-CZ3 3.77Å; Y187-W240 HydrophobicContact CG-CB 4.11Å; Y187-W240 HydrophobicContact CG-CD2 4.4Å; Y187-W240 AromaticContact CG-CE3 3.83Å; Y187-W240 HydrophobicContact CG-CE3 3.83Å; Y187-W240 PolarHBondContact O-N 2.98Å; D224-W240 HydrophobicContact CB-CB 3.88Å; D224-W240 WeakPolarHBondContact O-CB 3.24Å; D224-W240 PolarHBondContact O-N 3.22Å; W240-A242 HydrophobicContact CD2-CB 4.32Å; W240-A242 HydrophobicContact CH2-CB 4.2Å; W240-A242 HydrophobicContact CZ2-CB 3.3Å; W240-Q245 VanDerWaalsContact CD1-NE2 3.34Å; W240-Q245 VanDerWaalsContact O-CD 3.31Å; W240-Q245 WeakPolarHBondContact O-CG 3.24Å; W240-Q245 PolarHBondContact O-OE1 3.03Å; W240-T246 WeakPolarHBondContact O-CG2 3.4Å; W240-I253 HydrophobicContact CE3-CD1 3.95Å; W240-I253 HydrophobicContact CE3-CG1 3.74Å; W240-I253 HydrophobicContact CZ3-CD1 3.91Å; W240-I253 HydrophobicContact CZ3-CG1 4.05Å
241	G	98.4	Very high	98.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.155	C	C	.	.			trans	-125.6	5.3	-173.9	0	0	0	0	0	115.3	D243 G244 L251	G241-D243 VanDerWaalsContact C-N 3.26Å; G241-D243 PolarHBondContact O-N 2.9Å; G241-G244 WeakPolarHBondContact O-CA 3.38Å; G241-G244 PolarHBondContact O-N 3.36Å; G241-L251 CarbonylContact C-O 3.57Å; G241-L251 CarbonylContact O-C 3.07Å; G241-L251 VanDerWaalsContact O-CA 3.24Å; G241-L251 WeakPolarHBondContact O-CA 3.07Å
242	A	98.4	Very high	98.5	Very high	30 Å²	30	30.4 Å²	30.4	25%	0.248	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-25.6	-167.5	0	0	0	0	0	114.4	W240 L251 Q307	W240-A242 HydrophobicContact CD2-CB 4.32Å; W240-A242 HydrophobicContact CH2-CB 4.2Å; W240-A242 HydrophobicContact CZ2-CB 3.3Å; A242-L251 PolarHBondContact N-O 3.03Å; A242-Q307 PolarHBondContact O-NE2 3.47Å
243	D	98.1	Very high	98.5	Very high	26 Å²	26	30.2 Å²	30.2	14%	0.139	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	2.7	172.1	-63.4	-39	0	0	0	112.4	G241 G292 N293 Q307 M308	G241-D243 VanDerWaalsContact C-N 3.26Å; G241-D243 PolarHBondContact O-N 2.9Å; D243-G292 CarbonylContact O-C 3.49Å; D243-G292 VanDerWaalsContact O-CA 3.25Å; D243-G292 WeakPolarHBondContact O-CA 3.45Å; D243-N293 HydrophobicContact CB-CB 4.15Å; D243-Q307 HydrophobicContact CB-CG 4.48Å; D243-Q307 PolarHBondContact OD1-NE2 3.33Å; D243-M308 PolarHBondContact O-N 2.98Å
244	G	98.3	Very high	98.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.165	C	C	.	.	S	Bend	trans	82.8	11.5	-176	0	0	0	0	0	114.1	G241 T246 G247 M308	G241-G244 WeakPolarHBondContact O-CA 3.38Å; G241-G244 PolarHBondContact O-N 3.36Å; G244-T246 PolarHBondContact O-N 2.88Å; G244-G247 PolarHBondContact O-N 3.04Å; G244-M308 CarbonylContact C-O 3.45Å; G244-M308 WeakPolarHBondContact CA-O 3.47Å; G244-M308 VanDerWaalsContact O-O 3.06Å
245	Q	98.6	Very high	98.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-17.9	-172.2	60.3	-92.5	76.4	0	0	114.7	H225 W240 D277 S279 W291	H225-Q245 HydrophobicContact CB-CG 4.05Å; H225-Q245 PolarHBondContact CD2-O 2.9Å; H225-Q245 PolarHBondContact NE2-O 2.72Å; W240-Q245 VanDerWaalsContact CD1-NE2 3.34Å; W240-Q245 VanDerWaalsContact O-CD 3.31Å; W240-Q245 WeakPolarHBondContact O-CG 3.24Å; W240-Q245 PolarHBondContact O-OE1 3.03Å; Q245-D277 VanDerWaalsContact CB-O 3.27Å; Q245-D277 WeakPolarHBondContact CB-O 3.38Å; Q245-D277 PolarHBondContact NE2-OD1 2.91Å; Q245-S279 PolarHBondContact O-OG 3.44Å; Q245-W291 PolarHBondContact O-NE1 3.15Å
246	T	98.7	Very high	98.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-26.9	169.6	53.5	0	0	0	0	113	H225 S237 W240 G244 L248 V260	H225-T246 HydrophobicContact CB-CG2 4.39Å; S237-T246 VanDerWaalsContact CB-O 3.24Å; S237-T246 WeakPolarHBondContact CB-O 3.31Å; S237-T246 PolarHBondContact OG-O 2.82Å; W240-T246 WeakPolarHBondContact O-CG2 3.4Å; G244-T246 PolarHBondContact O-N 2.88Å; T246-L248 VanDerWaalsContact C-N 3.34Å; T246-L248 PolarHBondContact O-N 3.11Å; T246-V260 WeakPolarHBondContact O-CG2 3.45Å
247	G	98.5	Very high	98.4	Very high	2 Å²	2	31.7 Å²	31.7	2%	0.021	18%	0.184	C	C	.	.			trans	72.4	22.8	176.6	0	0	0	0	0	114.6	G244 N309 P311	G244-G247 PolarHBondContact O-N 3.04Å; G247-N309 CarbonylContact C-O 3.08Å; G247-N309 WeakPolarHBondContact CA-O 3.19Å; G247-P311 WeakPolarHBondContact O-CD 3.44Å
248	L	98.6	Very high	98.4	Very high	27 Å²	27	34.6 Å²	34.6	14%	0.141	20%	0.202	C	C	.	.	S	Bend	trans	-93.1	13	-171.4	-60.2	177.6	0	0	0	114.8	S237 T246 H250 V258 V260 N309	S237-L248 WeakPolarHBondContact OG-CD2 3.41Å; T246-L248 VanDerWaalsContact C-N 3.34Å; T246-L248 PolarHBondContact O-N 3.11Å; L248-H250 VanDerWaalsContact C-N 3.27Å; L248-H250 PolarHBondContact O-CD2 2.84Å; L248-H250 PolarHBondContact O-N 3.49Å; L248-V258 HydrophobicContact CD1-CB 3.91Å; L248-V258 HydrophobicContact CD1-CG1 4.44Å; L248-V258 HydrophobicContact CD1-CG2 4.32Å; L248-V258 HydrophobicContact CD2-CB 3.73Å; L248-V258 HydrophobicContact CD2-CG1 3.79Å; L248-V258 HydrophobicContact CG-CB 4.47Å; L248-V260 HydrophobicContact CD2-CG2 4.18Å; L248-N309 PolarHBondContact N-O 2.86Å; L248-N309 VanDerWaalsContact N-O 3.12Å
249	G	98.1	Very high	98.3	Very high	43 Å²	43	38.5 Å²	38.5	44%	0.443	22%	0.22	S	C	.	.	S	Bend	trans	78.5	5.7	-177.3	0	0	0	0	0	114.8	N309 S310	G249-N309 WeakPolarHBondContact CA-O 3.42Å; G249-N309 PolarHBondContact N-O 2.82Å; G249-S310 WeakPolarHBondContact CA-OG 3.29Å
250	H	98.1	Very high	98.3	Very high	69 Å²	69	38.8 Å²	38.8	32%	0.319	22%	0.221	S	C	.	.	S	Bend	trans	-147.6	167	178.5	61.7	65.8	0	0	0	111.4	L248 N252	L248-H250 VanDerWaalsContact C-N 3.27Å; L248-H250 PolarHBondContact O-CD2 2.84Å; L248-H250 PolarHBondContact O-N 3.49Å; H250-N252 PolarHBondContact ND1-N 3.36Å; H250-N252 PolarHBondContact ND1-O 2.76Å
251	L	98.2	Very high	98.2	Very high	73 Å²	73	36.1 Å²	36.1	38%	0.382	22%	0.221	S	C	.	.	S	Bend	trans	-100	4.4	-179.3	-58.6	177.9	0	0	0	114.3	G241 A242 N309	G241-L251 CarbonylContact C-O 3.57Å; G241-L251 CarbonylContact O-C 3.07Å; G241-L251 VanDerWaalsContact O-CA 3.24Å; G241-L251 WeakPolarHBondContact O-CA 3.07Å; A242-L251 PolarHBondContact N-O 3.03Å; L251-N309 HydrophobicContact CD2-CB 3.7Å; L251-N309 HydrophobicContact CG-CB 4.5Å
252	N	98.3	Very high	98.1	Very high	112 Å²	112	38.5 Å²	38.5	60%	0.599	25%	0.245	S	C	*	.	S	Bend	trans	-75	158	179.9	-56.4	-37.2	0	0	0	112.1	H250	H250-N252 PolarHBondContact ND1-N 3.36Å; H250-N252 PolarHBondContact ND1-O 2.76Å
253	I	98.5	Very high	98	Very high	73 Å²	73	41.8 Å²	41.8	37%	0.374	26%	0.255	S	S	.	.			trans	-61.6	139.8	168.5	-67.1	169.3	0	0	0	110.4	Y187 I194 W240	Y187-I253 HydrophobicContact CD1-CD1 4.21Å; Y187-I253 WeakPolarHBondContact O-CG2 3.4Å; I194-I253 HydrophobicContact CD1-CG2 3.55Å; W240-I253 HydrophobicContact CE3-CD1 3.95Å; W240-I253 HydrophobicContact CE3-CG1 3.74Å; W240-I253 HydrophobicContact CZ3-CD1 3.91Å; W240-I253 HydrophobicContact CZ3-CG1 4.05Å
254	S	98.1	Very high	98	Very high	11 Å²	11	41 Å²	41	8%	0.077	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	117.6	169.2	-176.5	0	0	0	0	110.7	C238 G239 S256	C238-S254 WeakPolarHBondContact CB-O 3.35Å; G239-S254 PolarHBondContact N-O 3.23Å; G239-S254 PolarHBondContact O-N 3.45Å; S254-S256 PolarHBondContact OG-O 3.45Å
255	S	97.8	Very high	97.9	Very high	41 Å²	41	44.5 Å²	44.5	29%	0.287	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	9	-175.9	65.1	0	0	0	0	114.6	G191 R192	G191-S255 CarbonylContact C-O 3.2Å; R192-S255 CarbonylContact C-O 3.11Å; R192-S255 VanDerWaalsContact CA-O 3.26Å; R192-S255 WeakPolarHBondContact CA-O 3.49Å; R192-S255 PolarHBondContact N-O 3.05Å
256	S	97.6	Very high	97.7	Very high	61 Å²	61	48.8 Å²	48.8	43%	0.427	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	151.7	174.8	53.9	0	0	0	0	109	C238 S254 V258	C238-S256 WeakPolarHBondContact CB-O 3.44Å; S254-S256 PolarHBondContact OG-O 3.45Å; S256-V258 PolarHBondContact O-N 2.9Å
257	P	98.3	Very high	97.7	Very high	12 Å²	12	50.2 Å²	50.2	8%	0.078	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	126.4	174.9	-19.8	30.3	0	0	0	111.4	I209 F212 F228 Y236 S237	I209-P257 HydrophobicContact CG2-CG 3.2Å; F212-P257 HydrophobicContact CD1-CB 4.27Å; F212-P257 HydrophobicContact CE1-CB 3.62Å; F212-P257 HydrophobicContact CE1-CG 3.91Å; F212-P257 HydrophobicContact CZ-CB 4.11Å; F212-P257 HydrophobicContact CZ-CG 3.85Å; F228-P257 HydrophobicContact CD2-CB 4.49Å; F228-P257 HydrophobicContact CE2-CB 4.45Å; F228-P257 HydrophobicContact CE2-CG 4.36Å; Y236-P257 HydrophobicContact CD1-CB 4.35Å; S237-P257 WeakPolarHBondContact O-CA 3.49Å
258	V	98.6	Very high	97.6	Very high	62 Å²	62	53.6 Å²	53.6	38%	0.376	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	140	174.2	-178.1	0	0	0	0	108.5	Y236 S237 L248 S256 V260	Y236-V258 CarbonylContact C-O 3.54Å; Y236-V258 WeakPolarHBondContact CA-O 3.23Å; Y236-V258 VanDerWaalsContact CD1-C 3.49Å; S237-V258 PolarHBondContact N-O 3.34Å; S237-V258 PolarHBondContact O-N 2.7Å; L248-V258 HydrophobicContact CD1-CB 3.91Å; L248-V258 HydrophobicContact CD1-CG1 4.44Å; L248-V258 HydrophobicContact CD1-CG2 4.32Å; L248-V258 HydrophobicContact CD2-CB 3.73Å; L248-V258 HydrophobicContact CD2-CG1 3.79Å; L248-V258 HydrophobicContact CG-CB 4.47Å; S256-V258 PolarHBondContact O-N 2.9Å; V258-V260 PolarHBondContact O-N 2.87Å
259	E	98.5	Very high	97.6	Very high	82 Å²	82	52.4 Å²	52.4	38%	0.383	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	129.6	177.4	-169.2	168.5	155.2	0	0	109.9	K234 Y236	K234-E259 WeakPolarHBondContact CD-OE1 3.47Å; K234-E259 WeakPolarHBondContact CE-OE1 3.49Å; K234-E259 VanDerWaalsContact NZ-CD 3.31Å; K234-E259 IonicContact NZ-OE1 3.01Å; K234-E259 PolarHBondContact NZ-OE1 3.33Å; K234-E259 IonicContact NZ-OE2 3.89Å; K234-E259 PolarHBondContact NZ-OE2 2.85Å; Y236-E259 HydrophobicContact CD1-CB 4.06Å; Y236-E259 VanDerWaalsContact CD1-N 3.33Å; Y236-E259 HydrophobicContact CE1-CB 3.61Å; Y236-E259 HydrophobicContact CE1-CG 4.3Å; Y236-E259 HydrophobicContact CE2-CG 4.43Å; Y236-E259 PolarHBondContact OH-OE2 2.9Å
260	V	98.6	Very high	97.6	Very high	5 Å²	5	53.5 Å²	53.5	3%	0.03	34%	0.338	C	S	.	.			trans	-80.7	119.4	178.7	177	0	0	0	0	108.5	V235 S237 T246 L248 V258 L264 P311	V235-V260 HydrophobicContact CB-CB 4.2Å; V235-V260 HydrophobicContact CB-CG2 4.45Å; V235-V260 HydrophobicContact CG1-CB 4.21Å; V235-V260 HydrophobicContact CG1-CG2 3.97Å; V235-V260 PolarHBondContact O-N 2.96Å; S237-V260 WeakPolarHBondContact OG-CG2 3.5Å; T246-V260 WeakPolarHBondContact O-CG2 3.45Å; L248-V260 HydrophobicContact CD2-CG2 4.18Å; V258-V260 PolarHBondContact O-N 2.87Å; V260-L264 HydrophobicContact CG1-CD1 4.15Å; V260-P311 HydrophobicContact CG1-CG 3.29Å
261	G	96.9	Very high	97.7	Very high	30 Å²	30	51.1 Å²	51.1	31%	0.309	33%	0.327	S	S	.	.			trans	-98.4	-135.7	-179.1	0	0	0	0	0	113.3	L264 P311	G261-L264 PolarHBondContact O-N 2.95Å; G261-P311 WeakPolarHBondContact O-CG 3.41Å
262	G	94.9	Very high	97.7	Very high	50 Å²	50	47.7 Å²	47.7	52%	0.515	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	68	-141.4	-177.7	0	0	0	0	0	111.8	L264 A265	G262-L264 PolarHBondContact O-N 2.78Å; G262-A265 VanDerWaalsContact O-CB 3.28Å; G262-A265 WeakPolarHBondContact O-CB 3.42Å; G262-A265 PolarHBondContact O-N 3.27Å
263	E	97.6	Very high	97.7	Very high	98 Å²	98	43.7 Å²	43.7	46%	0.458	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-70.6	-7.6	179.7	-65.6	-177.3	-161.3	0	0	113.7	A265 V267 F289 P311 H313	E263-A265 VanDerWaalsContact C-N 3.32Å; E263-V267 VanDerWaalsContact O-CG2 3.28Å; E263-V267 WeakPolarHBondContact O-CG2 3.04Å; E263-F289 HydrophobicContact CB-CD1 4.26Å; E263-F289 HydrophobicContact CB-CE1 4.13Å; E263-F289 WeakPolarHBondContact O-CE1 3.4Å; E263-P311 PolarHBondContact N-O 2.86Å; E263-H313 VanDerWaalsContact OE2-CB 3.29Å; E263-H313 WeakPolarHBondContact OE2-CB 3.44Å; E263-H313 PolarHBondContact OE2-N 2.9Å
264	L	97	Very high	97.7	Very high	10 Å²	10	40.5 Å²	40.5	5%	0.052	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-81.8	-9.1	169.6	-77.9	-177.7	0	0	0	113.5	V235 V260 G261 G262 G266 V267 V269 A281 F289 W291 P311	V235-L264 HydrophobicContact CG2-CD1 4.41Å; V260-L264 HydrophobicContact CG1-CD1 4.15Å; G261-L264 PolarHBondContact O-N 2.95Å; G262-L264 PolarHBondContact O-N 2.78Å; L264-G266 PolarHBondContact O-N 2.81Å; L264-G266 VanDerWaalsContact O-N 3.15Å; L264-V267 HydrophobicContact CD2-CB 4.2Å; L264-V267 HydrophobicContact CD2-CG1 4.19Å; L264-V267 WeakPolarHBondContact O-CB 3.45Å; L264-V267 PolarHBondContact O-N 3.22Å; L264-V269 HydrophobicContact CD2-CG2 3.84Å; L264-A281 HydrophobicContact CD1-CB 4.04Å; L264-A281 HydrophobicContact CD2-CB 4.18Å; L264-F289 HydrophobicContact CD2-CB 3.74Å; L264-F289 HydrophobicContact CD2-CD1 3.83Å; L264-F289 HydrophobicContact CD2-CD2 3.61Å; L264-F289 HydrophobicContact CD2-CE1 4.34Å; L264-F289 HydrophobicContact CD2-CE2 4.17Å; L264-F289 HydrophobicContact CD2-CG 3.44Å; L264-F289 VanDerWaalsContact CD2-CG 3.44Å; L264-F289 HydrophobicContact CG-CB 4.18Å; L264-F289 HydrophobicContact CG-CD1 4.3Å; L264-F289 HydrophobicContact CG-CG 4.19Å; L264-W291 HydrophobicContact CD1-CE3 4.37Å; L264-W291 HydrophobicContact CD1-CH2 3.84Å; L264-W291 HydrophobicContact CD1-CZ3 3.6Å; L264-P311 HydrophobicContact CB-CB 4.28Å; L264-P311 HydrophobicContact CB-CG 4.32Å; L264-P311 HydrophobicContact CD1-CB 3.81Å; L264-P311 HydrophobicContact CD1-CG 3.75Å; L264-P311 HydrophobicContact CG-CB 3.67Å; L264-P311 HydrophobicContact CG-CG 4.01Å
265	A	95.7	Very high	97.8	Very high	73 Å²	73	40.7 Å²	40.7	60%	0.603	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	118.3	178.2	0	0	0	0	0	110.7	G262 E263 V267	G262-A265 VanDerWaalsContact O-CB 3.28Å; G262-A265 WeakPolarHBondContact O-CB 3.42Å; G262-A265 PolarHBondContact O-N 3.27Å; E263-A265 VanDerWaalsContact C-N 3.32Å; A265-V267 VanDerWaalsContact C-N 3.3Å
266	G	94.9	Very high	97.7	Very high	91 Å²	91	38.8 Å²	38.8	94%	0.938	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	2.4	-178.1	0	0	0	0	0	115.1	L264	L264-G266 PolarHBondContact O-N 2.81Å; L264-G266 VanDerWaalsContact O-N 3.15Å
267	V	98.1	Very high	97.8	Very high	30 Å²	30	37.2 Å²	37.2	18%	0.182	25%	0.245	C	C	.	.			trans	-83.7	131.2	174.7	177.9	0	0	0	0	109.9	E263 L264 A265 V269 F289	E263-V267 VanDerWaalsContact O-CG2 3.28Å; E263-V267 WeakPolarHBondContact O-CG2 3.04Å; L264-V267 HydrophobicContact CD2-CB 4.2Å; L264-V267 HydrophobicContact CD2-CG1 4.19Å; L264-V267 WeakPolarHBondContact O-CB 3.45Å; L264-V267 PolarHBondContact O-N 3.22Å; A265-V267 VanDerWaalsContact C-N 3.3Å; V267-V269 HydrophobicContact CG1-CG2 4.15Å; V267-V269 PolarHBondContact O-N 2.77Å; V267-F289 HydrophobicContact CG1-CE2 3.79Å; V267-F289 HydrophobicContact CG1-CZ 4.08Å; V267-F289 HydrophobicContact CG2-CE1 4.26Å; V267-F289 HydrophobicContact CG2-CE2 4.34Å; V267-F289 HydrophobicContact CG2-CZ 3.78Å
268	D	97.7	Very high	97.8	Very high	72 Å²	72	36.7 Å²	36.7	39%	0.385	24%	0.241	S	C	.	.			trans	-82.8	95.2	172.6	-172.2	-4	0	0	0	110	S283 R284	D268-S283 CarbonylContact O-C 3.07Å; D268-S283 WeakPolarHBondContact O-CA 3.33Å; D268-R284 HydrophobicContact CB-CG 4.49Å; D268-R284 VanDerWaalsContact CG-CD 3.48Å; D268-R284 PolarHBondContact O-N 2.76Å; D268-R284 IonicContact OD1-CZ 2.69Å; D268-R284 IonicContact OD1-NE 3.28Å; D268-R284 PolarHBondContact OD1-NE 3.02Å; D268-R284 IonicContact OD1-NH2 2.91Å; D268-R284 WeakPolarHBondContact OD2-CD 3.36Å; D268-R284 IonicContact OD2-NE 2.84Å; D268-R284 PolarHBondContact OD2-NE 3.1Å
269	V	98.8	Very high	97.8	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.018	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	131.3	-179.2	179.3	0	0	0	0	110.9	L229 G233 V235 L264 V267 Q271 I272 A281 V282	L229-V269 HydrophobicContact CD1-CB 3.74Å; L229-V269 HydrophobicContact CD1-CG1 3.72Å; L229-V269 HydrophobicContact CD2-CG1 4.3Å; G233-V269 WeakPolarHBondContact CA-O 3.24Å; G233-V269 WeakPolarHBondContact O-CB 3.15Å; G233-V269 PolarHBondContact O-N 3.23Å; V235-V269 HydrophobicContact CG2-CB 4.04Å; V235-V269 HydrophobicContact CG2-CG1 3.94Å; V235-V269 HydrophobicContact CG2-CG2 3.89Å; L264-V269 HydrophobicContact CD2-CG2 3.84Å; V267-V269 HydrophobicContact CG1-CG2 4.15Å; V267-V269 PolarHBondContact O-N 2.77Å; V269-Q271 WeakPolarHBondContact CG1-O 3.45Å; V269-I272 HydrophobicContact CG1-CG2 4.2Å; V269-A281 HydrophobicContact CG1-CB 3.94Å; V269-A281 HydrophobicContact CG2-CB 4.33Å; V269-V282 WeakPolarHBondContact CG1-O 3.47Å
270	Q	98.5	Very high	97.8	Very high	65 Å²	65	29.9 Å²	29.9	30%	0.304	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-22.7	175.7	70.7	175.4	11.3	0	0	113.9	V282 R284 V323	Q270-V282 HydrophobicContact CG-CB 4.35Å; Q270-V282 HydrophobicContact CG-CG1 4.21Å; Q270-V282 WeakPolarHBondContact CG-O 3.39Å; Q270-V282 PolarHBondContact N-O 2.84Å; Q270-R284 HydrophobicContact CB-CG 3.88Å; Q270-V323 PolarHBondContact NE2-O 2.8Å
271	Q	98.8	Very high	97.8	Very high	20 Å²	20	29.6 Å²	29.6	9%	0.093	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	138.3	-178.6	-164.9	-148.4	-1.6	0	0	111	V269 A281 V282 Q324 A325	V269-Q271 WeakPolarHBondContact CG1-O 3.45Å; Q271-A281 CarbonylContact O-C 3.51Å; Q271-A281 VanDerWaalsContact O-CA 3.31Å; Q271-A281 WeakPolarHBondContact O-CA 3.46Å; Q271-V282 HydrophobicContact CB-CB 4.19Å; Q271-V282 PolarHBondContact N-O 2.81Å; Q271-V282 PolarHBondContact O-N 3.03Å; Q271-Q324 VanDerWaalsContact OE1-CA 3.28Å; Q271-A325 PolarHBondContact NE2-O 2.96Å
272	I	98.9	Very high	97.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	150.6	163.5	53.9	169.7	0	0	0	110.7	Q218 A220 L227 L229 V235 V269 L280	Q218-I272 HydrophobicContact CB-CG1 4.28Å; Q218-I272 HydrophobicContact CG-CG1 4.23Å; Q218-I272 PolarHBondContact NE2-O 2.83Å; A220-I272 HydrophobicContact CB-CD1 4.27Å; A220-I272 HydrophobicContact CB-CG1 4.45Å; L227-I272 HydrophobicContact CB-CD1 3.67Å; L227-I272 WeakPolarHBondContact O-CD1 3.49Å; L229-I272 HydrophobicContact CB-CD1 3.91Å; L229-I272 HydrophobicContact CB-CG1 3.97Å; L229-I272 HydrophobicContact CB-CG2 4.18Å; V235-I272 HydrophobicContact CG1-CG2 4.01Å; V235-I272 HydrophobicContact CG2-CG2 3.75Å; V269-I272 HydrophobicContact CG1-CG2 4.2Å; I272-L280 CarbonylContact C-O 3.59Å; I272-L280 WeakPolarHBondContact CA-O 3.38Å
273	N	98.8	Very high	98.1	Very high	28 Å²	28	25.9 Å²	25.9	15%	0.15	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	140.9	171.2	-165.8	-94.6	0	0	0	112.3	L280 A326 C327	N273-L280 PolarHBondContact N-O 3.28Å; N273-L280 PolarHBondContact O-N 2.91Å; N273-A326 VanDerWaalsContact OD1-CA 3.27Å; N273-A326 WeakPolarHBondContact OD1-CA 3.44Å; N273-C327 PolarHBondContact OD1-N 2.79Å
274	T	98.8	Very high	98.1	Very high	7 Å²	7	27.3 Å²	27.3	4%	0.043	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	160.3	170.2	-171.6	0	0	0	0	109.2	A220 H225 L227 G276 C278 C327	A220-T274 HydrophobicContact CB-CG2 3.97Å; H225-T274 PolarHBondContact CE1-OG1 2.85Å; H225-T274 VanDerWaalsContact CE1-OG1 3.24Å; H225-T274 PolarHBondContact NE2-OG1 3.01Å; L227-T274 HydrophobicContact CD1-CG2 3.69Å; L227-T274 HydrophobicContact CG-CG2 3.95Å; T274-G276 PolarHBondContact OG1-O 2.83Å; T274-C278 WeakPolarHBondContact CB-O 3.49Å; T274-C278 PolarHBondContact OG1-O 2.8Å; T274-C327 VanDerWaalsContact CA-SG 3.58Å
275	Y	98.4	Very high	98.1	Very high	15 Å²	15	31.5 Å²	31.5	6%	0.059	19%	0.188	C	C	.	.	S	Bend	trans	-153.2	-42.5	170.7	-168.7	-100.5	0	0	0	111.4	C98 Y100 G222 Q223 L387 G436 V437	C98-Y275 WeakPolarHBondContact O-CE2 3.33Å; C98-Y275 PolarHBondContact O-OH 3.39Å; Y100-Y275 HydrophobicContact CD1-CE1 4.26Å; Y100-Y275 AromaticContact CD1-CZ 3.92Å; Y100-Y275 VanDerWaalsContact CD1-OH 3.32Å; Y100-Y275 WeakPolarHBondContact CD1-OH 3.47Å; Y100-Y275 HydrophobicContact CE1-CD1 4.28Å; Y100-Y275 AromaticContact CE1-CE1 3.52Å; Y100-Y275 HydrophobicContact CE1-CE1 3.52Å; Y100-Y275 HydrophobicContact CE1-CE2 4.35Å; Y100-Y275 AromaticContact CE1-CZ 3.56Å; Y100-Y275 WeakPolarHBondContact CE1-OH 3.35Å; Y100-Y275 PolarHBondContact OH-O 3.17Å; G222-Y275 CarbonylContact C-O 2.93Å; G222-Y275 WeakPolarHBondContact CA-O 3.27Å; Q223-Y275 PolarHBondContact N-O 2.99Å; Q223-Y275 VanDerWaalsContact N-O 3.1Å; Y275-L387 HydrophobicContact CD1-CB 4.24Å; Y275-L387 HydrophobicContact CD1-CD1 4.09Å; Y275-L387 HydrophobicContact CE1-CB 3.88Å; Y275-L387 HydrophobicContact CE1-CD1 4.19Å; Y275-G436 VanDerWaalsContact OH-CA 3.25Å; Y275-G436 WeakPolarHBondContact OH-CA 3.45Å; Y275-V437 HydrophobicContact CE1-CG2 4.3Å; Y275-V437 PolarHBondContact OH-N 3.06Å
276	G	97.3	Very high	98.2	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.01	16%	0.163	C	C	.	.	S	Bend	trans	-90.9	-134.3	166.3	0	0	0	0	0	111.9	G222 Q223 H225 T274 G328	G222-G276 WeakPolarHBondContact CA-O 3.45Å; Q223-G276 PolarHBondContact N-O 3.41Å; Q223-G276 VanDerWaalsContact N-O 3.16Å; H225-G276 PolarHBondContact CE1-O 3.18Å; H225-G276 VanDerWaalsContact CE1-O 3.31Å; T274-G276 PolarHBondContact OG1-O 2.83Å; G276-G328 PolarHBondContact N-O 2.68Å
277	D	98.5	Very high	98.4	Very high	28 Å²	28	27.6 Å²	27.6	15%	0.15	14%	0.135	C	C	.	.	S	Bend	trans	-104	6.5	-180	-62.3	-55.8	0	0	0	113.4	Q245 G292 N293	Q245-D277 VanDerWaalsContact CB-O 3.27Å; Q245-D277 WeakPolarHBondContact CB-O 3.38Å; Q245-D277 PolarHBondContact NE2-OD1 2.91Å; D277-G292 CarbonylContact O-C 3.56Å; D277-G292 WeakPolarHBondContact O-CA 3.5Å; D277-N293 HydrophobicContact CB-CB 3.78Å; D277-N293 PolarHBondContact O-N 2.89Å
278	C	98.5	Very high	98.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	135.9	170.2	-175.8	0	0	0	0	109.9	T274 C327	T274-C278 WeakPolarHBondContact CB-O 3.49Å; T274-C278 PolarHBondContact OG1-O 2.8Å; C278-C327 PolarHBondContact O-SG 3.21Å
279	S	98.8	Very high	98.5	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	136.8	-178.2	-67.3	0	0	0	0	110.3	H225 Q245 G290 W291	H225-S279 PolarHBondContact NE2-OG 3.41Å; Q245-S279 PolarHBondContact O-OG 3.44Å; S279-G290 VanDerWaalsContact O-CA 3.3Å; S279-G290 WeakPolarHBondContact O-CA 3.42Å; S279-W291 VanDerWaalsContact CB-NE1 3.25Å; S279-W291 PolarHBondContact N-O 2.84Å; S279-W291 PolarHBondContact O-N 2.82Å
280	L	98.9	Very high	98.4	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	147.3	-178.4	-61.2	175.8	0	0	0	111.5	I272 N273 L288 F289 L299 L314 A325 C327 V332	I272-L280 CarbonylContact C-O 3.59Å; I272-L280 WeakPolarHBondContact CA-O 3.38Å; N273-L280 PolarHBondContact N-O 3.28Å; N273-L280 PolarHBondContact O-N 2.91Å; L280-L288 HydrophobicContact CB-CD1 4.45Å; L280-F289 WeakPolarHBondContact CA-O 3.31Å; L280-L299 HydrophobicContact CD2-CD2 4.27Å; L280-L314 HydrophobicContact CD2-CD1 4.31Å; L280-A325 HydrophobicContact CB-CB 4.4Å; L280-A325 HydrophobicContact CD1-CB 4.07Å; L280-C327 HydrophobicContact CD1-CB 3.71Å; L280-C327 HydrophobicContact CG-CB 4.28Å; L280-V332 HydrophobicContact CD1-CG1 3.55Å; L280-V332 HydrophobicContact CD1-CG2 4.47Å
281	A	98.9	Very high	98.5	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	138.7	169.1	0	0	0	0	0	110.8	L264 V269 Q271 F289 W291	L264-A281 HydrophobicContact CD1-CB 4.04Å; L264-A281 HydrophobicContact CD2-CB 4.18Å; V269-A281 HydrophobicContact CG1-CB 3.94Å; V269-A281 HydrophobicContact CG2-CB 4.33Å; Q271-A281 CarbonylContact O-C 3.51Å; Q271-A281 VanDerWaalsContact O-CA 3.31Å; Q271-A281 WeakPolarHBondContact O-CA 3.46Å; A281-F289 HydrophobicContact CB-CB 4.43Å; A281-F289 PolarHBondContact N-O 3.1Å; A281-F289 PolarHBondContact O-N 2.95Å; A281-W291 HydrophobicContact CB-CH2 3.92Å; A281-W291 HydrophobicContact CB-CZ3 3.81Å
282	V	98.9	Very high	98.4	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.5	173.9	-175.8	0	0	0	0	108.1	V269 Q270 Q271 Q287 L288 V322 A325	V269-V282 WeakPolarHBondContact CG1-O 3.47Å; Q270-V282 HydrophobicContact CG-CB 4.35Å; Q270-V282 HydrophobicContact CG-CG1 4.21Å; Q270-V282 WeakPolarHBondContact CG-O 3.39Å; Q270-V282 PolarHBondContact N-O 2.84Å; Q271-V282 HydrophobicContact CB-CB 4.19Å; Q271-V282 PolarHBondContact N-O 2.81Å; Q271-V282 PolarHBondContact O-N 3.03Å; V282-Q287 WeakPolarHBondContact CA-O 3.39Å; V282-L288 HydrophobicContact CG2-CD1 3.84Å; V282-V322 HydrophobicContact CG1-CB 4.22Å; V282-V322 HydrophobicContact CG1-CG1 3.9Å; V282-V322 WeakPolarHBondContact CG1-O 3.23Å; V282-V322 HydrophobicContact CG2-CG1 3.95Å; V282-A325 HydrophobicContact CG2-CB 3.57Å
283	S	98.6	Very high	98.4	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.007	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	163.6	174.9	61.1	0	0	0	0	112.4	D268 D285 G286 Q287	D268-S283 CarbonylContact O-C 3.07Å; D268-S283 WeakPolarHBondContact O-CA 3.33Å; S283-D285 VanDerWaalsContact C-N 3.29Å; S283-D285 WeakPolarHBondContact CB-OD1 3.27Å; S283-D285 PolarHBondContact O-N 3.22Å; S283-D285 PolarHBondContact OG-OD1 3.3Å; S283-G286 WeakPolarHBondContact O-CA 3.44Å; S283-G286 PolarHBondContact O-N 3.01Å; S283-G286 PolarHBondContact OG-N 3.21Å; S283-Q287 PolarHBondContact N-O 3.45Å; S283-Q287 WeakPolarHBondContact OG-CA 3.38Å; S283-Q287 VanDerWaalsContact OG-CB 3.29Å; S283-Q287 WeakPolarHBondContact OG-CB 3.15Å; S283-Q287 PolarHBondContact OG-N 3.01Å; S283-Q287 PolarHBondContact OG-O 2.9Å
284	R	97.7	Very high	98.3	Very high	129 Å²	129	18.4 Å²	18.4	49%	0.487	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-29.6	178	-73.4	-168	-166.5	-83.9	-3.3	114.6	D268 Q270 G286 K321	D268-R284 HydrophobicContact CB-CG 4.49Å; D268-R284 VanDerWaalsContact CG-CD 3.48Å; D268-R284 PolarHBondContact O-N 2.76Å; D268-R284 IonicContact OD1-CZ 2.69Å; D268-R284 IonicContact OD1-NE 3.28Å; D268-R284 PolarHBondContact OD1-NE 3.02Å; D268-R284 IonicContact OD1-NH2 2.91Å; D268-R284 WeakPolarHBondContact OD2-CD 3.36Å; D268-R284 IonicContact OD2-NE 2.84Å; D268-R284 PolarHBondContact OD2-NE 3.1Å; Q270-R284 HydrophobicContact CB-CG 3.88Å; R284-G286 PolarHBondContact O-N 3.17Å; R284-K321 VanDerWaalsContact O-CE 3.26Å; R284-K321 WeakPolarHBondContact O-CE 3.36Å; R284-K321 PolarHBondContact O-NZ 2.85Å
285	D	97.2	Very high	98.3	Very high	97 Å²	97	23.1 Å²	23.1	52%	0.519	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-3.1	172.2	67.6	-21.6	0	0	0	112.4	S283 K321	S283-D285 VanDerWaalsContact C-N 3.29Å; S283-D285 WeakPolarHBondContact CB-OD1 3.27Å; S283-D285 PolarHBondContact O-N 3.22Å; S283-D285 PolarHBondContact OG-OD1 3.3Å; D285-K321 VanDerWaalsContact C-CE 3.45Å; D285-K321 WeakPolarHBondContact O-CE 3.38Å
286	G	97.9	Very high	98.2	Very high	8 Å²	8	26.6 Å²	26.6	8%	0.082	12%	0.124	C	C	.	.			trans	82.8	26.6	169.3	0	0	0	0	0	114.5	S283 R284 V322	S283-G286 WeakPolarHBondContact O-CA 3.44Å; S283-G286 PolarHBondContact O-N 3.01Å; S283-G286 PolarHBondContact OG-N 3.21Å; R284-G286 PolarHBondContact O-N 3.17Å; G286-V322 WeakPolarHBondContact CA-O 3.36Å; G286-V322 WeakPolarHBondContact O-CB 3.08Å; G286-V322 PolarHBondContact O-N 3.1Å; G286-V322 VanDerWaalsContact O-N 3.07Å
287	Q	98.3	Very high	98.2	Very high	74 Å²	74	31.2 Å²	31.2	35%	0.346	14%	0.141	S	C	.	.			trans	-79	152.4	164.8	-55.2	-176.7	-48.3	0	0	110	V282 S283 F289	V282-Q287 WeakPolarHBondContact CA-O 3.39Å; S283-Q287 PolarHBondContact N-O 3.45Å; S283-Q287 WeakPolarHBondContact OG-CA 3.38Å; S283-Q287 VanDerWaalsContact OG-CB 3.29Å; S283-Q287 WeakPolarHBondContact OG-CB 3.15Å; S283-Q287 PolarHBondContact OG-N 3.01Å; S283-Q287 PolarHBondContact OG-O 2.9Å; Q287-F289 HydrophobicContact CB-CE2 3.81Å; Q287-F289 HydrophobicContact CB-CZ 4.33Å
288	L	98.7	Very high	98.1	Very high	2 Å²	2	30 Å²	30	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	134.7	176.8	-175.2	73.7	0	0	0	109.5	L280 V282 H313 L314 L316 A325 V334 W344	L280-L288 HydrophobicContact CB-CD1 4.45Å; V282-L288 HydrophobicContact CG2-CD1 3.84Å; L288-H313 PolarHBondContact O-CD2 3.47Å; L288-L314 HydrophobicContact CB-CB 4.46Å; L288-L314 HydrophobicContact CD2-CB 4.27Å; L288-L314 HydrophobicContact CD2-CD1 3.57Å; L288-L314 HydrophobicContact CG-CB 4.5Å; L288-L314 HydrophobicContact CG-CD1 3.97Å; L288-L314 PolarHBondContact O-N 3.31Å; L288-L316 HydrophobicContact CB-CD1 4.02Å; L288-L316 HydrophobicContact CB-CG 4.4Å; L288-L316 HydrophobicContact CD2-CD1 3.88Å; L288-L316 HydrophobicContact CD2-CD2 4.23Å; L288-L316 HydrophobicContact CD2-CG 4.42Å; L288-A325 HydrophobicContact CD1-CB 3.67Å; L288-V334 HydrophobicContact CD1-CG1 4.47Å; L288-V334 HydrophobicContact CD2-CG1 3.98Å; L288-W344 HydrophobicContact CD2-CH2 3.75Å; L288-W344 HydrophobicContact CD2-CZ2 4.02Å
289	F	98.8	Very high	98.1	Very high	5 Å²	5	30 Å²	30	2%	0.022	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	146.3	172.5	-59.7	-100.5	0	0	0	109.4	E263 L264 V267 L280 A281 Q287 R312 H313	E263-F289 HydrophobicContact CB-CD1 4.26Å; E263-F289 HydrophobicContact CB-CE1 4.13Å; E263-F289 WeakPolarHBondContact O-CE1 3.4Å; L264-F289 HydrophobicContact CD2-CB 3.74Å; L264-F289 HydrophobicContact CD2-CD1 3.83Å; L264-F289 HydrophobicContact CD2-CD2 3.61Å; L264-F289 HydrophobicContact CD2-CE1 4.34Å; L264-F289 HydrophobicContact CD2-CE2 4.17Å; L264-F289 HydrophobicContact CD2-CG 3.44Å; L264-F289 VanDerWaalsContact CD2-CG 3.44Å; L264-F289 HydrophobicContact CG-CB 4.18Å; L264-F289 HydrophobicContact CG-CD1 4.3Å; L264-F289 HydrophobicContact CG-CG 4.19Å; V267-F289 HydrophobicContact CG1-CE2 3.79Å; V267-F289 HydrophobicContact CG1-CZ 4.08Å; V267-F289 HydrophobicContact CG2-CE1 4.26Å; V267-F289 HydrophobicContact CG2-CE2 4.34Å; V267-F289 HydrophobicContact CG2-CZ 3.78Å; L280-F289 WeakPolarHBondContact CA-O 3.31Å; A281-F289 HydrophobicContact CB-CB 4.43Å; A281-F289 PolarHBondContact N-O 3.1Å; A281-F289 PolarHBondContact O-N 2.95Å; Q287-F289 HydrophobicContact CB-CE2 3.81Å; Q287-F289 HydrophobicContact CB-CZ 4.33Å; F289-R312 CarbonylContact C-O 3.5Å; F289-R312 WeakPolarHBondContact CA-O 3.35Å; F289-H313 HydrophobicContact CD1-CB 3.98Å; F289-H313 HydrophobicContact CE1-CB 3.76Å; F289-H313 HydrophobicContact CZ-CB 4.45Å
290	G	98.5	Very high	97.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	152.2	178.6	0	0	0	0	0	114	S279 R312	S279-G290 VanDerWaalsContact O-CA 3.3Å; S279-G290 WeakPolarHBondContact O-CA 3.42Å; G290-R312 PolarHBondContact N-O 3.17Å; G290-R312 PolarHBondContact O-N 3.38Å; G290-R312 VanDerWaalsContact O-N 3.07Å
291	W	98.8	Very high	97.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	175.4	176.6	62.6	97.3	0	0	0	110.7	L227 V235 Q245 L264 S279 A281 L299 M308 P311	L227-W291 HydrophobicContact CD1-CZ2 4.13Å; L227-W291 HydrophobicContact CD2-CZ2 4.12Å; V235-W291 HydrophobicContact CG1-CH2 4.46Å; V235-W291 HydrophobicContact CG1-CZ2 4.49Å; Q245-W291 PolarHBondContact O-NE1 3.15Å; L264-W291 HydrophobicContact CD1-CE3 4.37Å; L264-W291 HydrophobicContact CD1-CH2 3.84Å; L264-W291 HydrophobicContact CD1-CZ3 3.6Å; S279-W291 VanDerWaalsContact CB-NE1 3.25Å; S279-W291 PolarHBondContact N-O 2.84Å; S279-W291 PolarHBondContact O-N 2.82Å; A281-W291 HydrophobicContact CB-CH2 3.92Å; A281-W291 HydrophobicContact CB-CZ3 3.81Å; W291-L299 VanDerWaalsContact C-CD1 3.47Å; W291-L299 VanDerWaalsContact CA-CD1 3.48Å; W291-M308 HydrophobicContact CB-CB 4.43Å; W291-P311 HydrophobicContact CD2-CB 4.27Å; W291-P311 HydrophobicContact CD2-CG 3.96Å; W291-P311 HydrophobicContact CE3-CB 3.68Å; W291-P311 HydrophobicContact CE3-CG 3.79Å; W291-P311 HydrophobicContact CG-CG 4.38Å; W291-P311 HydrophobicContact CZ3-CB 4.24Å; W291-P311 HydrophobicContact CZ3-CG 4.3Å
292	G	98.6	Very high	97.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	92.1	-148.5	-174.9	0	0	0	0	0	113.8	D243 D277 S294 M308	D243-G292 CarbonylContact O-C 3.49Å; D243-G292 VanDerWaalsContact O-CA 3.25Å; D243-G292 WeakPolarHBondContact O-CA 3.45Å; D277-G292 CarbonylContact O-C 3.56Å; D277-G292 WeakPolarHBondContact O-CA 3.5Å; G292-S294 PolarHBondContact O-N 2.98Å; G292-M308 PolarHBondContact N-O 3.25Å; G292-M308 WeakPolarHBondContact O-CB 3.36Å; G292-M308 PolarHBondContact O-N 2.99Å
293	N	98.3	Very high	97	Very high	8 Å²	8	35.8 Å²	35.8	4%	0.043	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	132.5	179.7	-178.3	-73.6	0	0	0	111.3	D243 D277 E295 Q298	D243-N293 HydrophobicContact CB-CB 4.15Å; D277-N293 HydrophobicContact CB-CB 3.78Å; D277-N293 PolarHBondContact O-N 2.89Å; N293-E295 PolarHBondContact ND2-OE2 2.93Å; N293-E295 PolarHBondContact OD1-N 2.78Å; N293-Q298 PolarHBondContact OD1-NE2 2.96Å
294	S	97.2	Very high	96.7	Very high	10 Å²	10	45.2 Å²	45.2	7%	0.07	22%	0.218	C	C	.	.			trans	-134.9	20.1	175.6	-169.9	0	0	0	0	112.8	G292 Y296 R297 Q298 L299 T306	G292-S294 PolarHBondContact O-N 2.98Å; S294-Y296 PolarHBondContact O-N 3.06Å; S294-Y296 VanDerWaalsContact O-N 3.15Å; S294-R297 PolarHBondContact O-N 2.98Å; S294-Q298 VanDerWaalsContact C-OE1 3.28Å; S294-Q298 VanDerWaalsContact CA-OE1 3.26Å; S294-L299 WeakPolarHBondContact OG-CA 3.36Å; S294-L299 WeakPolarHBondContact OG-CB 3.22Å; S294-L299 PolarHBondContact OG-N 2.99Å; S294-L299 VanDerWaalsContact OG-N 3.1Å; S294-T306 PolarHBondContact N-O 3.44Å
295	E	97.5	Very high	96.6	Very high	106 Å²	106	41.8 Å²	41.8	50%	0.495	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.6	178.4	-68.3	178.4	135.6	0	0	112.8	N293 T306	N293-E295 PolarHBondContact ND2-OE2 2.93Å; N293-E295 PolarHBondContact OD1-N 2.78Å; E295-T306 HydrophobicContact CG-CG2 4.12Å
296	Y	97.3	Very high	96.5	Very high	89 Å²	89	40.5 Å²	40.5	35%	0.349	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	27.7	-174.6	-55.6	-83.3	0	0	0	111.8	S294 Q298 T330 G345 Y346	S294-Y296 PolarHBondContact O-N 3.06Å; S294-Y296 VanDerWaalsContact O-N 3.15Å; Y296-Q298 VanDerWaalsContact CA-OE1 3.22Å; Y296-Q298 PolarHBondContact O-N 3.44Å; Y296-T330 HydrophobicContact CD1-CG2 3.75Å; Y296-T330 HydrophobicContact CD2-CG2 3.67Å; Y296-T330 HydrophobicContact CE1-CG2 3.88Å; Y296-T330 HydrophobicContact CE2-CG2 3.84Å; Y296-T330 HydrophobicContact CG-CG2 3.63Å; Y296-G345 CarbonylContact O-C 3.58Å; Y296-G345 WeakPolarHBondContact O-CA 3.11Å; Y296-Y346 AromaticContact CD1-CD1 3.97Å; Y296-Y346 HydrophobicContact CD1-CD1 3.97Å; Y296-Y346 AromaticContact CD1-CG 3.99Å; Y296-Y346 HydrophobicContact CD1-CG 3.99Å; Y296-Y346 HydrophobicContact CE1-CD1 4.49Å; Y296-Y346 PolarHBondContact O-N 3.31Å
297	R	96.4	Very high	96.5	Very high	98 Å²	98	43.7 Å²	43.7	37%	0.37	22%	0.222	S	C	.	.	S	Bend	trans	64.5	18.1	177.3	-52	172.2	175.1	-176.8	14.8	114.5	S294 L299 A300 E357 S359	S294-R297 PolarHBondContact O-N 2.98Å; R297-L299 PolarHBondContact O-N 2.76Å; R297-A300 HydrophobicContact CB-CB 3.96Å; R297-A300 PolarHBondContact O-N 2.83Å; R297-E357 IonicContact CZ-OE1 2.78Å; R297-E357 IonicContact CZ-OE2 3.45Å; R297-E357 IonicContact NE-OE2 2.77Å; R297-E357 IonicContact NH1-OE1 3.26Å; R297-E357 PolarHBondContact NH1-OE1 2.84Å; R297-E357 IonicContact NH1-OE2 3.26Å; R297-E357 VanDerWaalsContact NH2-CD 3.27Å; R297-E357 IonicContact NH2-OE1 2.7Å; R297-E357 PolarHBondContact NH2-OE1 3.16Å; R297-E357 IonicContact NH2-OE2 3.35Å; R297-E357 PolarHBondContact NH2-OE2 2.87Å; R297-S359 WeakPolarHBondContact CD-OG 3.25Å
298	Q	97.4	Very high	96.4	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-37.1	177.7	-55.6	97.4	-48.3	0	0	111.5	N293 S294 Y296 G329 V332 W344	N293-Q298 PolarHBondContact OD1-NE2 2.96Å; S294-Q298 VanDerWaalsContact C-OE1 3.28Å; S294-Q298 VanDerWaalsContact CA-OE1 3.26Å; Y296-Q298 VanDerWaalsContact CA-OE1 3.22Å; Y296-Q298 PolarHBondContact O-N 3.44Å; Q298-G329 PolarHBondContact NE2-O 3.39Å; Q298-V332 HydrophobicContact CB-CG2 3.75Å; Q298-V332 HydrophobicContact CG-CG2 4.01Å; Q298-W344 PolarHBondContact O-NE1 3.46Å
299	L	97	Very high	96.3	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	17	-176.3	-47.6	176.7	0	0	0	112.9	L280 W291 S294 R297 L301 A302 T303 M308 L314	L280-L299 HydrophobicContact CD2-CD2 4.27Å; W291-L299 VanDerWaalsContact C-CD1 3.47Å; W291-L299 VanDerWaalsContact CA-CD1 3.48Å; S294-L299 WeakPolarHBondContact OG-CA 3.36Å; S294-L299 WeakPolarHBondContact OG-CB 3.22Å; S294-L299 PolarHBondContact OG-N 2.99Å; S294-L299 VanDerWaalsContact OG-N 3.1Å; R297-L299 PolarHBondContact O-N 2.76Å; L299-L301 PolarHBondContact O-N 2.87Å; L299-A302 PolarHBondContact O-N 3.21Å; L299-T303 HydrophobicContact CB-CG2 4.37Å; L299-T303 PolarHBondContact O-N 3.35Å; L299-M308 HydrophobicContact CD1-CB 4.03Å; L299-M308 HydrophobicContact CD1-CE 4.3Å; L299-M308 HydrophobicContact CD1-CG 4.07Å; L299-L314 HydrophobicContact CB-CD2 4.46Å; L299-L314 HydrophobicContact CD2-CD1 3.98Å; L299-L314 HydrophobicContact CD2-CD2 4.4Å
300	A	94.9	Very high	96.3	Very high	37 Å²	37	44.6 Å²	44.6	31%	0.306	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-16.6	-175.4	0	0	0	0	0	114.3	R297 A302 T303	R297-A300 HydrophobicContact CB-CB 3.96Å; R297-A300 PolarHBondContact O-N 2.83Å; A300-A302 VanDerWaalsContact C-N 3.3Å; A300-T303 WeakPolarHBondContact CA-O 3.43Å
301	L	93.5	Very high	96.3	Very high	41 Å²	41	44.7 Å²	44.7	22%	0.215	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-21.2	173.9	-64.3	173.6	0	0	0	113.7	L299 L314 L316 S359 N360 P361	L299-L301 PolarHBondContact O-N 2.87Å; L301-L314 HydrophobicContact CB-CD2 3.92Å; L301-L316 HydrophobicContact CD1-CD2 3.58Å; L301-S359 WeakPolarHBondContact CD2-O 3.32Å; L301-S359 WeakPolarHBondContact CG-O 3.44Å; L301-N360 VanDerWaalsContact CD2-OD1 3.31Å; L301-N360 WeakPolarHBondContact CD2-OD1 3.3Å; L301-P361 HydrophobicContact CD1-CG 4.21Å
302	A	92.9	Very high	96.2	Very high	21 Å²	21	49.8 Å²	49.8	17%	0.174	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-15.2	-175.5	0	0	0	0	0	113.7	L299 A300 R312 L314	L299-A302 PolarHBondContact O-N 3.21Å; A300-A302 VanDerWaalsContact C-N 3.3Å; A302-R312 HydrophobicContact CB-CB 3.87Å; A302-R312 PolarHBondContact O-NH1 3.43Å; A302-L314 HydrophobicContact CB-CD2 3.73Å
303	T	91.8	Very high	96.2	Very high	25 Å²	25	52.9 Å²	52.9	15%	0.153	27%	0.266	C	S	.	.			trans	-160.6	159	-174.9	-166.5	0	0	0	0	112.4	L299 A300 S305 M308	L299-T303 HydrophobicContact CB-CG2 4.37Å; L299-T303 PolarHBondContact O-N 3.35Å; A300-T303 WeakPolarHBondContact CA-O 3.43Å; T303-S305 WeakPolarHBondContact CG2-O 3.47Å; T303-S305 WeakPolarHBondContact OG1-CB 3.29Å; T303-S305 PolarHBondContact OG1-N 2.96Å; T303-M308 VanDerWaalsContact CB-SD 3.54Å; T303-M308 HydrophobicContact CG2-CE 4.24Å; T303-M308 HydrophobicContact CG2-CG 3.51Å; T303-M308 HydrophobicContact CG2-SD 3.32Å; T303-M308 WeakPolarHBondContact CG2-SD 3.38Å
304	E	92.3	Very high	96.2	Very high	199 Å²	199	52.5 Å²	52.5	93%	0.93	27%	0.265	S	S	*	.	S	Bend	trans	-97.1	-11.4	163.4	-62.7	-175.9	167.3	0	0	112.2
305	S	95.1	Very high	96.1	Very high	57 Å²	57	54.9 Å²	54.9	40%	0.399	28%	0.28	S	S	.	.			trans	-67.3	138.2	177.8	-176	0	0	0	0	111.1	T303 Q307	T303-S305 WeakPolarHBondContact CG2-O 3.47Å; T303-S305 WeakPolarHBondContact OG1-CB 3.29Å; T303-S305 PolarHBondContact OG1-N 2.96Å; S305-Q307 VanDerWaalsContact C-N 3.29Å; S305-Q307 PolarHBondContact OG-N 2.84Å; S305-Q307 PolarHBondContact OG-O 2.97Å
306	T	95.9	Very high	96	Very high	69 Å²	69	51 Å²	51	42%	0.423	26%	0.262	S	S	.	.	S	Bend	trans	-77.1	-17.3	174.4	54.7	0	0	0	0	113.1	S294 E295	S294-T306 PolarHBondContact N-O 3.44Å; E295-T306 HydrophobicContact CG-CG2 4.12Å
307	Q	96.5	Very high	95.8	Very high	75 Å²	75	56 Å²	56	35%	0.35	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	121	-179.3	-61.9	177.4	-47.8	0	0	109.5	A242 D243 S305	A242-Q307 PolarHBondContact O-NE2 3.47Å; D243-Q307 HydrophobicContact CB-CG 4.48Å; D243-Q307 PolarHBondContact OD1-NE2 3.33Å; S305-Q307 VanDerWaalsContact C-N 3.29Å; S305-Q307 PolarHBondContact OG-N 2.84Å; S305-Q307 PolarHBondContact OG-O 2.97Å
308	M	96.6	Very high	95.6	Very high	9 Å²	9	55 Å²	55	4%	0.044	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	101.2	-175.1	-79.5	-98	-62.1	0	0	110.1	D243 G244 W291 G292 L299 T303 S310 R312	D243-M308 PolarHBondContact O-N 2.98Å; G244-M308 CarbonylContact C-O 3.45Å; G244-M308 WeakPolarHBondContact CA-O 3.47Å; G244-M308 VanDerWaalsContact O-O 3.06Å; W291-M308 HydrophobicContact CB-CB 4.43Å; G292-M308 PolarHBondContact N-O 3.25Å; G292-M308 WeakPolarHBondContact O-CB 3.36Å; G292-M308 PolarHBondContact O-N 2.99Å; L299-M308 HydrophobicContact CD1-CB 4.03Å; L299-M308 HydrophobicContact CD1-CE 4.3Å; L299-M308 HydrophobicContact CD1-CG 4.07Å; T303-M308 VanDerWaalsContact CB-SD 3.54Å; T303-M308 HydrophobicContact CG2-CE 4.24Å; T303-M308 HydrophobicContact CG2-CG 3.51Å; T303-M308 HydrophobicContact CG2-SD 3.32Å; T303-M308 WeakPolarHBondContact CG2-SD 3.38Å; M308-S310 VanDerWaalsContact C-N 3.34Å; M308-R312 HydrophobicContact CE-CB 3.73Å; M308-R312 HydrophobicContact CE-CG 3.51Å; M308-R312 HydrophobicContact SD-CG 4.37Å
309	N	97.6	Very high	95.5	Very high	53 Å²	53	55.1 Å²	55.1	28%	0.283	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	0.8	-177.6	67.4	19.2	0	0	0	114.9	G247 L248 G249 L251	G247-N309 CarbonylContact C-O 3.08Å; G247-N309 WeakPolarHBondContact CA-O 3.19Å; L248-N309 PolarHBondContact N-O 2.86Å; L248-N309 VanDerWaalsContact N-O 3.12Å; G249-N309 WeakPolarHBondContact CA-O 3.42Å; G249-N309 PolarHBondContact N-O 2.82Å; L251-N309 HydrophobicContact CD2-CB 3.7Å; L251-N309 HydrophobicContact CG-CB 4.5Å
310	S	97.8	Very high	95.5	Very high	39 Å²	39	57.5 Å²	57.5	27%	0.273	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	138.2	178.5	-58.7	0	0	0	0	109.3	G249 M308	G249-S310 WeakPolarHBondContact CA-OG 3.29Å; M308-S310 VanDerWaalsContact C-N 3.34Å
311	P	98.3	Very high	95.6	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.013	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	137.9	174.9	-21.8	30.7	0	0	0	112.6	G247 V260 G261 E263 L264 W291	G247-P311 WeakPolarHBondContact O-CD 3.44Å; V260-P311 HydrophobicContact CG1-CG 3.29Å; G261-P311 WeakPolarHBondContact O-CG 3.41Å; E263-P311 PolarHBondContact N-O 2.86Å; L264-P311 HydrophobicContact CB-CB 4.28Å; L264-P311 HydrophobicContact CB-CG 4.32Å; L264-P311 HydrophobicContact CD1-CB 3.81Å; L264-P311 HydrophobicContact CD1-CG 3.75Å; L264-P311 HydrophobicContact CG-CB 3.67Å; L264-P311 HydrophobicContact CG-CG 4.01Å; W291-P311 HydrophobicContact CD2-CB 4.27Å; W291-P311 HydrophobicContact CD2-CG 3.96Å; W291-P311 HydrophobicContact CE3-CB 3.68Å; W291-P311 HydrophobicContact CE3-CG 3.79Å; W291-P311 HydrophobicContact CG-CG 4.38Å; W291-P311 HydrophobicContact CZ3-CB 4.24Å; W291-P311 HydrophobicContact CZ3-CG 4.3Å
312	R	97.9	Very high	95.9	Very high	107 Å²	107	57.8 Å²	57.8	40%	0.404	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	146.9	168.5	-64.2	-168.9	178.6	-158.4	-7	111.5	F289 G290 A302 M308	F289-R312 CarbonylContact C-O 3.5Å; F289-R312 WeakPolarHBondContact CA-O 3.35Å; G290-R312 PolarHBondContact N-O 3.17Å; G290-R312 PolarHBondContact O-N 3.38Å; G290-R312 VanDerWaalsContact O-N 3.07Å; A302-R312 HydrophobicContact CB-CB 3.87Å; A302-R312 PolarHBondContact O-NH1 3.43Å; M308-R312 HydrophobicContact CE-CB 3.73Å; M308-R312 HydrophobicContact CE-CG 3.51Å; M308-R312 HydrophobicContact SD-CG 4.37Å
313	H	97.8	Very high	96.2	Very high	64 Å²	64	59.5 Å²	59.5	30%	0.296	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	132.8	170.5	175.8	-117.3	0	0	0	110.9	E263 L288 F289 P315	E263-H313 VanDerWaalsContact OE2-CB 3.29Å; E263-H313 WeakPolarHBondContact OE2-CB 3.44Å; E263-H313 PolarHBondContact OE2-N 2.9Å; L288-H313 PolarHBondContact O-CD2 3.47Å; F289-H313 HydrophobicContact CD1-CB 3.98Å; F289-H313 HydrophobicContact CE1-CB 3.76Å; F289-H313 HydrophobicContact CZ-CB 4.45Å; H313-P315 WeakPolarHBondContact O-CD 3.42Å
314	L	97.7	Very high	96.5	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	109.7	176.6	-68.9	166.1	0	0	0	109.3	L280 L288 L299 L301 A302 L316	L280-L314 HydrophobicContact CD2-CD1 4.31Å; L288-L314 HydrophobicContact CB-CB 4.46Å; L288-L314 HydrophobicContact CD2-CB 4.27Å; L288-L314 HydrophobicContact CD2-CD1 3.57Å; L288-L314 HydrophobicContact CG-CB 4.5Å; L288-L314 HydrophobicContact CG-CD1 3.97Å; L288-L314 PolarHBondContact O-N 3.31Å; L299-L314 HydrophobicContact CB-CD2 4.46Å; L299-L314 HydrophobicContact CD2-CD1 3.98Å; L299-L314 HydrophobicContact CD2-CD2 4.4Å; L301-L314 HydrophobicContact CB-CD2 3.92Å; A302-L314 HydrophobicContact CB-CD2 3.73Å; L314-L316 HydrophobicContact CB-CD2 4Å; L314-L316 WeakPolarHBondContact O-CG 3.33Å; L314-L316 PolarHBondContact O-N 3.36Å
315	P	95.3	Very high	96.8	Very high	59 Å²	59	49.8 Å²	49.8	38%	0.383	29%	0.286	S	S	.	.			trans	-75.9	85.7	-176.5	30.3	-35.9	0	0	0	112.1	H313 K317	H313-P315 WeakPolarHBondContact O-CD 3.42Å; P315-K317 VanDerWaalsContact C-N 3.34Å; P315-K317 PolarHBondContact O-N 2.93Å
316	L	95.4	Very high	97	Very high	25 Å²	25	47.1 Å²	47.1	13%	0.131	27%	0.267	C	S	.	.			trans	-77	74.4	-176.9	-51.3	-170.2	0	0	0	113.1	L288 L301 L314 G318 C319 V322 V334 W344 P361	L288-L316 HydrophobicContact CB-CD1 4.02Å; L288-L316 HydrophobicContact CB-CG 4.4Å; L288-L316 HydrophobicContact CD2-CD1 3.88Å; L288-L316 HydrophobicContact CD2-CD2 4.23Å; L288-L316 HydrophobicContact CD2-CG 4.42Å; L301-L316 HydrophobicContact CD1-CD2 3.58Å; L314-L316 HydrophobicContact CB-CD2 4Å; L314-L316 WeakPolarHBondContact O-CG 3.33Å; L314-L316 PolarHBondContact O-N 3.36Å; L316-G318 PolarHBondContact O-N 2.87Å; L316-C319 HydrophobicContact CB-CB 3.77Å; L316-C319 HydrophobicContact CD1-CB 4.37Å; L316-C319 PolarHBondContact O-N 3.37Å; L316-V322 HydrophobicContact CD1-CG2 3.59Å; L316-V334 HydrophobicContact CD1-CG1 4.38Å; L316-V334 HydrophobicContact CD1-CG2 4.25Å; L316-W344 HydrophobicContact CD2-CH2 4.32Å; L316-P361 HydrophobicContact CD2-CG 3.8Å
317	K	92.9	Very high	97	Very high	193 Å²	193	43.8 Å²	43.8	84%	0.839	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	126.5	178	-65.2	-177.6	-177.7	177	0	110.9	P315 C319	P315-K317 VanDerWaalsContact C-N 3.34Å; P315-K317 PolarHBondContact O-N 2.93Å; K317-C319 VanDerWaalsContact C-N 3.29Å; K317-C319 PolarHBondContact O-N 2.8Å
318	G	93.1	Very high	97.1	Very high	79 Å²	79	40.2 Å²	40.2	81%	0.814	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	78	0.7	176.5	0	0	0	0	0	116.2	L316	L316-G318 PolarHBondContact O-N 2.87Å
319	C	96.3	Very high	97.1	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.02	24%	0.236	C	C	.	.			trans	-84.7	-18.8	178.6	-65.4	0	0	0	0	113.7	L316 K317 N336 F342 P361	L316-C319 HydrophobicContact CB-CB 3.77Å; L316-C319 HydrophobicContact CD1-CB 4.37Å; L316-C319 PolarHBondContact O-N 3.37Å; K317-C319 VanDerWaalsContact C-N 3.29Å; K317-C319 PolarHBondContact O-N 2.8Å; C319-N336 VanDerWaalsContact O-CB 3.24Å; C319-N336 WeakPolarHBondContact O-CB 3.44Å; C319-N336 PolarHBondContact O-ND2 2.83Å; C319-F342 HydrophobicContact CB-CD1 4.47Å; C319-F342 HydrophobicContact CB-CD2 4.41Å; C319-F342 HydrophobicContact CB-CE1 4.36Å; C319-F342 HydrophobicContact CB-CE2 4.32Å; C319-F342 HydrophobicContact CB-CZ 4.31Å; C319-F342 VanDerWaalsContact SG-CD1 3.59Å; C319-P361 VanDerWaalsContact SG-CB 3.53Å
320	G	96.3	Very high	97.1	Very high	50 Å²	50	39.5 Å²	39.5	52%	0.515	23%	0.231	S	C	.	.			trans	71.8	-163.2	-172.7	0	0	0	0	0	112.4	V322	G320-V322 PolarHBondContact O-N 2.9Å
321	K	97.8	Very high	97.1	Very high	82 Å²	82	37.7 Å²	37.7	36%	0.357	22%	0.219	S	C	.	.	S	Bend	trans	-72.7	118	-178.6	-170.8	177.9	175.6	168	0	110.9	R284 D285 N336 E337	R284-K321 VanDerWaalsContact O-CE 3.26Å; R284-K321 WeakPolarHBondContact O-CE 3.36Å; R284-K321 PolarHBondContact O-NZ 2.85Å; D285-K321 VanDerWaalsContact C-CE 3.45Å; D285-K321 WeakPolarHBondContact O-CE 3.38Å; K321-N336 CarbonylContact O-C 3.59Å; K321-N336 WeakPolarHBondContact O-CA 3.34Å; K321-N336 WeakPolarHBondContact O-CB 3.27Å; K321-E337 HydrophobicContact CB-CG 4.25Å; K321-E337 PolarHBondContact O-N 3.06Å
322	V	98.6	Very high	97.1	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	129.4	176.8	-179.7	0	0	0	0	109.6	V282 G286 L316 G320 Q324 V334	V282-V322 HydrophobicContact CG1-CB 4.22Å; V282-V322 HydrophobicContact CG1-CG1 3.9Å; V282-V322 WeakPolarHBondContact CG1-O 3.23Å; V282-V322 HydrophobicContact CG2-CG1 3.95Å; G286-V322 WeakPolarHBondContact CA-O 3.36Å; G286-V322 WeakPolarHBondContact O-CB 3.08Å; G286-V322 PolarHBondContact O-N 3.1Å; G286-V322 VanDerWaalsContact O-N 3.07Å; L316-V322 HydrophobicContact CD1-CG2 3.59Å; G320-V322 PolarHBondContact O-N 2.9Å; V322-Q324 WeakPolarHBondContact CG1-O 3.41Å; V322-V334 HydrophobicContact CG1-CB 4.07Å; V322-V334 HydrophobicContact CG1-CG1 4.2Å; V322-V334 HydrophobicContact CG2-CB 4.4Å; V322-V334 HydrophobicContact CG2-CG2 4.49Å
323	V	98.6	Very high	97.2	Very high	56 Å²	56	32.6 Å²	32.6	34%	0.339	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-22.9	173.8	-61.1	0	0	0	0	112.1	Q270 L335 E337	Q270-V323 PolarHBondContact NE2-O 2.8Å; V323-L335 HydrophobicContact CG2-CB 4.36Å; V323-L335 HydrophobicContact CG2-CD2 4.25Å; V323-L335 HydrophobicContact CG2-CG 3.99Å; V323-L335 WeakPolarHBondContact CG2-O 3.18Å; V323-L335 PolarHBondContact N-O 2.9Å; V323-E337 HydrophobicContact CG1-CB 3.84Å
324	Q	98.8	Very high	97.2	Very high	20 Å²	20	29.5 Å²	29.5	9%	0.093	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	143.4	178.1	-151.1	-165.3	-19	0	0	111.7	Q271 V322 V334 L335 I383	Q271-Q324 VanDerWaalsContact OE1-CA 3.28Å; V322-Q324 WeakPolarHBondContact CG1-O 3.41Å; Q324-V334 CarbonylContact O-C 3.53Å; Q324-V334 VanDerWaalsContact O-CA 3.3Å; Q324-V334 WeakPolarHBondContact O-CA 3.35Å; Q324-L335 HydrophobicContact CB-CB 3.96Å; Q324-L335 HydrophobicContact CB-CD2 4.39Å; Q324-L335 PolarHBondContact N-O 3.15Å; Q324-L335 VanDerWaalsContact N-O 3.16Å; Q324-L335 PolarHBondContact O-N 2.91Å; Q324-I383 HydrophobicContact CB-CG1 4.27Å; Q324-I383 HydrophobicContact CG-CG1 4.29Å; Q324-I383 PolarHBondContact NE2-O 3.45Å
325	A	98.7	Very high	97.3	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.008	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	151.8	168.9	0	0	0	0	0	111.2	Q271 L280 V282 L288 A333 V334	Q271-A325 PolarHBondContact NE2-O 2.96Å; L280-A325 HydrophobicContact CB-CB 4.4Å; L280-A325 HydrophobicContact CD1-CB 4.07Å; V282-A325 HydrophobicContact CG2-CB 3.57Å; L288-A325 HydrophobicContact CD1-CB 3.67Å; A325-A333 WeakPolarHBondContact CA-O 3.43Å; A325-V334 HydrophobicContact CB-CG1 4.08Å
326	A	98.5	Very high	97.4	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	134.7	171.6	0	0	0	0	0	110.6	N273 A333 I383 C385	N273-A326 VanDerWaalsContact OD1-CA 3.27Å; N273-A326 WeakPolarHBondContact OD1-CA 3.44Å; A326-A333 PolarHBondContact N-O 2.82Å; A326-A333 PolarHBondContact O-N 3.39Å; A326-I383 HydrophobicContact CB-CD1 4.21Å; A326-I383 HydrophobicContact CB-CG1 4.33Å; A326-C385 HydrophobicContact CB-CB 4.08Å; A326-C385 VanDerWaalsContact CB-SG 3.53Å; A326-C385 PolarHBondContact O-SG 3.4Å
327	C	97.7	Very high	97.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	142.6	172.7	51.9	0	0	0	0	111.5	N273 T274 C278 L280 Q331 V332 C385	N273-C327 PolarHBondContact OD1-N 2.79Å; T274-C327 VanDerWaalsContact CA-SG 3.58Å; C278-C327 PolarHBondContact O-SG 3.21Å; L280-C327 HydrophobicContact CD1-CB 3.71Å; L280-C327 HydrophobicContact CG-CB 4.28Å; C327-Q331 WeakPolarHBondContact CA-O 3.27Å; C327-V332 HydrophobicContact CB-CG2 4.2Å; C327-C385 WeakPolarHBondContact O-CB 3.49Å
328	G	96.8	Very high	97.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.177	C	C	.	.			trans	-96.2	-143	170	0	0	0	0	0	110.9	G276 Q331 G386	G276-G328 PolarHBondContact N-O 2.68Å; G328-Q331 PolarHBondContact N-O 3.18Å; G328-G386 WeakPolarHBondContact CA-O 3.5Å
329	G	97.2	Very high	97.9	Very high	17 Å²	17	25.8 Å²	25.8	18%	0.175	15%	0.145	C	C	.	.	S	Bend	trans	-73.6	-52.2	170.1	0	0	0	0	0	112	Q298 L387	Q298-G329 PolarHBondContact NE2-O 3.39Å; G329-L387 PolarHBondContact N-O 2.65Å
330	T	98.2	Very high	98	Very high	29 Å²	29	26.8 Å²	26.8	18%	0.178	15%	0.15	C	C	.	.	S	Bend	trans	-118	-4.2	-170.1	60.5	0	0	0	0	113.8	Y296 Y346	Y296-T330 HydrophobicContact CD1-CG2 3.75Å; Y296-T330 HydrophobicContact CD2-CG2 3.67Å; Y296-T330 HydrophobicContact CE1-CG2 3.88Å; Y296-T330 HydrophobicContact CE2-CG2 3.84Å; Y296-T330 HydrophobicContact CG-CG2 3.63Å; T330-Y346 WeakPolarHBondContact CB-O 3.48Å; T330-Y346 PolarHBondContact O-N 3.47Å; T330-Y346 PolarHBondContact OG1-O 2.84Å
331	Q	97.5	Very high	98.1	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.009	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	148.3	-163.8	69.7	-172	17.1	0	0	111.7	C327 G328 L349 S388 H389 F390	C327-Q331 WeakPolarHBondContact CA-O 3.27Å; G328-Q331 PolarHBondContact N-O 3.18Å; Q331-L349 HydrophobicContact CB-CD2 4.07Å; Q331-S388 VanDerWaalsContact NE2-C 3.35Å; Q331-H389 VanDerWaalsContact NE2-C 3.3Å; Q331-H389 VanDerWaalsContact NE2-N 3.1Å; Q331-H389 PolarHBondContact NE2-O 2.87Å; Q331-H389 VanDerWaalsContact NE2-O 3.13Å; Q331-F390 HydrophobicContact CB-CE1 4.23Å; Q331-F390 HydrophobicContact CB-CE2 4.32Å; Q331-F390 HydrophobicContact CB-CZ 3.6Å; Q331-F390 HydrophobicContact CG-CE1 3.79Å; Q331-F390 HydrophobicContact CG-CE2 4.01Å; Q331-F390 HydrophobicContact CG-CZ 3.45Å; Q331-F390 VanDerWaalsContact CG-CZ 3.45Å; Q331-F390 VanDerWaalsContact NE2-CE2 3.34Å
332	V	98.5	Very high	98.1	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	142.3	179.5	-175.4	0	0	0	0	110	L280 Q298 C327 V343 W344	L280-V332 HydrophobicContact CD1-CG1 3.55Å; L280-V332 HydrophobicContact CD1-CG2 4.47Å; Q298-V332 HydrophobicContact CB-CG2 3.75Å; Q298-V332 HydrophobicContact CG-CG2 4.01Å; C327-V332 HydrophobicContact CB-CG2 4.2Å; V332-V343 WeakPolarHBondContact O-CA 3.35Å; V332-W344 HydrophobicContact CB-CD2 3.91Å; V332-W344 HydrophobicContact CB-CE3 4.27Å; V332-W344 HydrophobicContact CB-CG 4.49Å; V332-W344 HydrophobicContact CB-CH2 4.12Å; V332-W344 HydrophobicContact CB-CZ2 3.71Å; V332-W344 HydrophobicContact CB-CZ3 4.36Å; V332-W344 HydrophobicContact CG1-CD2 4.22Å; V332-W344 HydrophobicContact CG1-CE3 4.26Å; V332-W344 HydrophobicContact CG1-CH2 3.34Å; V332-W344 HydrophobicContact CG1-CZ2 3.24Å; V332-W344 HydrophobicContact CG1-CZ3 3.84Å; V332-W344 HydrophobicContact CG2-CZ2 4.32Å; V332-W344 PolarHBondContact N-O 2.78Å; V332-W344 PolarHBondContact O-N 3.01Å
333	A	98.8	Very high	98.1	Very high	1 Å²	1	21 Å²	21	1%	0.008	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	145.4	169.3	0	0	0	0	0	110.9	A325 A326 F342 V343 I383 F390	A325-A333 WeakPolarHBondContact CA-O 3.43Å; A326-A333 PolarHBondContact N-O 2.82Å; A326-A333 PolarHBondContact O-N 3.39Å; A333-F342 CarbonylContact C-O 3.54Å; A333-F342 WeakPolarHBondContact CA-O 3.49Å; A333-V343 HydrophobicContact CB-CG1 4.08Å; A333-I383 HydrophobicContact CB-CD1 3.99Å; A333-I383 WeakPolarHBondContact O-CD1 3.31Å; A333-F390 HydrophobicContact CB-CD1 3.94Å; A333-F390 HydrophobicContact CB-CE1 3.81Å
334	V	98.8	Very high	98.1	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	150.1	168.1	-61.2	0	0	0	0	111.1	L288 L316 V322 Q324 A325 V341 F342 W344	L288-V334 HydrophobicContact CD1-CG1 4.47Å; L288-V334 HydrophobicContact CD2-CG1 3.98Å; L316-V334 HydrophobicContact CD1-CG1 4.38Å; L316-V334 HydrophobicContact CD1-CG2 4.25Å; V322-V334 HydrophobicContact CG1-CB 4.07Å; V322-V334 HydrophobicContact CG1-CG1 4.2Å; V322-V334 HydrophobicContact CG2-CB 4.4Å; V322-V334 HydrophobicContact CG2-CG2 4.49Å; Q324-V334 CarbonylContact O-C 3.53Å; Q324-V334 VanDerWaalsContact O-CA 3.3Å; Q324-V334 WeakPolarHBondContact O-CA 3.35Å; A325-V334 HydrophobicContact CB-CG1 4.08Å; V334-V341 WeakPolarHBondContact O-CA 3.39Å; V334-F342 HydrophobicContact CG2-CB 3.82Å; V334-F342 HydrophobicContact CG2-CD2 4.21Å; V334-F342 HydrophobicContact CG2-CG 4.38Å; V334-F342 PolarHBondContact N-O 3.24Å; V334-F342 PolarHBondContact O-N 3.35Å; V334-W344 HydrophobicContact CB-CZ3 4.38Å; V334-W344 HydrophobicContact CG1-CH2 3.59Å; V334-W344 HydrophobicContact CG1-CZ3 3.8Å; V334-W344 HydrophobicContact CG2-CH2 4.43Å; V334-W344 HydrophobicContact CG2-CZ3 3.92Å
335	L	98.9	Very high	98.1	Very high	4 Å²	4	17.4 Å²	17.4	2%	0.021	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.6	172.5	-179.4	63.8	0	0	0	107.8	V323 Q324 E340 V341 V380 I383	V323-L335 HydrophobicContact CG2-CB 4.36Å; V323-L335 HydrophobicContact CG2-CD2 4.25Å; V323-L335 HydrophobicContact CG2-CG 3.99Å; V323-L335 WeakPolarHBondContact CG2-O 3.18Å; V323-L335 PolarHBondContact N-O 2.9Å; Q324-L335 HydrophobicContact CB-CB 3.96Å; Q324-L335 HydrophobicContact CB-CD2 4.39Å; Q324-L335 PolarHBondContact N-O 3.15Å; Q324-L335 VanDerWaalsContact N-O 3.16Å; Q324-L335 PolarHBondContact O-N 2.91Å; L335-E340 WeakPolarHBondContact CA-O 3.35Å; L335-V341 HydrophobicContact CD1-CG2 4.06Å; L335-V380 HydrophobicContact CD1-CB 3.87Å; L335-V380 HydrophobicContact CD1-CG1 3.84Å; L335-V380 HydrophobicContact CD2-CG1 4.32Å; L335-I383 HydrophobicContact CB-CD1 3.94Å; L335-I383 HydrophobicContact CB-CG1 4.05Å; L335-I383 HydrophobicContact CB-CG2 4.27Å
336	N	98.5	Very high	98.1	Very high	3 Å²	3	22.7 Å²	22.7	2%	0.016	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	172	174.5	77.1	3.7	0	0	0	112.3	C319 K321 K338 G339 E340 F342	C319-N336 VanDerWaalsContact O-CB 3.24Å; C319-N336 WeakPolarHBondContact O-CB 3.44Å; C319-N336 PolarHBondContact O-ND2 2.83Å; K321-N336 CarbonylContact O-C 3.59Å; K321-N336 WeakPolarHBondContact O-CA 3.34Å; K321-N336 WeakPolarHBondContact O-CB 3.27Å; N336-K338 PolarHBondContact O-N 3.06Å; N336-K338 VanDerWaalsContact O-N 3.09Å; N336-K338 WeakPolarHBondContact OD1-CA 3.16Å; N336-K338 WeakPolarHBondContact OD1-CB 3.38Å; N336-K338 PolarHBondContact OD1-N 2.79Å; N336-G339 PolarHBondContact O-N 3.08Å; N336-G339 PolarHBondContact OD1-N 3.45Å; N336-E340 PolarHBondContact N-O 2.95Å; N336-E340 VanDerWaalsContact N-O 3.13Å; N336-E340 PolarHBondContact ND2-OE2 2.86Å; N336-E340 WeakPolarHBondContact OD1-CB 3.37Å; N336-E340 PolarHBondContact OD1-N 2.88Å; N336-F342 HydrophobicContact CB-CE2 4.4Å
337	E	97.1	Very high	98	Very high	121 Å²	121	23.5 Å²	23.5	57%	0.565	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.5	179.5	70.6	-171.8	158.5	0	0	114.6	K321 V323 G339	K321-E337 HydrophobicContact CB-CG 4.25Å; K321-E337 PolarHBondContact O-N 3.06Å; V323-E337 HydrophobicContact CG1-CB 3.84Å; E337-G339 VanDerWaalsContact C-N 3.34Å
338	K	96.4	Very high	98.1	Very high	136 Å²	136	24 Å²	24	59%	0.591	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	0.9	177.9	-58.8	178.9	-177.2	174.8	0	112.9	N336 E340	N336-K338 PolarHBondContact O-N 3.06Å; N336-K338 VanDerWaalsContact O-N 3.09Å; N336-K338 WeakPolarHBondContact OD1-CA 3.16Å; N336-K338 WeakPolarHBondContact OD1-CB 3.38Å; N336-K338 PolarHBondContact OD1-N 2.79Å; K338-E340 VanDerWaalsContact C-N 3.32Å; K338-E340 HydrophobicContact CB-CG 4.16Å
339	G	97.6	Very high	98.2	Very high	14 Å²	14	24 Å²	24	14%	0.144	12%	0.121	C	C	.	.	S	Bend	trans	74.3	21.5	-176.3	0	0	0	0	0	113.9	N336 E337 V380	N336-G339 PolarHBondContact O-N 3.08Å; N336-G339 PolarHBondContact OD1-N 3.45Å; E337-G339 VanDerWaalsContact C-N 3.34Å; G339-V380 WeakPolarHBondContact CA-O 3.25Å; G339-V380 PolarHBondContact O-N 3.46Å
340	E	98.1	Very high	98.2	Very high	25 Å²	25	23.1 Å²	23.1	12%	0.117	11%	0.113	C	C	.	.			trans	-92	137.8	176.3	-56.9	174.9	118.4	0	0	110.6	L335 N336 K338 F342 R363	L335-E340 WeakPolarHBondContact CA-O 3.35Å; N336-E340 PolarHBondContact N-O 2.95Å; N336-E340 VanDerWaalsContact N-O 3.13Å; N336-E340 PolarHBondContact ND2-OE2 2.86Å; N336-E340 WeakPolarHBondContact OD1-CB 3.37Å; N336-E340 PolarHBondContact OD1-N 2.88Å; K338-E340 VanDerWaalsContact C-N 3.32Å; K338-E340 HydrophobicContact CB-CG 4.16Å; E340-F342 HydrophobicContact CB-CE2 3.77Å; E340-F342 HydrophobicContact CB-CZ 4.27Å; E340-R363 IonicContact OE1-CZ 3.34Å; E340-R363 IonicContact OE1-NH1 2.82Å; E340-R363 PolarHBondContact OE1-NH1 3Å
341	V	98.8	Very high	98.2	Very high	1 Å²	1	25 Å²	25	1%	0.006	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	129.5	-179.2	-178.6	0	0	0	0	109.9	V334 L335 V343 I364 F369 V380 I383 W402	V334-V341 WeakPolarHBondContact O-CA 3.39Å; L335-V341 HydrophobicContact CD1-CG2 4.06Å; V341-V343 HydrophobicContact CG1-CG1 4.31Å; V341-I364 HydrophobicContact CG1-CD1 4.21Å; V341-I364 PolarHBondContact O-N 2.93Å; V341-F369 HydrophobicContact CB-CE2 3.95Å; V341-F369 HydrophobicContact CB-CZ 4.14Å; V341-F369 HydrophobicContact CG1-CZ 4.44Å; V341-F369 HydrophobicContact CG2-CE2 3.93Å; V341-F369 HydrophobicContact CG2-CZ 4.05Å; V341-V380 HydrophobicContact CG2-CB 3.9Å; V341-V380 HydrophobicContact CG2-CG1 3.83Å; V341-V380 HydrophobicContact CG2-CG2 3.83Å; V341-I383 HydrophobicContact CG1-CG2 4.42Å; V341-I383 HydrophobicContact CG2-CG2 4.01Å; V341-W402 HydrophobicContact CG1-CH2 4.42Å; V341-W402 HydrophobicContact CG1-CZ2 4.48Å
342	F	98.8	Very high	98.1	Very high	11 Å²	11	25 Å²	25	5%	0.048	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	143.7	174	-55.4	-107	0	0	0	109.6	C319 A333 V334 N336 E340 P361 E362 R363	C319-F342 HydrophobicContact CB-CD1 4.47Å; C319-F342 HydrophobicContact CB-CD2 4.41Å; C319-F342 HydrophobicContact CB-CE1 4.36Å; C319-F342 HydrophobicContact CB-CE2 4.32Å; C319-F342 HydrophobicContact CB-CZ 4.31Å; C319-F342 VanDerWaalsContact SG-CD1 3.59Å; A333-F342 CarbonylContact C-O 3.54Å; A333-F342 WeakPolarHBondContact CA-O 3.49Å; V334-F342 HydrophobicContact CG2-CB 3.82Å; V334-F342 HydrophobicContact CG2-CD2 4.21Å; V334-F342 HydrophobicContact CG2-CG 4.38Å; V334-F342 PolarHBondContact N-O 3.24Å; V334-F342 PolarHBondContact O-N 3.35Å; N336-F342 HydrophobicContact CB-CE2 4.4Å; E340-F342 HydrophobicContact CB-CE2 3.77Å; E340-F342 HydrophobicContact CB-CZ 4.27Å; F342-P361 HydrophobicContact CB-CB 3.83Å; F342-P361 HydrophobicContact CD1-CB 4.35Å; F342-P361 HydrophobicContact CG-CB 4.45Å; F342-E362 WeakPolarHBondContact CA-O 3.47Å; F342-R363 HydrophobicContact CD1-CB 3.69Å; F342-R363 HydrophobicContact CD1-CG 4.16Å; F342-R363 HydrophobicContact CE1-CB 3.55Å; F342-R363 HydrophobicContact CE1-CG 3.79Å; F342-R363 HydrophobicContact CZ-CB 4.25Å; F342-R363 HydrophobicContact CZ-CG 3.96Å
343	V	98.7	Very high	98.1	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	145.4	-174.6	-68.6	0	0	0	0	111.3	V332 A333 V341 L349 E362 I364 F390 W402	V332-V343 WeakPolarHBondContact O-CA 3.35Å; A333-V343 HydrophobicContact CB-CG1 4.08Å; V341-V343 HydrophobicContact CG1-CG1 4.31Å; V343-L349 HydrophobicContact CB-CB 4.44Å; V343-L349 HydrophobicContact CG2-CB 4.07Å; V343-L349 VanDerWaalsContact CG2-O 3.31Å; V343-L349 WeakPolarHBondContact CG2-O 3.43Å; V343-E362 HydrophobicContact CG2-CB 4.31Å; V343-E362 WeakPolarHBondContact CG2-O 3.46Å; V343-E362 PolarHBondContact N-O 2.79Å; V343-E362 WeakPolarHBondContact O-CB 3.42Å; V343-E362 PolarHBondContact O-N 3.22Å; V343-I364 HydrophobicContact CG1-CD1 3.71Å; V343-I364 HydrophobicContact CG1-CG1 4.25Å; V343-I364 HydrophobicContact CG2-CD1 4.03Å; V343-I364 HydrophobicContact CG2-CG1 3.84Å; V343-F390 HydrophobicContact CG1-CE1 4.29Å; V343-F390 HydrophobicContact CG1-CZ 4.39Å; V343-W402 HydrophobicContact CG1-CZ2 4.25Å
344	W	98.6	Very high	98	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	-174.4	172.2	71.7	98.7	0	0	0	110.7	L288 Q298 L316 V332 V334 S358 N360 P361	L288-W344 HydrophobicContact CD2-CH2 3.75Å; L288-W344 HydrophobicContact CD2-CZ2 4.02Å; Q298-W344 PolarHBondContact O-NE1 3.46Å; L316-W344 HydrophobicContact CD2-CH2 4.32Å; V332-W344 HydrophobicContact CB-CD2 3.91Å; V332-W344 HydrophobicContact CB-CE3 4.27Å; V332-W344 HydrophobicContact CB-CG 4.49Å; V332-W344 HydrophobicContact CB-CH2 4.12Å; V332-W344 HydrophobicContact CB-CZ2 3.71Å; V332-W344 HydrophobicContact CB-CZ3 4.36Å; V332-W344 HydrophobicContact CG1-CD2 4.22Å; V332-W344 HydrophobicContact CG1-CE3 4.26Å; V332-W344 HydrophobicContact CG1-CH2 3.34Å; V332-W344 HydrophobicContact CG1-CZ2 3.24Å; V332-W344 HydrophobicContact CG1-CZ3 3.84Å; V332-W344 HydrophobicContact CG2-CZ2 4.32Å; V332-W344 PolarHBondContact N-O 2.78Å; V332-W344 PolarHBondContact O-N 3.01Å; V334-W344 HydrophobicContact CB-CZ3 4.38Å; V334-W344 HydrophobicContact CG1-CH2 3.59Å; V334-W344 HydrophobicContact CG1-CZ3 3.8Å; V334-W344 HydrophobicContact CG2-CH2 4.43Å; V334-W344 HydrophobicContact CG2-CZ3 3.92Å; W344-S358 WeakPolarHBondContact CB-O 3.28Å; W344-N360 WeakPolarHBondContact CB-O 3.43Å; W344-P361 HydrophobicContact CD2-CB 4.46Å; W344-P361 HydrophobicContact CD2-CG 4.33Å; W344-P361 HydrophobicContact CE3-CB 3.72Å; W344-P361 HydrophobicContact CE3-CG 3.95Å; W344-P361 HydrophobicContact CZ3-CB 4.01Å; W344-P361 HydrophobicContact CZ3-CG 4.11Å
345	G	98.2	Very high	97.9	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	100.3	-138.7	-173.3	0	0	0	0	0	110.7	Y296 E357 S358	Y296-G345 CarbonylContact O-C 3.58Å; Y296-G345 WeakPolarHBondContact O-CA 3.11Å; G345-E357 CarbonylContact O-C 3.6Å; G345-E357 WeakPolarHBondContact O-CA 3.14Å; G345-S358 PolarHBondContact N-O 2.84Å; G345-S358 PolarHBondContact O-N 3.48Å
346	Y	98.4	Very high	97.8	Very high	113 Å²	113	40.8 Å²	40.8	44%	0.443	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	142.4	178.4	177.7	-91.2	0	0	0	111.6	Y296 T330 S356 E357	Y296-Y346 AromaticContact CD1-CD1 3.97Å; Y296-Y346 HydrophobicContact CD1-CD1 3.97Å; Y296-Y346 AromaticContact CD1-CG 3.99Å; Y296-Y346 HydrophobicContact CD1-CG 3.99Å; Y296-Y346 HydrophobicContact CE1-CD1 4.49Å; Y296-Y346 PolarHBondContact O-N 3.31Å; T330-Y346 WeakPolarHBondContact CB-O 3.48Å; T330-Y346 PolarHBondContact O-N 3.47Å; T330-Y346 PolarHBondContact OG1-O 2.84Å; Y346-S356 WeakPolarHBondContact CA-O 3.47Å; Y346-E357 HydrophobicContact CD2-CB 4.09Å
347	G	97.8	Very high	97.7	Very high	17 Å²	17	44.3 Å²	44.3	18%	0.175	23%	0.23	C	C	.	.	S	Bend	trans	131.7	-146.8	172.6	0	0	0	0	0	112.2	L349 S356	G347-L349 PolarHBondContact O-N 2.94Å; G347-S356 PolarHBondContact N-O 3.33Å; G347-S356 CarbonylContact O-C 3.55Å; G347-S356 WeakPolarHBondContact O-CA 3.45Å; G347-S356 VanDerWaalsContact O-O 3.07Å
348	I	98.4	Very high	97.7	Very high	9 Å²	9	39.1 Å²	39.1	5%	0.046	21%	0.207	C	C	.	.			trans	-95.2	88.9	178.5	-62.2	-178.4	0	0	0	108.1	G350 F390 K404 D417 Q418 F419	I348-G350 PolarHBondContact O-N 3.43Å; I348-F390 WeakPolarHBondContact O-CE2 3.24Å; I348-K404 HydrophobicContact CD1-CD 3.87Å; I348-K404 HydrophobicContact CD1-CG 4.23Å; I348-D417 HydrophobicContact CD1-CB 3.52Å; I348-D417 WeakPolarHBondContact CD1-OD2 3.35Å; I348-Q418 WeakPolarHBondContact CG2-O 3.43Å; I348-F419 HydrophobicContact CB-CD1 4.48Å; I348-F419 HydrophobicContact CD1-CD1 4.39Å; I348-F419 HydrophobicContact CD1-CE1 3.86Å; I348-F419 HydrophobicContact CD1-CE2 4.4Å; I348-F419 HydrophobicContact CD1-CZ 3.86Å; I348-F419 HydrophobicContact CG1-CD1 4.24Å; I348-F419 HydrophobicContact CG1-CE1 3.84Å; I348-F419 HydrophobicContact CG1-CZ 4.35Å; I348-F419 HydrophobicContact CG2-CB 4.31Å; I348-F419 HydrophobicContact CG2-CD1 3.64Å; I348-F419 HydrophobicContact CG2-CE1 4.12Å; I348-F419 HydrophobicContact CG2-CG 4Å
349	L	98.4	Very high	97.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.191	C	C	.	.			trans	-78.8	-16.8	-164.9	-63.5	-179.3	0	0	0	114.6	Q331 V343 G347 L355 F390 W402	Q331-L349 HydrophobicContact CB-CD2 4.07Å; V343-L349 HydrophobicContact CB-CB 4.44Å; V343-L349 HydrophobicContact CG2-CB 4.07Å; V343-L349 VanDerWaalsContact CG2-O 3.31Å; V343-L349 WeakPolarHBondContact CG2-O 3.43Å; G347-L349 PolarHBondContact O-N 2.94Å; L349-L355 HydrophobicContact CB-CD2 4Å; L349-L355 HydrophobicContact CB-CG 4.28Å; L349-L355 HydrophobicContact CD1-CD2 4.24Å; L349-L355 HydrophobicContact CD1-CG 4.04Å; L349-F390 HydrophobicContact CD2-CE2 4.48Å; L349-F390 HydrophobicContact CD2-CZ 4.15Å; L349-W402 PolarHBondContact O-NE1 3.06Å
350	G	97.9	Very high	97.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.208	C	C	.	.	S	Bend	trans	105.6	9.2	173.7	0	0	0	0	0	115.9	I348 F419 P421	I348-G350 PolarHBondContact O-N 3.43Å; G350-F419 CarbonylContact C-O 3.56Å; G350-F419 WeakPolarHBondContact CA-O 3.27Å; G350-P421 WeakPolarHBondContact O-CD 3.46Å
351	K	97.6	Very high	97.6	Very high	67 Å²	67	38.1 Å²	38.1	29%	0.291	21%	0.209	S	C	.	.	S	Bend	trans	-116	33.6	173.5	-61.9	178.2	62.6	174.8	0	112.6	L355 E362 R363 I364 F419	K351-L355 HydrophobicContact CB-CB 4.45Å; K351-L355 HydrophobicContact CB-CD2 3.76Å; K351-L355 HydrophobicContact CD-CD2 3.86Å; K351-L355 HydrophobicContact CG-CD2 4.11Å; K351-E362 HydrophobicContact CD-CB 3.71Å; K351-E362 IonicContact NZ-OE2 2.85Å; K351-E362 PolarHBondContact NZ-OE2 3.19Å; K351-R363 VanDerWaalsContact CD-O 3.3Å; K351-R363 WeakPolarHBondContact CD-O 3.32Å; K351-R363 WeakPolarHBondContact CE-O 3.41Å; K351-R363 PolarHBondContact NZ-O 3.48Å; K351-I364 HydrophobicContact CD-CG1 4.47Å; K351-I364 HydrophobicContact CG-CG1 4Å; K351-F419 PolarHBondContact N-O 3.45Å
352	G	96.9	Very high	97.6	Very high	4 Å²	4	41.1 Å²	41.1	4%	0.041	22%	0.223	C	C	.	.			trans	92.9	175.6	179.5	0	0	0	0	0	114.1	N354 L355 F419 F420	G352-N354 VanDerWaalsContact C-N 3.26Å; G352-N354 PolarHBondContact O-N 3.47Å; G352-L355 PolarHBondContact O-N 2.96Å; G352-F419 PolarHBondContact N-O 3.41Å; G352-F420 VanDerWaalsContact CA-CE1 3.49Å
353	P	96.9	Very high	97.6	Very high	82 Å²	82	46.6 Å²	46.6	53%	0.532	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-18.2	-171.9	28.8	-36	0	0	0	114.4	L355 F419	P353-L355 VanDerWaalsContact C-N 3.34Å; P353-F419 VanDerWaalsContact CA-CD1 3.45Å; P353-F419 HydrophobicContact CB-CD1 3.92Å; P353-F419 HydrophobicContact CB-CE1 4.05Å; P353-F419 HydrophobicContact CB-CG 4.31Å
354	N	97.2	Very high	97.6	Very high	161 Å²	161	46.6 Å²	46.6	86%	0.861	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-14.1	-178	-61.7	-17.7	0	0	0	113	G352	G352-N354 VanDerWaalsContact C-N 3.26Å; G352-N354 PolarHBondContact O-N 3.47Å
355	L	96.5	Very high	97.5	Very high	29 Å²	29	49.2 Å²	49.2	15%	0.152	26%	0.261	C	S	.	.			trans	-101.6	80.8	176.4	-173.6	69.9	0	0	0	109.7	L349 K351 G352 P353 E362	L349-L355 HydrophobicContact CB-CD2 4Å; L349-L355 HydrophobicContact CB-CG 4.28Å; L349-L355 HydrophobicContact CD1-CD2 4.24Å; L349-L355 HydrophobicContact CD1-CG 4.04Å; K351-L355 HydrophobicContact CB-CB 4.45Å; K351-L355 HydrophobicContact CB-CD2 3.76Å; K351-L355 HydrophobicContact CD-CD2 3.86Å; K351-L355 HydrophobicContact CG-CD2 4.11Å; G352-L355 PolarHBondContact O-N 2.96Å; P353-L355 VanDerWaalsContact C-N 3.34Å; L355-E362 HydrophobicContact CD1-CG 4.19Å; L355-E362 HydrophobicContact CD2-CB 3.99Å; L355-E362 HydrophobicContact CD2-CG 3.96Å
356	S	96.3	Very high	97.5	Very high	64 Å²	64	50.7 Å²	50.7	45%	0.448	27%	0.27	S	S	.	.	S	Bend	trans	-89	-22.5	176.2	54.4	0	0	0	0	113.4	Y346 G347	Y346-S356 WeakPolarHBondContact CA-O 3.47Å; G347-S356 PolarHBondContact N-O 3.33Å; G347-S356 CarbonylContact O-C 3.55Å; G347-S356 WeakPolarHBondContact O-CA 3.45Å; G347-S356 VanDerWaalsContact O-O 3.07Å
357	E	97.4	Very high	97.4	Very high	77 Å²	77	49.9 Å²	49.9	36%	0.36	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	152.2	178.1	58.6	175.1	-150.2	0	0	111.5	R297 G345 Y346	R297-E357 IonicContact CZ-OE1 2.78Å; R297-E357 IonicContact CZ-OE2 3.45Å; R297-E357 IonicContact NE-OE2 2.77Å; R297-E357 IonicContact NH1-OE1 3.26Å; R297-E357 PolarHBondContact NH1-OE1 2.84Å; R297-E357 IonicContact NH1-OE2 3.26Å; R297-E357 VanDerWaalsContact NH2-CD 3.27Å; R297-E357 IonicContact NH2-OE1 2.7Å; R297-E357 PolarHBondContact NH2-OE1 3.16Å; R297-E357 IonicContact NH2-OE2 3.35Å; R297-E357 PolarHBondContact NH2-OE2 2.87Å; G345-E357 CarbonylContact O-C 3.6Å; G345-E357 WeakPolarHBondContact O-CA 3.14Å; Y346-E357 HydrophobicContact CD2-CB 4.09Å
358	S	97.4	Very high	97.4	Very high	12 Å²	12	51.5 Å²	51.5	8%	0.084	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	139.7	169.2	-175.1	0	0	0	0	110.9	W344 G345 N360	W344-S358 WeakPolarHBondContact CB-O 3.28Å; G345-S358 PolarHBondContact N-O 2.84Å; G345-S358 PolarHBondContact O-N 3.48Å; S358-N360 WeakPolarHBondContact CB-O 3.38Å; S358-N360 PolarHBondContact OG-N 2.79Å; S358-N360 PolarHBondContact OG-O 3.07Å
359	S	96.4	Very high	97.4	Very high	37 Å²	37	51.3 Å²	51.3	26%	0.259	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-14.2	168	-53	0	0	0	0	112.7	R297 L301	R297-S359 WeakPolarHBondContact CD-OG 3.25Å; L301-S359 WeakPolarHBondContact CD2-O 3.32Å; L301-S359 WeakPolarHBondContact CG-O 3.44Å
360	N	96.3	Very high	97.2	Very high	94 Å²	94	52.7 Å²	52.7	50%	0.503	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	147.3	-177	-65.3	-74.4	0	0	0	110.8	L301 W344 S358 E362	L301-N360 VanDerWaalsContact CD2-OD1 3.31Å; L301-N360 WeakPolarHBondContact CD2-OD1 3.3Å; W344-N360 WeakPolarHBondContact CB-O 3.43Å; S358-N360 WeakPolarHBondContact CB-O 3.38Å; S358-N360 PolarHBondContact OG-N 2.79Å; S358-N360 PolarHBondContact OG-O 3.07Å; N360-E362 PolarHBondContact O-N 2.88Å
361	P	97.8	Very high	97.1	Very high	22 Å²	22	57.3 Å²	57.3	14%	0.143	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	120.4	178.5	-17.1	31.8	0	0	0	111.1	L301 L316 C319 F342 W344	L301-P361 HydrophobicContact CD1-CG 4.21Å; L316-P361 HydrophobicContact CD2-CG 3.8Å; C319-P361 VanDerWaalsContact SG-CB 3.53Å; F342-P361 HydrophobicContact CB-CB 3.83Å; F342-P361 HydrophobicContact CD1-CB 4.35Å; F342-P361 HydrophobicContact CG-CB 4.45Å; W344-P361 HydrophobicContact CD2-CB 4.46Å; W344-P361 HydrophobicContact CD2-CG 4.33Å; W344-P361 HydrophobicContact CE3-CB 3.72Å; W344-P361 HydrophobicContact CE3-CG 3.95Å; W344-P361 HydrophobicContact CZ3-CB 4.01Å; W344-P361 HydrophobicContact CZ3-CG 4.11Å
362	E	98.2	Very high	96.9	Very high	65 Å²	65	56.3 Å²	56.3	30%	0.304	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	117.9	179.7	-73.9	-66	153.9	0	0	110.2	F342 V343 K351 L355 N360 I364	F342-E362 WeakPolarHBondContact CA-O 3.47Å; V343-E362 HydrophobicContact CG2-CB 4.31Å; V343-E362 WeakPolarHBondContact CG2-O 3.46Å; V343-E362 PolarHBondContact N-O 2.79Å; V343-E362 WeakPolarHBondContact O-CB 3.42Å; V343-E362 PolarHBondContact O-N 3.22Å; K351-E362 HydrophobicContact CD-CB 3.71Å; K351-E362 IonicContact NZ-OE2 2.85Å; K351-E362 PolarHBondContact NZ-OE2 3.19Å; L355-E362 HydrophobicContact CD1-CG 4.19Å; L355-E362 HydrophobicContact CD2-CB 3.99Å; L355-E362 HydrophobicContact CD2-CG 3.96Å; N360-E362 PolarHBondContact O-N 2.88Å; E362-I364 PolarHBondContact O-N 3.02Å
363	R	98.2	Very high	96.6	Very high	125 Å²	125	64.9 Å²	64.9	47%	0.472	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	124.6	177.5	-165.8	178.1	68	177.4	-5.1	110.7	E340 F342 K351	E340-R363 IonicContact OE1-CZ 3.34Å; E340-R363 IonicContact OE1-NH1 2.82Å; E340-R363 PolarHBondContact OE1-NH1 3Å; F342-R363 HydrophobicContact CD1-CB 3.69Å; F342-R363 HydrophobicContact CD1-CG 4.16Å; F342-R363 HydrophobicContact CE1-CB 3.55Å; F342-R363 HydrophobicContact CE1-CG 3.79Å; F342-R363 HydrophobicContact CZ-CB 4.25Å; F342-R363 HydrophobicContact CZ-CG 3.96Å; K351-R363 VanDerWaalsContact CD-O 3.3Å; K351-R363 WeakPolarHBondContact CD-O 3.32Å; K351-R363 WeakPolarHBondContact CE-O 3.41Å; K351-R363 PolarHBondContact NZ-O 3.48Å
364	I	98.4	Very high	96.3	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-76.4	128.2	168.9	-60.7	-174.6	0	0	0	108.4	V341 V343 K351 E362 P366 L368 F369 W402 P421	V341-I364 HydrophobicContact CG1-CD1 4.21Å; V341-I364 PolarHBondContact O-N 2.93Å; V343-I364 HydrophobicContact CG1-CD1 3.71Å; V343-I364 HydrophobicContact CG1-CG1 4.25Å; V343-I364 HydrophobicContact CG2-CD1 4.03Å; V343-I364 HydrophobicContact CG2-CG1 3.84Å; K351-I364 HydrophobicContact CD-CG1 4.47Å; K351-I364 HydrophobicContact CG-CG1 4Å; E362-I364 PolarHBondContact O-N 3.02Å; I364-P366 WeakPolarHBondContact O-CD 3.41Å; I364-L368 HydrophobicContact CG2-CB 4.32Å; I364-L368 HydrophobicContact CG2-CD1 3.85Å; I364-F369 HydrophobicContact CB-CE2 3.92Å; I364-F369 HydrophobicContact CB-CZ 4.31Å; I364-F369 HydrophobicContact CD1-CZ 4.19Å; I364-F369 HydrophobicContact CG2-CD2 4.45Å; I364-F369 HydrophobicContact CG2-CE2 3.54Å; I364-F369 HydrophobicContact CG2-CZ 3.85Å; I364-W402 HydrophobicContact CD1-CH2 4.41Å; I364-W402 HydrophobicContact CD1-CZ2 3.67Å; I364-P421 HydrophobicContact CD1-CG 4.43Å; I364-P421 HydrophobicContact CG2-CG 3.91Å
365	P	97.6	Very high	96.1	Very high	56 Å²	56	64.4 Å²	64.4	36%	0.364	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-52.8	123.9	175.9	-28.2	35	0	0	0	112	T367 L368	P365-T367 PolarHBondContact O-N 3.07Å; P365-L368 HydrophobicContact CB-CD1 4.34Å; P365-L368 HydrophobicContact CB-CG 4.38Å; P365-L368 HydrophobicContact CG-CD1 4.3Å; P365-L368 WeakPolarHBondContact O-CB 3.5Å; P365-L368 PolarHBondContact O-N 2.91Å
366	P	97	Very high	95.8	Very high	31 Å²	31	66.8 Å²	66.8	20%	0.201	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-58	-21.9	-179.3	-28.8	36.5	0	0	0	114.5	I364 L368 F369 R371	I364-P366 WeakPolarHBondContact O-CD 3.41Å; P366-L368 PolarHBondContact O-N 2.87Å; P366-F369 PolarHBondContact O-N 2.83Å; P366-R371 HydrophobicContact CB-CB 3.93Å; P366-R371 HydrophobicContact CB-CG 4.39Å; P366-R371 WeakPolarHBondContact O-CB 3.35Å; P366-R371 PolarHBondContact O-N 3.4Å
367	T	97.3	Very high	95.6	Very high	96 Å²	96	67.5 Å²	67.5	59%	0.589	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-58.8	-29.2	173.8	51.9	0	0	0	0	113.3	P365 F369 G370 R371	P365-T367 PolarHBondContact O-N 3.07Å; T367-F369 PolarHBondContact O-N 2.75Å; T367-G370 PolarHBondContact O-N 3.35Å; T367-R371 VanDerWaalsContact CA-O 3.25Å; T367-R371 WeakPolarHBondContact CA-O 3.26Å; T367-R371 WeakPolarHBondContact CG2-O 3.41Å
368	L	98	Very high	95.5	Very high	50 Å²	50	64 Å²	64	26%	0.262	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-72.6	-13.6	175.9	-61.3	173.7	0	0	0	112.9	I364 P365 P366 F400 F420 P421	I364-L368 HydrophobicContact CG2-CB 4.32Å; I364-L368 HydrophobicContact CG2-CD1 3.85Å; P365-L368 HydrophobicContact CB-CD1 4.34Å; P365-L368 HydrophobicContact CB-CG 4.38Å; P365-L368 HydrophobicContact CG-CD1 4.3Å; P365-L368 WeakPolarHBondContact O-CB 3.5Å; P365-L368 PolarHBondContact O-N 2.91Å; P366-L368 PolarHBondContact O-N 2.87Å; L368-F400 WeakPolarHBondContact O-CD1 3.04Å; L368-F400 WeakPolarHBondContact O-CE1 3.41Å; L368-F420 HydrophobicContact CD1-CD1 3.89Å; L368-F420 HydrophobicContact CD2-CD1 4.43Å; L368-P421 HydrophobicContact CB-CB 4.25Å; L368-P421 HydrophobicContact CB-CG 4.01Å
369	F	98	Very high	95.4	Very high	6 Å²	6	64.9 Å²	64.9	3%	0.026	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-104.5	17.2	172.9	-57.4	-67.1	0	0	0	112.5	V341 I364 P366 T367 V378 V380 A392 F400 W402 P421	V341-F369 HydrophobicContact CB-CE2 3.95Å; V341-F369 HydrophobicContact CB-CZ 4.14Å; V341-F369 HydrophobicContact CG1-CZ 4.44Å; V341-F369 HydrophobicContact CG2-CE2 3.93Å; V341-F369 HydrophobicContact CG2-CZ 4.05Å; I364-F369 HydrophobicContact CB-CE2 3.92Å; I364-F369 HydrophobicContact CB-CZ 4.31Å; I364-F369 HydrophobicContact CD1-CZ 4.19Å; I364-F369 HydrophobicContact CG2-CD2 4.45Å; I364-F369 HydrophobicContact CG2-CE2 3.54Å; I364-F369 HydrophobicContact CG2-CZ 3.85Å; P366-F369 PolarHBondContact O-N 2.83Å; T367-F369 PolarHBondContact O-N 2.75Å; F369-V378 WeakPolarHBondContact O-CG1 3.44Å; F369-V380 HydrophobicContact CB-CG2 3.99Å; F369-V380 HydrophobicContact CD1-CG2 4Å; F369-V380 HydrophobicContact CD2-CG2 3.85Å; F369-V380 HydrophobicContact CE1-CG2 4.44Å; F369-V380 HydrophobicContact CE2-CG2 4.3Å; F369-V380 HydrophobicContact CG-CG2 3.67Å; F369-A392 HydrophobicContact CD1-CB 4.23Å; F369-A392 HydrophobicContact CE1-CB 3.79Å; F369-F400 HydrophobicContact CD1-CB 3.95Å; F369-F400 HydrophobicContact CD1-CD1 4.31Å; F369-F400 HydrophobicContact CD1-CD2 4.21Å; F369-F400 AromaticContact CD1-CG 3.91Å; F369-F400 HydrophobicContact CD1-CG 3.91Å; F369-F400 HydrophobicContact CE1-CB 4.18Å; F369-W402 HydrophobicContact CE1-CE3 4.41Å; F369-W402 HydrophobicContact CE1-CH2 4.08Å; F369-W402 AromaticContact CE1-CZ3 3.72Å; F369-W402 HydrophobicContact CE1-CZ3 3.72Å; F369-W402 HydrophobicContact CZ-CH2 4Å; F369-W402 HydrophobicContact CZ-CZ3 4.1Å; F369-P421 HydrophobicContact CD1-CB 3.97Å; F369-P421 HydrophobicContact CD1-CG 4.29Å; F369-P421 HydrophobicContact CE1-CB 3.55Å; F369-P421 HydrophobicContact CE1-CG 3.54Å; F369-P421 HydrophobicContact CE2-CG 4.4Å; F369-P421 HydrophobicContact CZ-CB 4.16Å; F369-P421 HydrophobicContact CZ-CG 3.61Å
370	G	95	Very high	95.5	Very high	29 Å²	29	63.3 Å²	63.3	30%	0.299	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	3.6	176.4	0	0	0	0	0	115.4	T367 S372	T367-G370 PolarHBondContact O-N 3.35Å; G370-S372 PolarHBondContact O-N 2.83Å
371	R	94.3	Very high	95.6	Very high	97 Å²	97	62.3 Å²	62.3	37%	0.366	34%	0.337	S	S	.	.			trans	-73.4	122.2	173.8	-166.7	179.9	-173.3	-179.5	-0.5	110.4	P366 T367 P376 V378	P366-R371 HydrophobicContact CB-CB 3.93Å; P366-R371 HydrophobicContact CB-CG 4.39Å; P366-R371 WeakPolarHBondContact O-CB 3.35Å; P366-R371 PolarHBondContact O-N 3.4Å; T367-R371 VanDerWaalsContact CA-O 3.25Å; T367-R371 WeakPolarHBondContact CA-O 3.26Å; T367-R371 WeakPolarHBondContact CG2-O 3.41Å; R371-P376 PolarHBondContact NE-O 2.79Å; R371-P376 PolarHBondContact NH2-O 3.14Å; R371-V378 HydrophobicContact CB-CB 4.37Å; R371-V378 WeakPolarHBondContact CD-O 3.5Å
372	S	93	Very high	95.7	Very high	46 Å²	46	64 Å²	64	32%	0.322	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-144.4	176.3	179.7	68.1	0	0	0	0	110.7	G370 F374 N375 P376	G370-S372 PolarHBondContact O-N 2.83Å; S372-F374 PolarHBondContact O-N 2.89Å; S372-F374 PolarHBondContact OG-N 3.43Å; S372-N375 PolarHBondContact N-O 2.71Å; S372-N375 CarbonylContact O-C 3.12Å; S372-N375 PolarHBondContact O-N 3.05Å; S372-N375 PolarHBondContact OG-N 2.77Å; S372-P376 VanDerWaalsContact O-CA 3.3Å; S372-P376 WeakPolarHBondContact O-CA 3.38Å
373	E	91.3	Very high	95.7	Very high	184 Å²	184	61 Å²	61	86%	0.86	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-29.5	172.7	-62	-175.9	155.1	0	0	112.3
374	F	91.4	Very high	95.7	Very high	179 Å²	179	58 Å²	58	79%	0.785	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-20.1	175.6	-53.5	-72	0	0	0	113.3	S372	S372-F374 PolarHBondContact O-N 2.89Å; S372-F374 PolarHBondContact OG-N 3.43Å
375	N	91.7	Very high	95.7	Very high	54 Å²	54	58.6 Å²	58.6	29%	0.289	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-135.7	62.8	-179.9	-69.3	-56.8	0	0	0	110.6	S372 S377 V378 R396	S372-N375 PolarHBondContact N-O 2.71Å; S372-N375 CarbonylContact O-C 3.12Å; S372-N375 PolarHBondContact O-N 3.05Å; S372-N375 PolarHBondContact OG-N 2.77Å; N375-S377 PolarHBondContact O-N 3.11Å; N375-V378 HydrophobicContact CB-CG2 3.85Å; N375-V378 PolarHBondContact O-N 3.14Å; N375-R396 VanDerWaalsContact CG-NH1 3.33Å; N375-R396 VanDerWaalsContact OD1-CZ 3.27Å; N375-R396 PolarHBondContact OD1-NH1 3.42Å; N375-R396 PolarHBondContact OD1-NH2 2.81Å
376	P	91.4	Very high	95.8	Very high	79 Å²	79	56 Å²	56	51%	0.513	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-19.5	-169.1	28.5	-35.9	0	0	0	113.3	R371 S372	R371-P376 PolarHBondContact NE-O 2.79Å; R371-P376 PolarHBondContact NH2-O 3.14Å; S372-P376 VanDerWaalsContact O-CA 3.3Å; S372-P376 WeakPolarHBondContact O-CA 3.38Å
377	S	91.5	Very high	95.8	Very high	78 Å²	78	56.1 Å²	56.1	55%	0.545	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-13	-177.5	71.5	0	0	0	0	114.4	N375 A379	N375-S377 PolarHBondContact O-N 3.11Å; S377-A379 PolarHBondContact O-N 3.41Å
378	V	95	Very high	95.9	Very high	5 Å²	5	53.2 Å²	53.2	3%	0.03	29%	0.286	C	S	.	.			trans	-62.8	126.9	-177	173.5	0	0	0	0	109.5	F369 R371 N375 T394 R396	F369-V378 WeakPolarHBondContact O-CG1 3.44Å; R371-V378 HydrophobicContact CB-CB 4.37Å; R371-V378 WeakPolarHBondContact CD-O 3.5Å; N375-V378 HydrophobicContact CB-CG2 3.85Å; N375-V378 PolarHBondContact O-N 3.14Å; V378-T394 HydrophobicContact CG1-CG2 4.16Å; V378-R396 HydrophobicContact CG2-CG 4.36Å; V378-R396 VanDerWaalsContact CG2-CZ 3.45Å; V378-R396 VanDerWaalsContact CG2-NE 3.29Å
379	A	96.6	Very high	95.9	Very high	29 Å²	29	50.9 Å²	50.9	24%	0.24	27%	0.274	C	S	.	.			trans	-138.2	147.5	-177.4	0	0	0	0	0	110.3	S377 T394 D395	S377-A379 PolarHBondContact O-N 3.41Å; A379-T394 CarbonylContact O-C 3.59Å; A379-T394 VanDerWaalsContact O-CA 3.23Å; A379-T394 WeakPolarHBondContact O-CA 3.21Å; A379-D395 PolarHBondContact N-OD1 3.02Å; A379-D395 PolarHBondContact O-N 3.49Å
380	V	98.6	Very high	95.9	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.03	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	130.9	169.5	178.2	0	0	0	0	108.1	L335 G339 V341 F369 K382 I383 A392	L335-V380 HydrophobicContact CD1-CB 3.87Å; L335-V380 HydrophobicContact CD1-CG1 3.84Å; L335-V380 HydrophobicContact CD2-CG1 4.32Å; G339-V380 WeakPolarHBondContact CA-O 3.25Å; G339-V380 PolarHBondContact O-N 3.46Å; V341-V380 HydrophobicContact CG2-CB 3.9Å; V341-V380 HydrophobicContact CG2-CG1 3.83Å; V341-V380 HydrophobicContact CG2-CG2 3.83Å; F369-V380 HydrophobicContact CB-CG2 3.99Å; F369-V380 HydrophobicContact CD1-CG2 4Å; F369-V380 HydrophobicContact CD2-CG2 3.85Å; F369-V380 HydrophobicContact CE1-CG2 4.44Å; F369-V380 HydrophobicContact CE2-CG2 4.3Å; F369-V380 HydrophobicContact CG-CG2 3.67Å; V380-K382 WeakPolarHBondContact CG1-O 3.36Å; V380-I383 HydrophobicContact CG1-CG2 3.87Å; V380-A392 HydrophobicContact CG1-CB 3.9Å; V380-A392 HydrophobicContact CG2-CB 4.37Å
381	V	98.5	Very high	96.1	Very high	73 Å²	73	49.3 Å²	49.3	44%	0.442	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	-18	-179.8	-63.3	0	0	0	0	112.8	V393 D395	V381-V393 WeakPolarHBondContact CG2-O 3.49Å; V381-V393 PolarHBondContact N-O 3.43Å; V381-D395 HydrophobicContact CG1-CB 3.74Å
382	K	98.7	Very high	96.3	Very high	57 Å²	57	44.7 Å²	44.7	25%	0.248	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	141.1	174.7	-65	-176.8	175.8	-174.7	0	111.3	V380 A392 V393 V431 D432	V380-K382 WeakPolarHBondContact CG1-O 3.36Å; K382-A392 CarbonylContact O-C 3.55Å; K382-A392 VanDerWaalsContact O-CA 3.29Å; K382-A392 WeakPolarHBondContact O-CA 3.5Å; K382-V393 HydrophobicContact CB-CB 4.25Å; K382-V393 PolarHBondContact N-O 2.82Å; K382-V393 PolarHBondContact O-N 3.06Å; K382-V431 WeakPolarHBondContact CD-O 3.27Å; K382-V431 WeakPolarHBondContact CE-O 3.32Å; K382-V431 PolarHBondContact NZ-O 2.97Å; K382-D432 IonicContact NZ-OD2 3.78Å; K382-D432 PolarHBondContact NZ-OD2 2.93Å
383	I	98.8	Very high	96.6	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	149.8	167.3	58.2	167	0	0	0	111.4	Q324 A326 A333 L335 V341 V380 A391 A392	Q324-I383 HydrophobicContact CB-CG1 4.27Å; Q324-I383 HydrophobicContact CG-CG1 4.29Å; Q324-I383 PolarHBondContact NE2-O 3.45Å; A326-I383 HydrophobicContact CB-CD1 4.21Å; A326-I383 HydrophobicContact CB-CG1 4.33Å; A333-I383 HydrophobicContact CB-CD1 3.99Å; A333-I383 WeakPolarHBondContact O-CD1 3.31Å; L335-I383 HydrophobicContact CB-CD1 3.94Å; L335-I383 HydrophobicContact CB-CG1 4.05Å; L335-I383 HydrophobicContact CB-CG2 4.27Å; V341-I383 HydrophobicContact CG1-CG2 4.42Å; V341-I383 HydrophobicContact CG2-CG2 4.01Å; V380-I383 HydrophobicContact CG1-CG2 3.87Å; I383-A391 CarbonylContact C-O 3.58Å; I383-A391 WeakPolarHBondContact CA-O 3.24Å; I383-A392 HydrophobicContact CG2-CB 4.39Å
384	R	98.7	Very high	97	Very high	62 Å²	62	34 Å²	34	23%	0.234	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	150.3	175.5	-60	-74.9	-178.2	-117.2	3.5	109.2	F390 A391 D432 V433	R384-F390 WeakPolarHBondContact O-CA 3.39Å; R384-A391 HydrophobicContact CB-CB 4.37Å; R384-A391 PolarHBondContact N-O 2.93Å; R384-A391 PolarHBondContact O-N 3.04Å; R384-D432 IonicContact CZ-OD1 3.01Å; R384-D432 VanDerWaalsContact CZ-OD1 3.28Å; R384-D432 IonicContact NE-OD1 2.82Å; R384-D432 PolarHBondContact NE-OD1 3.26Å; R384-D432 VanDerWaalsContact NH2-CG 3.28Å; R384-D432 IonicContact NH2-OD1 2.7Å; R384-D432 PolarHBondContact NH2-OD1 2.95Å; R384-D432 IonicContact NH2-OD2 3.82Å; R384-D432 PolarHBondContact NH2-OD2 2.95Å; R384-V433 HydrophobicContact CB-CG2 4.05Å; R384-V433 WeakPolarHBondContact CD-O 3.14Å; R384-V433 HydrophobicContact CG-CG2 3.67Å; R384-V433 WeakPolarHBondContact CG-O 3.44Å; R384-V433 PolarHBondContact NE-O 3.01Å
385	C	98	Very high	97.2	Very high	13 Å²	13	29.2 Å²	29.2	9%	0.088	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136.3	171.7	-72.1	0	0	0	0	108.7	A326 C327 H389 F390	A326-C385 HydrophobicContact CB-CB 4.08Å; A326-C385 VanDerWaalsContact CB-SG 3.53Å; A326-C385 PolarHBondContact O-SG 3.4Å; C327-C385 WeakPolarHBondContact O-CB 3.49Å; C385-H389 WeakPolarHBondContact CA-O 3.38Å; C385-F390 WeakPolarHBondContact SG-CD1 3.47Å
386	G	98.1	Very high	97.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.175	C	C	.	.			trans	-90.3	-161.3	155.7	0	0	0	0	0	109.5	G328 S388 H389 C435 G436	G328-G386 WeakPolarHBondContact CA-O 3.5Å; G386-S388 VanDerWaalsContact C-N 3.34Å; G386-S388 PolarHBondContact O-N 2.96Å; G386-H389 PolarHBondContact N-O 3.25Å; G386-C435 VanDerWaalsContact CA-CB 3.42Å; G386-G436 VanDerWaalsContact CA-O 3.26Å; G386-G436 WeakPolarHBondContact CA-O 3.19Å
387	L	98.3	Very high	97.6	Very high	35 Å²	35	28.4 Å²	28.4	18%	0.183	16%	0.156	C	C	.	.	S	Bend	trans	-62.4	-41.6	-179.3	-166	61.6	0	0	0	112.9	Y100 Y275 G329 G436 V437	Y100-L387 WeakPolarHBondContact OH-CD1 3.43Å; Y275-L387 HydrophobicContact CD1-CB 4.24Å; Y275-L387 HydrophobicContact CD1-CD1 4.09Å; Y275-L387 HydrophobicContact CE1-CB 3.88Å; Y275-L387 HydrophobicContact CE1-CD1 4.19Å; G329-L387 PolarHBondContact N-O 2.65Å; L387-G436 PolarHBondContact N-O 3.09Å; L387-G436 VanDerWaalsContact N-O 3.17Å; L387-V437 HydrophobicContact CB-CB 4.41Å; L387-V437 HydrophobicContact CB-CG1 4.36Å; L387-V437 HydrophobicContact CB-CG2 4.21Å; L387-V437 HydrophobicContact CD2-CB 4.45Å; L387-V437 HydrophobicContact CD2-CG1 3.83Å; L387-V437 HydrophobicContact CD2-CG2 4.03Å
388	S	98.2	Very high	97.9	Very high	34 Å²	34	27 Å²	27	24%	0.238	14%	0.141	C	C	.	.	S	Bend	trans	-142.7	17.6	-172	-48.1	0	0	0	0	113.2	Q331 G386 K404	Q331-S388 VanDerWaalsContact NE2-C 3.35Å; G386-S388 VanDerWaalsContact C-N 3.34Å; G386-S388 PolarHBondContact O-N 2.96Å; S388-K404 WeakPolarHBondContact O-CB 3.39Å; S388-K404 PolarHBondContact O-N 3.26Å
389	H	98.8	Very high	98.1	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	162.5	177.6	70	-83.2	0	0	0	110.9	Q331 C385 G386 W402 L410 C435 G436	Q331-H389 VanDerWaalsContact NE2-C 3.3Å; Q331-H389 VanDerWaalsContact NE2-N 3.1Å; Q331-H389 PolarHBondContact NE2-O 2.87Å; Q331-H389 VanDerWaalsContact NE2-O 3.13Å; C385-H389 WeakPolarHBondContact CA-O 3.38Å; G386-H389 PolarHBondContact N-O 3.25Å; H389-W402 CarbonylContact C-O 3.53Å; H389-W402 WeakPolarHBondContact CA-O 3.16Å; H389-W402 WeakPolarHBondContact CB-O 3.42Å; H389-L410 HydrophobicContact CB-CD2 3.79Å; H389-C435 WeakPolarHBondContact NE2-CB 3.26Å; H389-G436 PolarHBondContact CE1-O 3.07Å; H389-G436 VanDerWaalsContact CE1-O 3.27Å
390	F	98.9	Very high	98.2	Very high	1 Å²	1	26 Å²	26	0%	0.004	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	156	-178.2	-57.9	-93.4	0	0	0	110.1	Q331 A333 V343 I348 L349 R384 C385 V401 W402	Q331-F390 HydrophobicContact CB-CE1 4.23Å; Q331-F390 HydrophobicContact CB-CE2 4.32Å; Q331-F390 HydrophobicContact CB-CZ 3.6Å; Q331-F390 HydrophobicContact CG-CE1 3.79Å; Q331-F390 HydrophobicContact CG-CE2 4.01Å; Q331-F390 HydrophobicContact CG-CZ 3.45Å; Q331-F390 VanDerWaalsContact CG-CZ 3.45Å; Q331-F390 VanDerWaalsContact NE2-CE2 3.34Å; A333-F390 HydrophobicContact CB-CD1 3.94Å; A333-F390 HydrophobicContact CB-CE1 3.81Å; V343-F390 HydrophobicContact CG1-CE1 4.29Å; V343-F390 HydrophobicContact CG1-CZ 4.39Å; I348-F390 WeakPolarHBondContact O-CE2 3.24Å; L349-F390 HydrophobicContact CD2-CE2 4.48Å; L349-F390 HydrophobicContact CD2-CZ 4.15Å; R384-F390 WeakPolarHBondContact O-CA 3.39Å; C385-F390 WeakPolarHBondContact SG-CD1 3.47Å; F390-V401 VanDerWaalsContact O-CA 3.31Å; F390-V401 WeakPolarHBondContact O-CA 3.36Å; F390-W402 HydrophobicContact CB-CD2 3.63Å; F390-W402 HydrophobicContact CB-CE3 3.96Å; F390-W402 HydrophobicContact CB-CG 4.24Å; F390-W402 HydrophobicContact CB-CH2 3.68Å; F390-W402 HydrophobicContact CB-CZ2 3.34Å; F390-W402 HydrophobicContact CB-CZ3 3.97Å; F390-W402 HydrophobicContact CD1-CZ2 4.03Å; F390-W402 AromaticContact CD2-CD1 3.45Å; F390-W402 VanDerWaalsContact CD2-CD1 3.45Å; F390-W402 HydrophobicContact CD2-CD2 4.27Å; F390-W402 AromaticContact CD2-CE2 3.62Å; F390-W402 HydrophobicContact CD2-CG 4.19Å; F390-W402 HydrophobicContact CD2-CZ2 4.17Å; F390-W402 AromaticContact CD2-NE1 3.07Å; F390-W402 AromaticContact CE2-NE1 3.58Å; F390-W402 HydrophobicContact CG-CD2 4.25Å; F390-W402 AromaticContact CG-CE2 3.51Å; F390-W402 HydrophobicContact CG-CH2 4.41Å; F390-W402 AromaticContact CG-CZ2 3.63Å; F390-W402 HydrophobicContact CG-CZ2 3.63Å; F390-W402 AromaticContact CG-NE1 3.49Å; F390-W402 PolarHBondContact N-O 3.37Å; F390-W402 PolarHBondContact O-N 2.89Å; F390-W402 VanDerWaalsContact O-N 3.16Å
391	A	98.9	Very high	98.2	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.008	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	143.4	168.4	0	0	0	0	0	110.4	I383 R384 L399 F400 V401 V433 M440	I383-A391 CarbonylContact C-O 3.58Å; I383-A391 WeakPolarHBondContact CA-O 3.24Å; R384-A391 HydrophobicContact CB-CB 4.37Å; R384-A391 PolarHBondContact N-O 2.93Å; R384-A391 PolarHBondContact O-N 3.04Å; A391-L399 HydrophobicContact CB-CD1 4.03Å; A391-F400 CarbonylContact C-O 3.54Å; A391-F400 VanDerWaalsContact CA-O 3.27Å; A391-F400 WeakPolarHBondContact CA-O 3.44Å; A391-V401 HydrophobicContact CB-CG1 4.13Å; A391-V433 HydrophobicContact CB-CG2 3.73Å; A391-M440 HydrophobicContact CB-CE 3.89Å
392	A	98.9	Very high	98.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	137.9	174.1	0	0	0	0	0	109.7	F369 V380 K382 I383 F400 W402	F369-A392 HydrophobicContact CD1-CB 4.23Å; F369-A392 HydrophobicContact CE1-CB 3.79Å; V380-A392 HydrophobicContact CG1-CB 3.9Å; V380-A392 HydrophobicContact CG2-CB 4.37Å; K382-A392 CarbonylContact O-C 3.55Å; K382-A392 VanDerWaalsContact O-CA 3.29Å; K382-A392 WeakPolarHBondContact O-CA 3.5Å; I383-A392 HydrophobicContact CG2-CB 4.39Å; A392-F400 PolarHBondContact N-O 2.63Å; A392-F400 PolarHBondContact O-N 3.11Å; A392-W402 HydrophobicContact CB-CH2 4.08Å; A392-W402 HydrophobicContact CB-CZ3 3.8Å
393	V	98.8	Very high	98.2	Very high	5 Å²	5	19.7 Å²	19.7	3%	0.03	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	130.2	174.1	-175.9	0	0	0	0	108.4	V381 K382 E398 L399 V430 V433	V381-V393 WeakPolarHBondContact CG2-O 3.49Å; V381-V393 PolarHBondContact N-O 3.43Å; K382-V393 HydrophobicContact CB-CB 4.25Å; K382-V393 PolarHBondContact N-O 2.82Å; K382-V393 PolarHBondContact O-N 3.06Å; V393-E398 WeakPolarHBondContact CA-O 3.28Å; V393-L399 HydrophobicContact CG2-CD1 4.17Å; V393-V430 HydrophobicContact CG1-CB 4.39Å; V393-V430 HydrophobicContact CG1-CG1 4.4Å; V393-V430 WeakPolarHBondContact CG1-O 3.32Å; V393-V430 HydrophobicContact CG2-CG1 3.98Å; V393-V433 HydrophobicContact CG2-CG1 4.39Å
394	T	98.4	Very high	98.2	Very high	2 Å²	2	23.8 Å²	23.8	1%	0.012	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	164.8	176.8	67.9	0	0	0	0	112.1	V378 A379 R396 G397 E398 F400	V378-T394 HydrophobicContact CG1-CG2 4.16Å; A379-T394 CarbonylContact O-C 3.59Å; A379-T394 VanDerWaalsContact O-CA 3.23Å; A379-T394 WeakPolarHBondContact O-CA 3.21Å; T394-R396 PolarHBondContact O-N 3.09Å; T394-R396 VanDerWaalsContact O-N 3.13Å; T394-R396 PolarHBondContact OG1-N 2.92Å; T394-G397 PolarHBondContact O-N 2.57Å; T394-E398 PolarHBondContact N-O 3.23Å; T394-E398 WeakPolarHBondContact OG1-CB 3.39Å; T394-E398 PolarHBondContact OG1-N 3.49Å; T394-F400 HydrophobicContact CG2-CD2 3.97Å; T394-F400 HydrophobicContact CG2-CE2 3.72Å
395	D	96.6	Very high	98.2	Very high	78 Å²	78	21.2 Å²	21.2	42%	0.417	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-21.3	171.8	65.8	-33.8	0	0	0	113.6	A379 V381 G397	A379-D395 PolarHBondContact N-OD1 3.02Å; A379-D395 PolarHBondContact O-N 3.49Å; V381-D395 HydrophobicContact CG1-CB 3.74Å; D395-G397 VanDerWaalsContact C-N 3.34Å
396	R	95.3	Very high	98.2	Very high	105 Å²	105	23.2 Å²	23.2	40%	0.396	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	0.1	174	-61.4	-169.9	175.9	-176.2	2.9	114.3	N375 V378 T394 E398	N375-R396 VanDerWaalsContact CG-NH1 3.33Å; N375-R396 VanDerWaalsContact OD1-CZ 3.27Å; N375-R396 PolarHBondContact OD1-NH1 3.42Å; N375-R396 PolarHBondContact OD1-NH2 2.81Å; V378-R396 HydrophobicContact CG2-CG 4.36Å; V378-R396 VanDerWaalsContact CG2-CZ 3.45Å; V378-R396 VanDerWaalsContact CG2-NE 3.29Å; T394-R396 PolarHBondContact O-N 3.09Å; T394-R396 VanDerWaalsContact O-N 3.13Å; T394-R396 PolarHBondContact OG1-N 2.92Å; R396-E398 VanDerWaalsContact C-N 3.32Å; R396-E398 HydrophobicContact CB-CG 4.36Å
397	G	96.6	Very high	98.2	Very high	11 Å²	11	29 Å²	29	11%	0.113	14%	0.139	C	C	.	.			trans	72.7	23.7	-176.9	0	0	0	0	0	113.6	T394 D395 V430	T394-G397 PolarHBondContact O-N 2.57Å; D395-G397 VanDerWaalsContact C-N 3.34Å; G397-V430 WeakPolarHBondContact CA-O 3.4Å; G397-V430 PolarHBondContact O-N 3.39Å
398	E	97.9	Very high	98.1	Very high	48 Å²	48	27.4 Å²	27.4	22%	0.224	13%	0.131	C	C	.	.			trans	-87.2	135.9	172.3	-60.1	-178.8	105.9	0	0	110	V393 T394 R396 F400 R423	V393-E398 WeakPolarHBondContact CA-O 3.28Å; T394-E398 PolarHBondContact N-O 3.23Å; T394-E398 WeakPolarHBondContact OG1-CB 3.39Å; T394-E398 PolarHBondContact OG1-N 3.49Å; R396-E398 VanDerWaalsContact C-N 3.32Å; R396-E398 HydrophobicContact CB-CG 4.36Å; E398-F400 HydrophobicContact CB-CE2 3.92Å; E398-R423 WeakPolarHBondContact OE1-CD 3.24Å; E398-R423 IonicContact OE1-CZ 3.81Å; E398-R423 IonicContact OE1-NH1 2.82Å; E398-R423 PolarHBondContact OE1-NH1 2.91Å
399	L	98.8	Very high	98.1	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	126.4	177.6	173.1	62.3	0	0	0	110.5	W54 A391 V393 V401 R423 V424 V426 V430 V433	W54-L399 HydrophobicContact CH2-CD2 3.58Å; W54-L399 HydrophobicContact CZ2-CD2 3.88Å; A391-L399 HydrophobicContact CB-CD1 4.03Å; V393-L399 HydrophobicContact CG2-CD1 4.17Å; L399-V401 HydrophobicContact CD1-CG1 4.11Å; L399-V401 HydrophobicContact CD2-CG1 4.45Å; L399-V401 HydrophobicContact CG-CG1 4.13Å; L399-R423 CarbonylContact O-C 3.51Å; L399-R423 WeakPolarHBondContact O-CA 3.2Å; L399-V424 HydrophobicContact CB-CB 4.37Å; L399-V424 HydrophobicContact CD2-CB 3.98Å; L399-V424 HydrophobicContact CD2-CG1 4.33Å; L399-V424 HydrophobicContact CD2-CG2 4.06Å; L399-V424 HydrophobicContact CG-CB 4.08Å; L399-V424 HydrophobicContact CG-CG2 4.02Å; L399-V424 PolarHBondContact O-N 3.06Å; L399-V426 HydrophobicContact CD2-CG2 4.36Å; L399-V430 HydrophobicContact CB-CB 4.31Å; L399-V430 HydrophobicContact CB-CG1 4.35Å; L399-V430 HydrophobicContact CB-CG2 3.91Å; L399-V433 HydrophobicContact CD1-CG1 3.77Å; L399-V433 HydrophobicContact CD1-CG2 4.33Å; L399-V433 HydrophobicContact CD2-CG1 3.96Å; L399-V433 HydrophobicContact CG-CG1 4.48Å
400	F	98.9	Very high	98.1	Very high	13 Å²	13	25.8 Å²	25.8	6%	0.057	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	139	170.5	-69.1	-99.2	0	0	0	109.9	L368 F369 A391 A392 T394 E398 P421 W422 R423	L368-F400 WeakPolarHBondContact O-CD1 3.04Å; L368-F400 WeakPolarHBondContact O-CE1 3.41Å; F369-F400 HydrophobicContact CD1-CB 3.95Å; F369-F400 HydrophobicContact CD1-CD1 4.31Å; F369-F400 HydrophobicContact CD1-CD2 4.21Å; F369-F400 AromaticContact CD1-CG 3.91Å; F369-F400 HydrophobicContact CD1-CG 3.91Å; F369-F400 HydrophobicContact CE1-CB 4.18Å; A391-F400 CarbonylContact C-O 3.54Å; A391-F400 VanDerWaalsContact CA-O 3.27Å; A391-F400 WeakPolarHBondContact CA-O 3.44Å; A392-F400 PolarHBondContact N-O 2.63Å; A392-F400 PolarHBondContact O-N 3.11Å; T394-F400 HydrophobicContact CG2-CD2 3.97Å; T394-F400 HydrophobicContact CG2-CE2 3.72Å; E398-F400 HydrophobicContact CB-CE2 3.92Å; F400-P421 HydrophobicContact CB-CB 4.2Å; F400-P421 HydrophobicContact CD1-CB 4.16Å; F400-W422 CarbonylContact C-O 3.53Å; F400-W422 WeakPolarHBondContact CA-O 3.36Å; F400-R423 HydrophobicContact CD1-CB 4.1Å; F400-R423 HydrophobicContact CE1-CB 3.79Å; F400-R423 HydrophobicContact CE1-CG 4.35Å; F400-R423 HydrophobicContact CZ-CB 4.17Å; F400-R423 HydrophobicContact CZ-CG 4.23Å
401	V	98.9	Very high	98	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	148.6	178	-60.5	0	0	0	0	110.8	F390 A391 L399 L410 I412 W422 V424 M440	F390-V401 VanDerWaalsContact O-CA 3.31Å; F390-V401 WeakPolarHBondContact O-CA 3.36Å; A391-V401 HydrophobicContact CB-CG1 4.13Å; L399-V401 HydrophobicContact CD1-CG1 4.11Å; L399-V401 HydrophobicContact CD2-CG1 4.45Å; L399-V401 HydrophobicContact CG-CG1 4.13Å; V401-L410 HydrophobicContact CB-CD2 4.03Å; V401-L410 HydrophobicContact CG2-CB 3.83Å; V401-L410 HydrophobicContact CG2-CD2 4.07Å; V401-L410 HydrophobicContact CG2-CG 4.4Å; V401-L410 WeakPolarHBondContact CG2-O 3.19Å; V401-I412 HydrophobicContact CG2-CG2 3.85Å; V401-W422 PolarHBondContact N-O 2.69Å; V401-W422 PolarHBondContact O-N 2.84Å; V401-V424 HydrophobicContact CB-CG2 4.13Å; V401-V424 HydrophobicContact CG1-CG2 3.64Å; V401-V424 HydrophobicContact CG2-CG2 3.43Å; V401-V424 VanDerWaalsContact CG2-CG2 3.43Å; V401-M440 HydrophobicContact CG1-CE 4.18Å; V401-M440 HydrophobicContact CG1-SD 4.26Å
402	W	98.9	Very high	98	Very high	1 Å²	1	27 Å²	27	0%	0.004	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	170.2	172.9	66.7	99.2	0	0	0	110.8	V341 V343 L349 I364 F369 H389 F390 A392 Q418 F420 P421	V341-W402 HydrophobicContact CG1-CH2 4.42Å; V341-W402 HydrophobicContact CG1-CZ2 4.48Å; V343-W402 HydrophobicContact CG1-CZ2 4.25Å; L349-W402 PolarHBondContact O-NE1 3.06Å; I364-W402 HydrophobicContact CD1-CH2 4.41Å; I364-W402 HydrophobicContact CD1-CZ2 3.67Å; F369-W402 HydrophobicContact CE1-CE3 4.41Å; F369-W402 HydrophobicContact CE1-CH2 4.08Å; F369-W402 AromaticContact CE1-CZ3 3.72Å; F369-W402 HydrophobicContact CE1-CZ3 3.72Å; F369-W402 HydrophobicContact CZ-CH2 4Å; F369-W402 HydrophobicContact CZ-CZ3 4.1Å; H389-W402 CarbonylContact C-O 3.53Å; H389-W402 WeakPolarHBondContact CA-O 3.16Å; H389-W402 WeakPolarHBondContact CB-O 3.42Å; F390-W402 HydrophobicContact CB-CD2 3.63Å; F390-W402 HydrophobicContact CB-CE3 3.96Å; F390-W402 HydrophobicContact CB-CG 4.24Å; F390-W402 HydrophobicContact CB-CH2 3.68Å; F390-W402 HydrophobicContact CB-CZ2 3.34Å; F390-W402 HydrophobicContact CB-CZ3 3.97Å; F390-W402 HydrophobicContact CD1-CZ2 4.03Å; F390-W402 AromaticContact CD2-CD1 3.45Å; F390-W402 VanDerWaalsContact CD2-CD1 3.45Å; F390-W402 HydrophobicContact CD2-CD2 4.27Å; F390-W402 AromaticContact CD2-CE2 3.62Å; F390-W402 HydrophobicContact CD2-CG 4.19Å; F390-W402 HydrophobicContact CD2-CZ2 4.17Å; F390-W402 AromaticContact CD2-NE1 3.07Å; F390-W402 AromaticContact CE2-NE1 3.58Å; F390-W402 HydrophobicContact CG-CD2 4.25Å; F390-W402 AromaticContact CG-CE2 3.51Å; F390-W402 HydrophobicContact CG-CH2 4.41Å; F390-W402 AromaticContact CG-CZ2 3.63Å; F390-W402 HydrophobicContact CG-CZ2 3.63Å; F390-W402 AromaticContact CG-NE1 3.49Å; F390-W402 PolarHBondContact N-O 3.37Å; F390-W402 PolarHBondContact O-N 2.89Å; F390-W402 VanDerWaalsContact O-N 3.16Å; A392-W402 HydrophobicContact CB-CH2 4.08Å; A392-W402 HydrophobicContact CB-CZ3 3.8Å; W402-Q418 HydrophobicContact CB-CB 4.34Å; W402-Q418 WeakPolarHBondContact CB-O 3.33Å; W402-F420 WeakPolarHBondContact CB-O 3.45Å; W402-P421 HydrophobicContact CD2-CB 4.49Å; W402-P421 HydrophobicContact CD2-CG 4.06Å; W402-P421 HydrophobicContact CE3-CB 3.94Å; W402-P421 HydrophobicContact CE3-CG 3.89Å; W402-P421 HydrophobicContact CZ3-CB 4.45Å; W402-P421 HydrophobicContact CZ3-CG 4.34Å
403	G	98.7	Very high	97.9	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	113	-157.2	-178.2	0	0	0	0	0	113	Q418	G403-Q418 PolarHBondContact N-O 2.82Å; G403-Q418 PolarHBondContact O-N 3.47Å
404	K	98.5	Very high	97.7	Very high	88 Å²	88	32 Å²	32	38%	0.383	16%	0.161	S	C	.	.			trans	-70.3	129.5	176.6	-72	-75.2	172.6	-168.2	0	111.1	I348 S388 V406 C409 D417	I348-K404 HydrophobicContact CD1-CD 3.87Å; I348-K404 HydrophobicContact CD1-CG 4.23Å; S388-K404 WeakPolarHBondContact O-CB 3.39Å; S388-K404 PolarHBondContact O-N 3.26Å; K404-V406 VanDerWaalsContact C-N 3.29Å; K404-V406 HydrophobicContact CB-CG2 4Å; K404-V406 PolarHBondContact O-N 3.45Å; K404-C409 PolarHBondContact O-SG 3.27Å; K404-C409 VanDerWaalsContact O-SG 3.42Å; K404-D417 WeakPolarHBondContact CA-OD1 3.49Å; K404-D417 WeakPolarHBondContact CD-OD2 3.46Å; K404-D417 IonicContact NZ-OD2 3.52Å; K404-D417 PolarHBondContact NZ-OD2 3.29Å
405	N	98.3	Very high	97.5	Very high	9 Å²	9	38.7 Å²	38.7	5%	0.048	19%	0.19	C	C	.	.			trans	-94	55.3	-180	-163.9	2.5	0	0	0	112	R407 G408 C409 L410 K414 K415 D416 D417	N405-R407 PolarHBondContact O-N 2.82Å; N405-G408 PolarHBondContact O-N 2.87Å; N405-G408 WeakPolarHBondContact OD1-CA 3.41Å; N405-C409 PolarHBondContact OD1-N 3.28Å; N405-L410 HydrophobicContact CB-CD1 3.62Å; N405-L410 HydrophobicContact CB-CG 3.85Å; N405-L410 PolarHBondContact OD1-N 2.88Å; N405-K414 PolarHBondContact ND2-O 3.43Å; N405-K415 VanDerWaalsContact ND2-C 3.35Å; N405-K415 PolarHBondContact ND2-O 2.7Å; N405-D416 WeakPolarHBondContact CB-O 3.39Å; N405-D416 PolarHBondContact ND2-O 3.26Å; N405-D417 PolarHBondContact N-OD1 2.78Å
406	V	97.8	Very high	97.6	Very high	55 Å²	55	39.9 Å²	39.9	33%	0.333	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-60.7	113.6	-177.5	-176.5	0	0	0	0	109.4	K404 G408 C409 D438	K404-V406 VanDerWaalsContact C-N 3.29Å; K404-V406 HydrophobicContact CB-CG2 4Å; K404-V406 PolarHBondContact O-N 3.45Å; V406-G408 PolarHBondContact O-N 3Å; V406-G408 VanDerWaalsContact O-N 3.1Å; V406-C409 PolarHBondContact N-SG 3.22Å; V406-C409 WeakPolarHBondContact O-CB 3.14Å; V406-C409 PolarHBondContact O-N 2.8Å; V406-C409 VanDerWaalsContact O-N 3.13Å; V406-C409 PolarHBondContact O-SG 2.84Å; V406-D438 HydrophobicContact CB-CB 4.46Å; V406-D438 HydrophobicContact CG1-CB 3.94Å
407	R	97.2	Very high	97.7	Very high	121 Å²	121	37.1 Å²	37.1	46%	0.457	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	55.1	29.2	176.6	-57.4	171.1	176.9	171.9	-1.9	114	G55 F56 Y80 N405 D438	G55-R407 CarbonylContact C-O 3.48Å; F56-R407 HydrophobicContact CB-CB 3.97Å; F56-R407 HydrophobicContact CD2-CB 4.4Å; F56-R407 HydrophobicContact CG-CB 4.47Å; Y80-R407 HydrophobicContact CD1-CB 3.8Å; Y80-R407 HydrophobicContact CD1-CG 4.44Å; Y80-R407 HydrophobicContact CE1-CB 3.77Å; Y80-R407 HydrophobicContact CE1-CG 3.89Å; N405-R407 PolarHBondContact O-N 2.82Å; R407-D438 HydrophobicContact CB-CB 4.21Å; R407-D438 VanDerWaalsContact CD-OD2 3.29Å; R407-D438 WeakPolarHBondContact CD-OD2 3.43Å; R407-D438 HydrophobicContact CG-CB 4.47Å; R407-D438 IonicContact CZ-OD2 3.11Å; R407-D438 IonicContact NE-OD2 3.05Å; R407-D438 IonicContact NH1-OD2 3.04Å; R407-D438 PolarHBondContact NH1-OD2 3.38Å
408	G	97	Very high	97.8	Very high	2 Å²	2	37.4 Å²	37.4	2%	0.021	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	83.8	15.6	177.2	0	0	0	0	0	114.8	N405 V406 L410 G411	N405-G408 PolarHBondContact O-N 2.87Å; N405-G408 WeakPolarHBondContact OD1-CA 3.41Å; V406-G408 PolarHBondContact O-N 3Å; V406-G408 VanDerWaalsContact O-N 3.1Å; G408-L410 PolarHBondContact O-N 3.15Å; G408-L410 VanDerWaalsContact O-N 3.08Å; G408-G411 PolarHBondContact O-N 3.47Å
409	C	97.9	Very high	97.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-18.7	-177.4	67.1	0	0	0	0	114.5	W54 K404 N405 V406 G411 D438 M440	W54-C409 PolarHBondContact NE1-O 2.8Å; K404-C409 PolarHBondContact O-SG 3.27Å; K404-C409 VanDerWaalsContact O-SG 3.42Å; N405-C409 PolarHBondContact OD1-N 3.28Å; V406-C409 PolarHBondContact N-SG 3.22Å; V406-C409 WeakPolarHBondContact O-CB 3.14Å; V406-C409 PolarHBondContact O-N 2.8Å; V406-C409 VanDerWaalsContact O-N 3.13Å; V406-C409 PolarHBondContact O-SG 2.84Å; C409-G411 VanDerWaalsContact C-N 3.33Å; C409-D438 VanDerWaalsContact CB-C 3.4Å; C409-D438 WeakPolarHBondContact CB-O 3.47Å; C409-M440 WeakPolarHBondContact O-CG 3.32Å
410	L	98.6	Very high	97.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-19.8	176.2	-60	-175.4	0	0	0	113.1	H389 V401 N405 G408 I412 Q418	H389-L410 HydrophobicContact CB-CD2 3.79Å; V401-L410 HydrophobicContact CB-CD2 4.03Å; V401-L410 HydrophobicContact CG2-CB 3.83Å; V401-L410 HydrophobicContact CG2-CD2 4.07Å; V401-L410 HydrophobicContact CG2-CG 4.4Å; V401-L410 WeakPolarHBondContact CG2-O 3.19Å; N405-L410 HydrophobicContact CB-CD1 3.62Å; N405-L410 HydrophobicContact CB-CG 3.85Å; N405-L410 PolarHBondContact OD1-N 2.88Å; G408-L410 PolarHBondContact O-N 3.15Å; G408-L410 VanDerWaalsContact O-N 3.08Å; L410-I412 VanDerWaalsContact C-N 3.26Å; L410-I412 HydrophobicContact CB-CD1 4.05Å; L410-I412 HydrophobicContact CB-CG1 4.03Å; L410-I412 HydrophobicContact CB-CG2 4.19Å; L410-I412 HydrophobicContact CD1-CD1 4.04Å; L410-I412 PolarHBondContact O-N 3.46Å; L410-Q418 HydrophobicContact CD1-CB 3.81Å; L410-Q418 HydrophobicContact CD1-CG 3.57Å
411	G	98.2	Very high	97.8	Very high	3 Å²	3	43 Å²	43	3%	0.031	21%	0.213	C	C	.	.			trans	69.3	22.2	176	0	0	0	0	0	114.5	W54 Y82 P84 G408 C409	W54-G411 VanDerWaalsContact CD1-N 3.29Å; Y82-G411 CarbonylContact O-C 3.57Å; Y82-G411 WeakPolarHBondContact O-CA 3.41Å; P84-G411 VanDerWaalsContact CD-O 3.27Å; P84-G411 WeakPolarHBondContact CD-O 3.34Å; G408-G411 PolarHBondContact O-N 3.47Å; C409-G411 VanDerWaalsContact C-N 3.33Å
412	I	98.1	Very high	97.8	Very high	26 Å²	26	48.8 Å²	48.8	13%	0.133	24%	0.235	C	C	.	.	S	Bend	trans	-98.3	10.7	-173	58.8	179.4	0	0	0	114.1	Y82 V401 L410 K414 Q418 W422 V424	Y82-I412 PolarHBondContact O-N 2.99Å; V401-I412 HydrophobicContact CG2-CG2 3.85Å; L410-I412 VanDerWaalsContact C-N 3.26Å; L410-I412 HydrophobicContact CB-CD1 4.05Å; L410-I412 HydrophobicContact CB-CG1 4.03Å; L410-I412 HydrophobicContact CB-CG2 4.19Å; L410-I412 HydrophobicContact CD1-CD1 4.04Å; L410-I412 PolarHBondContact O-N 3.46Å; I412-K414 HydrophobicContact CD1-CD 4.21Å; I412-K414 HydrophobicContact CD1-CG 3.7Å; I412-K414 HydrophobicContact CG1-CG 3.66Å; I412-K414 PolarHBondContact O-N 2.96Å; I412-K414 VanDerWaalsContact O-N 3.12Å; I412-Q418 HydrophobicContact CD1-CG 3.26Å; I412-W422 VanDerWaalsContact CG2-CD1 3.44Å; I412-W422 HydrophobicContact CG2-CG 4.23Å; I412-V424 HydrophobicContact CG2-CG2 4.16Å
413	G	96.9	Very high	97.8	Very high	45 Å²	45	55.2 Å²	55.2	46%	0.464	26%	0.259	S	S	.	.	S	Bend	trans	77.7	-16	-179.8	0	0	0	0	0	115.5	Y82	Y82-G413 WeakPolarHBondContact O-CA 3.35Å; Y82-G413 PolarHBondContact O-N 3.36Å
414	K	94.1	Very high	97.8	Very high	64 Å²	64	55.5 Å²	55.5	28%	0.278	26%	0.261	S	S	.	.	S	Bend	trans	-112.2	164.8	176.7	57.6	179.6	176.1	176.5	0	111.8	N405 I412 Q418	N405-K414 PolarHBondContact ND2-O 3.43Å; I412-K414 HydrophobicContact CD1-CD 4.21Å; I412-K414 HydrophobicContact CD1-CG 3.7Å; I412-K414 HydrophobicContact CG1-CG 3.66Å; I412-K414 PolarHBondContact O-N 2.96Å; I412-K414 VanDerWaalsContact O-N 3.12Å; K414-Q418 VanDerWaalsContact NZ-NE2 3.11Å
415	K	95.3	Very high	97.7	Very high	143 Å²	143	57 Å²	57	62%	0.622	28%	0.277	S	S	*	.			trans	-94.8	-12.9	-178.2	-59.1	-174.6	-170.9	-176.9	0	113.4	Y82 N405	Y82-K415 HydrophobicContact CD1-CG 4.44Å; Y82-K415 HydrophobicContact CE1-CD 4.44Å; Y82-K415 HydrophobicContact CE1-CG 3.77Å; Y82-K415 VanDerWaalsContact OH-CE 3.23Å; Y82-K415 WeakPolarHBondContact OH-CE 3.44Å; N405-K415 VanDerWaalsContact ND2-C 3.35Å; N405-K415 PolarHBondContact ND2-O 2.7Å
416	D	97.2	Very high	97.6	Very high	103 Å²	103	57.4 Å²	57.4	55%	0.551	28%	0.28	S	S	*	.	S	Bend	trans	-70.3	143.7	-173.8	-48.2	-75.5	0	0	0	111.7	N405 Q418	N405-D416 WeakPolarHBondContact CB-O 3.39Å; N405-D416 PolarHBondContact ND2-O 3.26Å; D416-Q418 PolarHBondContact O-NE2 3.31Å
417	D	98.4	Very high	97.4	Very high	47 Å²	47	58.7 Å²	58.7	25%	0.251	29%	0.29	S	S	.	.			trans	-56.6	148.8	166.4	-70.1	-20	0	0	0	110.4	I348 K404 N405 F419	I348-D417 HydrophobicContact CD1-CB 3.52Å; I348-D417 WeakPolarHBondContact CD1-OD2 3.35Å; K404-D417 WeakPolarHBondContact CA-OD1 3.49Å; K404-D417 WeakPolarHBondContact CD-OD2 3.46Å; K404-D417 IonicContact NZ-OD2 3.52Å; K404-D417 PolarHBondContact NZ-OD2 3.29Å; N405-D417 PolarHBondContact N-OD1 2.78Å; D417-F419 HydrophobicContact CB-CE2 4.19Å
418	Q	98.5	Very high	97.3	Very high	16 Å²	16	53.5 Å²	53.5	8%	0.075	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	112.4	177.7	-68.3	-50.3	-75.2	0	0	110.7	I348 W402 G403 L410 I412 K414 D416 F420 W422	I348-Q418 WeakPolarHBondContact CG2-O 3.43Å; W402-Q418 HydrophobicContact CB-CB 4.34Å; W402-Q418 WeakPolarHBondContact CB-O 3.33Å; G403-Q418 PolarHBondContact N-O 2.82Å; G403-Q418 PolarHBondContact O-N 3.47Å; L410-Q418 HydrophobicContact CD1-CB 3.81Å; L410-Q418 HydrophobicContact CD1-CG 3.57Å; I412-Q418 HydrophobicContact CD1-CG 3.26Å; K414-Q418 VanDerWaalsContact NZ-NE2 3.11Å; D416-Q418 PolarHBondContact O-NE2 3.31Å; Q418-F420 VanDerWaalsContact C-N 3.29Å; Q418-W422 HydrophobicContact CG-CB 4.11Å
419	F	98.5	Very high	97.3	Very high	75 Å²	75	58 Å²	58	33%	0.329	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-5.7	179.2	-67.4	-90.2	0	0	0	114.2	I348 G350 K351 G352 P353 D417	I348-F419 HydrophobicContact CB-CD1 4.48Å; I348-F419 HydrophobicContact CD1-CD1 4.39Å; I348-F419 HydrophobicContact CD1-CE1 3.86Å; I348-F419 HydrophobicContact CD1-CE2 4.4Å; I348-F419 HydrophobicContact CD1-CZ 3.86Å; I348-F419 HydrophobicContact CG1-CD1 4.24Å; I348-F419 HydrophobicContact CG1-CE1 3.84Å; I348-F419 HydrophobicContact CG1-CZ 4.35Å; I348-F419 HydrophobicContact CG2-CB 4.31Å; I348-F419 HydrophobicContact CG2-CD1 3.64Å; I348-F419 HydrophobicContact CG2-CE1 4.12Å; I348-F419 HydrophobicContact CG2-CG 4Å; G350-F419 CarbonylContact C-O 3.56Å; G350-F419 WeakPolarHBondContact CA-O 3.27Å; K351-F419 PolarHBondContact N-O 3.45Å; G352-F419 PolarHBondContact N-O 3.41Å; P353-F419 VanDerWaalsContact CA-CD1 3.45Å; P353-F419 HydrophobicContact CB-CD1 3.92Å; P353-F419 HydrophobicContact CB-CE1 4.05Å; P353-F419 HydrophobicContact CB-CG 4.31Å; D417-F419 HydrophobicContact CB-CE2 4.19Å
420	F	98.6	Very high	97.3	Very high	95 Å²	95	58.3 Å²	58.3	42%	0.417	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	152.1	176	-61.3	-79.9	0	0	0	109	G352 L368 W402 Q418 W422	G352-F420 VanDerWaalsContact CA-CE1 3.49Å; L368-F420 HydrophobicContact CD1-CD1 3.89Å; L368-F420 HydrophobicContact CD2-CD1 4.43Å; W402-F420 WeakPolarHBondContact CB-O 3.45Å; Q418-F420 VanDerWaalsContact C-N 3.29Å; F420-W422 PolarHBondContact O-N 3.12Å
421	P	98.7	Very high	97.2	Very high	11 Å²	11	60.8 Å²	60.8	7%	0.071	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-47.8	122.4	168.2	-27.4	34	0	0	0	111.4	G350 I364 L368 F369 F400 W402	G350-P421 WeakPolarHBondContact O-CD 3.46Å; I364-P421 HydrophobicContact CD1-CG 4.43Å; I364-P421 HydrophobicContact CG2-CG 3.91Å; L368-P421 HydrophobicContact CB-CB 4.25Å; L368-P421 HydrophobicContact CB-CG 4.01Å; F369-P421 HydrophobicContact CD1-CB 3.97Å; F369-P421 HydrophobicContact CD1-CG 4.29Å; F369-P421 HydrophobicContact CE1-CB 3.55Å; F369-P421 HydrophobicContact CE1-CG 3.54Å; F369-P421 HydrophobicContact CE2-CG 4.4Å; F369-P421 HydrophobicContact CZ-CB 4.16Å; F369-P421 HydrophobicContact CZ-CG 3.61Å; F400-P421 HydrophobicContact CB-CB 4.2Å; F400-P421 HydrophobicContact CD1-CB 4.16Å; W402-P421 HydrophobicContact CD2-CB 4.49Å; W402-P421 HydrophobicContact CD2-CG 4.06Å; W402-P421 HydrophobicContact CE3-CB 3.94Å; W402-P421 HydrophobicContact CE3-CG 3.89Å; W402-P421 HydrophobicContact CZ3-CB 4.45Å; W402-P421 HydrophobicContact CZ3-CG 4.34Å
422	W	98.6	Very high	97.2	Very high	121 Å²	121	62.4 Å²	62.4	46%	0.458	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.6	179.6	-170.4	-83	0	0	0	109.9	F400 V401 I412 Q418 F420 V424	F400-W422 CarbonylContact C-O 3.53Å; F400-W422 WeakPolarHBondContact CA-O 3.36Å; V401-W422 PolarHBondContact N-O 2.69Å; V401-W422 PolarHBondContact O-N 2.84Å; I412-W422 VanDerWaalsContact CG2-CD1 3.44Å; I412-W422 HydrophobicContact CG2-CG 4.23Å; Q418-W422 HydrophobicContact CG-CB 4.11Å; F420-W422 PolarHBondContact O-N 3.12Å; W422-V424 PolarHBondContact O-N 3.23Å
423	R	98.3	Very high	97.3	Very high	135 Å²	135	61.4 Å²	61.4	51%	0.509	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	125.1	-179.5	-167.9	176.3	67.3	170.6	-0.6	111.1	E398 L399 F400	E398-R423 WeakPolarHBondContact OE1-CD 3.24Å; E398-R423 IonicContact OE1-CZ 3.81Å; E398-R423 IonicContact OE1-NH1 2.82Å; E398-R423 PolarHBondContact OE1-NH1 2.91Å; L399-R423 CarbonylContact O-C 3.51Å; L399-R423 WeakPolarHBondContact O-CA 3.2Å; F400-R423 HydrophobicContact CD1-CB 4.1Å; F400-R423 HydrophobicContact CE1-CB 3.79Å; F400-R423 HydrophobicContact CE1-CG 4.35Å; F400-R423 HydrophobicContact CZ-CB 4.17Å; F400-R423 HydrophobicContact CZ-CG 4.23Å
424	V	98.4	Very high	97.4	Very high	7 Å²	7	59.7 Å²	59.7	4%	0.042	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	132.1	173.1	-173.7	0	0	0	0	109	P84 L399 V401 I412 W422 V426	P84-V424 HydrophobicContact CG-CG1 3.57Å; L399-V424 HydrophobicContact CB-CB 4.37Å; L399-V424 HydrophobicContact CD2-CB 3.98Å; L399-V424 HydrophobicContact CD2-CG1 4.33Å; L399-V424 HydrophobicContact CD2-CG2 4.06Å; L399-V424 HydrophobicContact CG-CB 4.08Å; L399-V424 HydrophobicContact CG-CG2 4.02Å; L399-V424 PolarHBondContact O-N 3.06Å; V401-V424 HydrophobicContact CB-CG2 4.13Å; V401-V424 HydrophobicContact CG1-CG2 3.64Å; V401-V424 HydrophobicContact CG2-CG2 3.43Å; V401-V424 VanDerWaalsContact CG2-CG2 3.43Å; I412-V424 HydrophobicContact CG2-CG2 4.16Å; W422-V424 PolarHBondContact O-N 3.23Å; V424-V426 HydrophobicContact CB-CG2 4.39Å; V424-V426 HydrophobicContact CG1-CG2 3.86Å; V424-V426 PolarHBondContact O-N 3.38Å
425	T	97.1	Very high	97.6	Very high	118 Å²	118	57.1 Å²	57.1	72%	0.724	29%	0.285	S	S	*	.			trans	-86.2	105	176.2	-57.8	0	0	0	0	109.6
426	V	96.1	Very high	97.7	Very high	19 Å²	19	50.3 Å²	50.3	12%	0.115	26%	0.256	C	S	.	.			trans	-118.5	133.5	177.1	-171.4	0	0	0	0	108.6	F52 P84 L399 V424 G428 V430 V444	F52-V426 HydrophobicContact CB-CG1 4.42Å; F52-V426 HydrophobicContact CD1-CG1 4.36Å; F52-V426 HydrophobicContact CD2-CG1 3.84Å; F52-V426 HydrophobicContact CE2-CG1 4.2Å; F52-V426 HydrophobicContact CG-CG1 3.94Å; P84-V426 HydrophobicContact CB-CG2 4.29Å; P84-V426 HydrophobicContact CG-CG2 3.83Å; L399-V426 HydrophobicContact CD2-CG2 4.36Å; V424-V426 HydrophobicContact CB-CG2 4.39Å; V424-V426 HydrophobicContact CG1-CG2 3.86Å; V424-V426 PolarHBondContact O-N 3.38Å; V426-G428 VanDerWaalsContact C-N 3.26Å; V426-G428 PolarHBondContact O-N 2.75Å; V426-V430 HydrophobicContact CB-CG2 4.07Å; V426-V430 HydrophobicContact CG1-CG2 4.25Å; V426-V430 HydrophobicContact CG2-CG2 4.07Å; V426-V444 HydrophobicContact CG1-CG1 4.29Å; V426-V444 HydrophobicContact CG1-CG2 3.75Å
427	P	94.4	Very high	97.8	Very high	82 Å²	82	46.8 Å²	46.8	53%	0.532	24%	0.238	S	C	.	.	S	Bend	trans	-80.2	72.4	-177.3	31.2	-32.7	0	0	0	111.8	F52	F52-P427 HydrophobicContact CD1-CG 4.48Å; F52-P427 HydrophobicContact CE1-CG 3.45Å; F52-P427 VanDerWaalsContact CE1-CG 3.45Å; F52-P427 HydrophobicContact CE2-CG 4.41Å; F52-P427 HydrophobicContact CZ-CG 3.43Å; F52-P427 VanDerWaalsContact CZ-CG 3.43Å
428	G	94.8	Very high	97.8	Very high	12 Å²	12	44.9 Å²	44.9	12%	0.124	23%	0.228	C	C	.	.	S	Bend	trans	159.3	-178.8	178.2	0	0	0	0	0	112.7	V426 V444 K445	V426-G428 VanDerWaalsContact C-N 3.26Å; V426-G428 PolarHBondContact O-N 2.75Å; G428-V444 VanDerWaalsContact CA-CG1 3.45Å; G428-K445 CarbonylContact C-O 3Å; G428-K445 VanDerWaalsContact CA-O 3.3Å; G428-K445 WeakPolarHBondContact CA-O 3.21Å
429	Q	96.9	Very high	97.8	Very high	95 Å²	95	44.1 Å²	44.1	44%	0.444	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	118.1	171.6	-73.2	176.5	2.8	0	0	109.9	V431 V444 K445 L447	Q429-V431 PolarHBondContact O-N 2.91Å; Q429-V444 CarbonylContact O-C 3.36Å; Q429-V444 VanDerWaalsContact O-CA 3.32Å; Q429-V444 WeakPolarHBondContact O-CA 3.49Å; Q429-V444 WeakPolarHBondContact O-CG1 3.24Å; Q429-K445 PolarHBondContact N-O 3.4Å; Q429-K445 PolarHBondContact O-N 3.26Å; Q429-L447 HydrophobicContact CG-CD2 3.89Å
430	V	98.2	Very high	97.8	Very high	7 Å²	7	40.6 Å²	40.6	4%	0.042	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	125.8	177.2	-177.9	0	0	0	0	109.3	V393 G397 L399 V426 V433 A442 V444	V393-V430 HydrophobicContact CG1-CB 4.39Å; V393-V430 HydrophobicContact CG1-CG1 4.4Å; V393-V430 WeakPolarHBondContact CG1-O 3.32Å; V393-V430 HydrophobicContact CG2-CG1 3.98Å; G397-V430 WeakPolarHBondContact CA-O 3.4Å; G397-V430 PolarHBondContact O-N 3.39Å; L399-V430 HydrophobicContact CB-CB 4.31Å; L399-V430 HydrophobicContact CB-CG1 4.35Å; L399-V430 HydrophobicContact CB-CG2 3.91Å; V426-V430 HydrophobicContact CB-CG2 4.07Å; V426-V430 HydrophobicContact CG1-CG2 4.25Å; V426-V430 HydrophobicContact CG2-CG2 4.07Å; V430-V433 HydrophobicContact CG1-CG1 3.62Å; V430-A442 HydrophobicContact CG1-CB 4.37Å; V430-V444 HydrophobicContact CG2-CG2 4.21Å
431	V	97.3	Very high	97.8	Very high	53 Å²	53	36 Å²	36	32%	0.321	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	-39.8	-179.8	178.8	0	0	0	0	111	K382 Q429 L443 K445	K382-V431 WeakPolarHBondContact CD-O 3.27Å; K382-V431 WeakPolarHBondContact CE-O 3.32Å; K382-V431 PolarHBondContact NZ-O 2.97Å; Q429-V431 PolarHBondContact O-N 2.91Å; V431-L443 PolarHBondContact N-O 3.41Å; V431-K445 HydrophobicContact CG2-CB 4.35Å; V431-K445 HydrophobicContact CG2-CD 3.76Å; V431-K445 HydrophobicContact CG2-CG 3.72Å
432	D	98.1	Very high	97.8	Very high	36 Å²	36	35.5 Å²	35.5	19%	0.193	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	161.4	177	-142.6	-35.9	0	0	0	110.6	K382 R384 A442 L443	K382-D432 IonicContact NZ-OD2 3.78Å; K382-D432 PolarHBondContact NZ-OD2 2.93Å; R384-D432 IonicContact CZ-OD1 3.01Å; R384-D432 VanDerWaalsContact CZ-OD1 3.28Å; R384-D432 IonicContact NE-OD1 2.82Å; R384-D432 PolarHBondContact NE-OD1 3.26Å; R384-D432 VanDerWaalsContact NH2-CG 3.28Å; R384-D432 IonicContact NH2-OD1 2.7Å; R384-D432 PolarHBondContact NH2-OD1 2.95Å; R384-D432 IonicContact NH2-OD2 3.82Å; R384-D432 PolarHBondContact NH2-OD2 2.95Å; D432-A442 WeakPolarHBondContact O-CA 3.12Å; D432-L443 HydrophobicContact CB-CB 4.49Å; D432-L443 HydrophobicContact CB-CD1 4.39Å; D432-L443 PolarHBondContact N-O 3.35Å; D432-L443 PolarHBondContact O-N 3.36Å
433	V	98.4	Very high	97.8	Very high	6 Å²	6	30.6 Å²	30.6	4%	0.036	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	146.7	174.9	-59.8	0	0	0	0	110.7	R384 A391 V393 L399 V430 M440 V441 A442	R384-V433 HydrophobicContact CB-CG2 4.05Å; R384-V433 WeakPolarHBondContact CD-O 3.14Å; R384-V433 HydrophobicContact CG-CG2 3.67Å; R384-V433 WeakPolarHBondContact CG-O 3.44Å; R384-V433 PolarHBondContact NE-O 3.01Å; A391-V433 HydrophobicContact CB-CG2 3.73Å; V393-V433 HydrophobicContact CG2-CG1 4.39Å; L399-V433 HydrophobicContact CD1-CG1 3.77Å; L399-V433 HydrophobicContact CD1-CG2 4.33Å; L399-V433 HydrophobicContact CD2-CG1 3.96Å; L399-V433 HydrophobicContact CG-CG1 4.48Å; V430-V433 HydrophobicContact CG1-CG1 3.62Å; V433-M440 HydrophobicContact CB-CE 4.24Å; V433-M440 HydrophobicContact CG2-CE 4.36Å; V433-V441 CarbonylContact C-O 3.53Å; V433-V441 VanDerWaalsContact CA-O 3.25Å; V433-V441 WeakPolarHBondContact CA-O 3.09Å; V433-A442 HydrophobicContact CG1-CB 3.93Å
434	A	98.8	Very high	97.8	Very high	9 Å²	9	24.2 Å²	24.2	7%	0.074	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	130.1	169.3	0	0	0	0	0	108.5	A96 C98 M440 V441	A96-A434 HydrophobicContact CB-CB 4.34Å; A96-A434 WeakPolarHBondContact O-CB 3.5Å; C98-A434 HydrophobicContact CB-CB 4.43Å; C98-A434 VanDerWaalsContact SG-CB 3.56Å; C98-A434 PolarHBondContact SG-O 3.06Å; A434-M440 VanDerWaalsContact O-CA 3.3Å; A434-M440 WeakPolarHBondContact O-CA 3.41Å; A434-V441 HydrophobicContact CB-CB 4.48Å; A434-V441 PolarHBondContact N-O 3.43Å; A434-V441 PolarHBondContact O-N 3.43Å
435	C	98.7	Very high	97.6	Very high	9 Å²	9	27.7 Å²	27.7	6%	0.061	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	121.9	-175.6	-56.7	0	0	0	0	109.3	G386 H389 M440	G386-C435 VanDerWaalsContact CA-CB 3.42Å; H389-C435 WeakPolarHBondContact NE2-CB 3.26Å; C435-M440 VanDerWaalsContact SG-CE 3.6Å
436	G	98.4	Very high	97.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.128	C	C	.	.			trans	-95.1	-153.6	176.4	0	0	0	0	0	112.5	C98 Y275 G386 L387 H389 H439	C98-G436 VanDerWaalsContact CB-CA 3.44Å; C98-G436 VanDerWaalsContact CB-N 3.34Å; Y275-G436 VanDerWaalsContact OH-CA 3.25Å; Y275-G436 WeakPolarHBondContact OH-CA 3.45Å; G386-G436 VanDerWaalsContact CA-O 3.26Å; G386-G436 WeakPolarHBondContact CA-O 3.19Å; L387-G436 PolarHBondContact N-O 3.09Å; L387-G436 VanDerWaalsContact N-O 3.17Å; H389-G436 PolarHBondContact CE1-O 3.07Å; H389-G436 VanDerWaalsContact CE1-O 3.27Å; G436-H439 WeakPolarHBondContact CA-O 3.31Å; G436-H439 PolarHBondContact N-O 2.99Å
437	V	98.5	Very high	96.6	Very high	30 Å²	30	27.6 Å²	27.6	18%	0.182	15%	0.153	C	C	.	.	S	Bend	trans	-74.4	-48	167.5	179.2	0	0	0	0	110.6	Y100 Y275 L387	Y100-V437 HydrophobicContact CD1-CG2 3.46Å; Y100-V437 VanDerWaalsContact CD1-CG2 3.46Å; Y100-V437 HydrophobicContact CD2-CG2 3.71Å; Y100-V437 HydrophobicContact CE1-CG2 3.78Å; Y100-V437 HydrophobicContact CE2-CG2 4.03Å; Y100-V437 HydrophobicContact CG-CG2 3.42Å; Y100-V437 VanDerWaalsContact CG-CG2 3.42Å; Y275-V437 HydrophobicContact CE1-CG2 4.3Å; Y275-V437 PolarHBondContact OH-N 3.06Å; L387-V437 HydrophobicContact CB-CB 4.41Å; L387-V437 HydrophobicContact CB-CG1 4.36Å; L387-V437 HydrophobicContact CB-CG2 4.21Å; L387-V437 HydrophobicContact CD2-CB 4.45Å; L387-V437 HydrophobicContact CD2-CG1 3.83Å; L387-V437 HydrophobicContact CD2-CG2 4.03Å
438	D	98.2	Very high	95.6	Very high	7 Å²	7	30.1 Å²	30.1	4%	0.037	16%	0.161	C	C	.	.	S	Bend	trans	-142.4	11.1	-166.5	62.4	-5.3	0	0	0	113.8	G55 F56 V406 R407 C409	G55-D438 CarbonylContact C-O 3.58Å; G55-D438 WeakPolarHBondContact CA-O 3.45Å; F56-D438 HydrophobicContact CB-CB 4.13Å; F56-D438 WeakPolarHBondContact CB-OD2 3.46Å; F56-D438 VanDerWaalsContact CD1-OD2 3.27Å; F56-D438 WeakPolarHBondContact CD1-OD2 3.39Å; F56-D438 PolarHBondContact N-O 3.26Å; V406-D438 HydrophobicContact CB-CB 4.46Å; V406-D438 HydrophobicContact CG1-CB 3.94Å; R407-D438 HydrophobicContact CB-CB 4.21Å; R407-D438 VanDerWaalsContact CD-OD2 3.29Å; R407-D438 WeakPolarHBondContact CD-OD2 3.43Å; R407-D438 HydrophobicContact CG-CB 4.47Å; R407-D438 IonicContact CZ-OD2 3.11Å; R407-D438 IonicContact NE-OD2 3.05Å; R407-D438 IonicContact NH1-OD2 3.04Å; R407-D438 PolarHBondContact NH1-OD2 3.38Å; C409-D438 VanDerWaalsContact CB-C 3.4Å; C409-D438 WeakPolarHBondContact CB-O 3.47Å
439	H	98.8	Very high	95.7	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	162.2	173.5	68.7	-76.4	0	0	0	111.2	W54 L62 C98 G99 F102 T103 G436	W54-H439 VanDerWaalsContact O-CA 3.28Å; W54-H439 WeakPolarHBondContact O-CA 3.36Å; W54-H439 VanDerWaalsContact O-CB 3.32Å; W54-H439 WeakPolarHBondContact O-CB 3.3Å; L62-H439 HydrophobicContact CD2-CB 3.79Å; C98-H439 WeakPolarHBondContact CB-NE2 3.4Å; G99-H439 PolarHBondContact O-CE1 3.12Å; G99-H439 VanDerWaalsContact O-CE1 3.3Å; F102-H439 PolarHBondContact O-CE1 2.78Å; F102-H439 PolarHBondContact O-NE2 3.42Å; T103-H439 PolarHBondContact OG1-CD2 3.27Å; T103-H439 PolarHBondContact OG1-NE2 3.07Å; G436-H439 WeakPolarHBondContact CA-O 3.31Å; G436-H439 PolarHBondContact N-O 2.99Å
440	M	98.9	Very high	95.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	154.6	177.3	-64.9	-177	63.4	0	0	111.1	V53 W54 A391 V401 C409 V433 A434 C435	V53-M440 WeakPolarHBondContact CA-O 3.5Å; W54-M440 HydrophobicContact CD2-CB 4.2Å; W54-M440 HydrophobicContact CH2-CB 4.36Å; W54-M440 HydrophobicContact CZ2-CB 3.64Å; W54-M440 HydrophobicContact CZ2-CE 3.75Å; W54-M440 HydrophobicContact CZ2-CG 4.28Å; W54-M440 HydrophobicContact CZ2-SD 3.72Å; W54-M440 PolarHBondContact N-O 2.87Å; W54-M440 VanDerWaalsContact N-O 3.14Å; W54-M440 PolarHBondContact O-N 2.86Å; A391-M440 HydrophobicContact CB-CE 3.89Å; V401-M440 HydrophobicContact CG1-CE 4.18Å; V401-M440 HydrophobicContact CG1-SD 4.26Å; C409-M440 WeakPolarHBondContact O-CG 3.32Å; V433-M440 HydrophobicContact CB-CE 4.24Å; V433-M440 HydrophobicContact CG2-CE 4.36Å; A434-M440 VanDerWaalsContact O-CA 3.3Å; A434-M440 WeakPolarHBondContact O-CA 3.41Å; C435-M440 VanDerWaalsContact SG-CE 3.6Å
441	V	98.8	Very high	95.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	136.9	170.6	179.9	0	0	0	0	109.1	V51 F52 V53 A96 T103 V433 A434	V51-V441 HydrophobicContact CG1-CG1 3.57Å; F52-V441 CarbonylContact O-C 3.18Å; F52-V441 VanDerWaalsContact O-CA 3.3Å; F52-V441 WeakPolarHBondContact O-CA 3.41Å; V53-V441 HydrophobicContact CG1-CG1 4.35Å; V53-V441 HydrophobicContact CG1-CG2 3.95Å; A96-V441 HydrophobicContact CB-CB 4.44Å; A96-V441 HydrophobicContact CB-CG1 4Å; T103-V441 HydrophobicContact CG2-CG2 3.81Å; V433-V441 CarbonylContact C-O 3.53Å; V433-V441 VanDerWaalsContact CA-O 3.25Å; V433-V441 WeakPolarHBondContact CA-O 3.09Å; A434-V441 HydrophobicContact CB-CB 4.48Å; A434-V441 PolarHBondContact N-O 3.43Å; A434-V441 PolarHBondContact O-N 3.43Å
442	A	98.7	Very high	95.3	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	134.2	172.7	0	0	0	0	0	111.2	V51 F52 W54 V430 D432 V433 V444	V51-A442 WeakPolarHBondContact CA-O 3.43Å; F52-A442 HydrophobicContact CB-CB 4.42Å; F52-A442 PolarHBondContact N-O 2.74Å; F52-A442 PolarHBondContact O-N 3.21Å; W54-A442 HydrophobicContact CH2-CB 3.76Å; W54-A442 HydrophobicContact CZ3-CB 3.71Å; V430-A442 HydrophobicContact CG1-CB 4.37Å; D432-A442 WeakPolarHBondContact O-CA 3.12Å; V433-A442 HydrophobicContact CG1-CB 3.93Å; A442-V444 HydrophobicContact CB-CG2 3.99Å
443	L	98.4	Very high	95.2	Very high	18 Å²	18	26.8 Å²	26.8	9%	0.094	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	123.5	169.2	-55.3	-175.8	0	0	0	108.3	V51 I93 A96 V431 D432	V51-L443 HydrophobicContact CG2-CD2 4.06Å; I93-L443 HydrophobicContact CB-CD2 4.13Å; I93-L443 HydrophobicContact CG2-CD2 3.72Å; A96-L443 HydrophobicContact CB-CD2 4.28Å; V431-L443 PolarHBondContact N-O 3.41Å; D432-L443 HydrophobicContact CB-CB 4.49Å; D432-L443 HydrophobicContact CB-CD1 4.39Å; D432-L443 PolarHBondContact N-O 3.35Å; D432-L443 PolarHBondContact O-N 3.36Å
444	V	97.7	Very high	94.9	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.006	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	138.3	-165.2	-177.9	0	0	0	0	110.5	H49 K50 F52 V426 G428 Q429 V430 A442	H49-V444 CarbonylContact C-O 3.54Å; H49-V444 WeakPolarHBondContact CA-O 3.25Å; K50-V444 HydrophobicContact CB-CB 4.49Å; K50-V444 PolarHBondContact N-O 2.93Å; K50-V444 PolarHBondContact O-N 3.46Å; F52-V444 HydrophobicContact CD2-CB 3.87Å; F52-V444 HydrophobicContact CD2-CG1 4.35Å; F52-V444 HydrophobicContact CD2-CG2 3.5Å; F52-V444 VanDerWaalsContact CD2-CG2 3.5Å; F52-V444 HydrophobicContact CE2-CB 3.95Å; F52-V444 HydrophobicContact CE2-CG1 4.06Å; F52-V444 HydrophobicContact CE2-CG2 4.05Å; F52-V444 HydrophobicContact CG-CG2 4.47Å; V426-V444 HydrophobicContact CG1-CG1 4.29Å; V426-V444 HydrophobicContact CG1-CG2 3.75Å; G428-V444 VanDerWaalsContact CA-CG1 3.45Å; Q429-V444 CarbonylContact O-C 3.36Å; Q429-V444 VanDerWaalsContact O-CA 3.32Å; Q429-V444 WeakPolarHBondContact O-CA 3.49Å; Q429-V444 WeakPolarHBondContact O-CG1 3.24Å; V430-V444 HydrophobicContact CG2-CG2 4.21Å; A442-V444 HydrophobicContact CB-CG2 3.99Å
445	K	94.5	Very high	94.7	Very high	80 Å²	80	29.6 Å²	29.6	35%	0.348	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	138.2	167.7	-74.5	174	-179.7	178.8	0	110	H49 G428 Q429 V431	H49-K445 VanDerWaalsContact NE2-CE 3.25Å; H49-K445 WeakPolarHBondContact NE2-CE 3.42Å; G428-K445 CarbonylContact C-O 3Å; G428-K445 VanDerWaalsContact CA-O 3.3Å; G428-K445 WeakPolarHBondContact CA-O 3.21Å; Q429-K445 PolarHBondContact N-O 3.4Å; Q429-K445 PolarHBondContact O-N 3.26Å; V431-K445 HydrophobicContact CG2-CB 4.35Å; V431-K445 HydrophobicContact CG2-CD 3.76Å; V431-K445 HydrophobicContact CG2-CG 3.72Å
446	S	90.4	Very high	94.4	Very high	10 Å²	10	31.2 Å²	31.2	7%	0.07	16%	0.161	C	C	.	.			trans	-62.6	150.8	172.6	63	0	0	0	0	111.5	P47 T48 L448	P47-S446 WeakPolarHBondContact CA-OG 3.26Å; T48-S446 PolarHBondContact N-OG 3.29Å; T48-S446 PolarHBondContact O-N 3.1Å; S446-L448 VanDerWaalsContact C-N 3.28Å; S446-L448 VanDerWaalsContact CB-O 3.31Å; S446-L448 WeakPolarHBondContact CB-O 3.44Å; S446-L448 PolarHBondContact OG-O 3.47Å
447	L	82.6	Confident	94	Very high	125 Å²	125	33.8 Å²	33.8	65%	0.654	17%	0.174	S	C	*	.			trans	-74.3	-21.3	175	-64.2	171.5	0	0	0	112.9	Q429	Q429-L447 HydrophobicContact CG-CD2 3.89Å
448	L	72.8	Confident	93.6	Very high	134 Å²	134	34.1 Å²	34.1	70%	0.702	17%	0.174	S	C	*	.			trans	-128.4	0	-177.2	-62.5	174.2	0	0	0	110.5	R45 S446	R45-L448 WeakPolarHBondContact CB-OXT 3.3Å; S446-L448 VanDerWaalsContact C-N 3.28Å; S446-L448 VanDerWaalsContact CB-O 3.31Å; S446-L448 WeakPolarHBondContact CB-O 3.44Å; S446-L448 PolarHBondContact OG-O 3.47Å

Retrieved 448 of 448 residues in 226.5 ms (Link to these results)

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