A0A077Z7A6_TRITR Loading...

DM13 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z7A6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 557 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	34.1	Very low	31.9	Very low	246 Å²	246	148.9 Å²	148.9	100%	1.212	86%	0.855	S	S	*	*				0	69.2	0	-70	175.2	180	0	0	108.8
2	N	35.8	Very low	32.1	Very low	164 Å²	164	148 Å²	148	88%	0.877	85%	0.845	S	S	*	*			trans	-126.1	134.7	-179.9	-105.8	-7.3	0	0	0	109.5	A4	N2-A4 PolarHBondContact O-N 3.37Å
3	S	31.4	Very low	32.4	Very low	110 Å²	110	151 Å²	151	77%	0.769	85%	0.847	S	S	*	*			trans	-57.4	113.8	-171.5	-170.7	0	0	0	0	113.1
4	A	33.6	Very low	32.7	Very low	83 Å²	83	152.9 Å²	152.9	69%	0.686	85%	0.846	S	S	*	*			trans	-154.9	52.2	171.4	0	0	0	0	0	111.6	N2	N2-A4 PolarHBondContact O-N 3.37Å
5	Y	32.4	Very low	32.8	Very low	235 Å²	235	152.3 Å²	152.3	92%	0.922	84%	0.841	S	S	*	*			trans	-153.3	66.7	169.6	-93.5	-79.7	0	0	0	110.5
6	I	30.9	Very low	32.9	Very low	157 Å²	157	151.1 Å²	151.1	81%	0.805	83%	0.832	S	S	*	*			trans	-141.1	81.6	167.8	-53.4	177.5	0	0	0	107.9
7	A	31.1	Very low	33	Very low	90 Å²	90	148.5 Å²	148.5	74%	0.744	83%	0.827	S	S	*	*			trans	-175.7	85	160.8	0	0	0	0	0	110.4
8	T	30	Very low	33	Very low	142 Å²	142	144.9 Å²	144.9	87%	0.871	82%	0.819	S	S	*	*			trans	171.1	88.9	149.6	33.3	0	0	0	0	108.2
9	C	28.1	Very low	32.9	Very low	132 Å²	132	141.1 Å²	141.1	89%	0.892	81%	0.808	S	S	*	*			trans	-173	58	161.9	-100	0	0	0	0	109.4
10	I	32.3	Very low	32.8	Very low	176 Å²	176	142 Å²	142	90%	0.903	81%	0.809	S	S	*	*			trans	-137.6	52.6	172.1	-45.7	178.6	0	0	0	110.1
11	S	31.6	Very low	32.7	Very low	103 Å²	103	144.8 Å²	144.8	72%	0.72	81%	0.812	S	S	*	*	S	Bend	trans	-137.3	-3.5	171.3	58.9	0	0	0	0	116.4
12	D	33.6	Very low	32.6	Very low	138 Å²	138	138.7 Å²	138.7	74%	0.738	79%	0.788	S	S	*	*	S	Bend	trans	-105.1	5.1	-176.1	-75.9	-23	0	0	0	115.8	Q14	D12-Q14 PolarHBondContact O-N 3.2Å
13	Q	36.4	Very low	32.4	Very low	187 Å²	187	135.5 Å²	135.5	87%	0.874	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-4	-178.9	-75.1	-131.4	-62.9	0	0	115.6
14	Q	36.5	Very low	32.6	Very low	178 Å²	178	141.2 Å²	141.2	83%	0.832	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-7.7	178.8	-89	-174.4	-15.4	0	0	115.6	D12	D12-Q14 PolarHBondContact O-N 3.2Å
15	N	34.1	Very low	32.6	Very low	144 Å²	144	140.7 Å²	140.7	77%	0.77	79%	0.792	S	S	*	*	S	Bend	trans	-106.4	1.9	-178	-86.5	-18.1	0	0	0	116
16	L	34.3	Very low	32.8	Very low	132 Å²	132	133.7 Å²	133.7	69%	0.691	78%	0.783	S	S	*	*	S	Bend	trans	-91.1	-12.6	179.3	-99.3	133.8	0	0	0	115
17	S	34	Very low	33.1	Very low	108 Å²	108	131.9 Å²	131.9	76%	0.755	78%	0.781	S	S	*	*	S	Bend	trans	-82.6	-12.9	177.9	67.9	0	0	0	0	114.2
18	A	33.5	Very low	33.8	Very low	83 Å²	83	135.3 Å²	135.3	69%	0.686	78%	0.782	S	S	*	*	S	Bend	trans	-88.3	-16.3	179.9	0	0	0	0	0	114
19	A	31.5	Very low	34.8	Very low	73 Å²	73	132.6 Å²	132.6	60%	0.603	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-4	-172.2	0	0	0	0	0	115.1
20	L	30.5	Very low	36.1	Very low	159 Å²	159	134.3 Å²	134.3	83%	0.832	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	5.8	-176.4	-96.9	150.4	0	0	0	115.2
21	K	31.4	Very low	38.2	Very low	201 Å²	201	129.9 Å²	129.9	87%	0.874	75%	0.752	S	S	*	*			trans	-93.2	13.9	175.2	-82.6	-171.8	177.2	-178.6	0	115	A23	K21-A23 PolarHBondContact O-N 2.77Å; K21-A23 VanDerWaalsContact O-N 3.13Å
22	V	31.1	Very low	40.8	Very low	117 Å²	117	128.8 Å²	128.8	71%	0.709	73%	0.732	S	S	*	*			trans	-79.3	102.5	172	-177.7	0	0	0	0	108.8	R24	V22-R24 VanDerWaalsContact C-N 3.31Å; V22-R24 PolarHBondContact O-N 2.8Å
23	A	32.7	Very low	43.5	Very low	97 Å²	97	125.7 Å²	125.7	80%	0.802	71%	0.71	S	S	*	*			trans	-49.1	91.4	166.5	0	0	0	0	0	110.4	K21 G25	K21-A23 PolarHBondContact O-N 2.77Å; K21-A23 VanDerWaalsContact O-N 3.13Å; A23-G25 PolarHBondContact O-N 2.76Å
24	R	34.4	Very low	46.2	Very low	230 Å²	230	117 Å²	117	87%	0.868	67%	0.67	S	S	*	*			trans	-75.2	105.6	163.7	-78.6	-176.1	175.6	-175.3	-1	106.1	V22 A26	V22-R24 VanDerWaalsContact C-N 3.31Å; V22-R24 PolarHBondContact O-N 2.8Å; R24-A26 PolarHBondContact O-N 2.98Å
25	G	33.2	Very low	48.9	Very low	72 Å²	72	109.7 Å²	109.7	74%	0.742	64%	0.637	S	S	*	*			trans	-47.3	109.9	163.6	0	0	0	0	0	108	A23	A23-G25 PolarHBondContact O-N 2.76Å
26	A	37.9	Very low	51.7	Low	88 Å²	88	108.2 Å²	108.2	73%	0.727	62%	0.624	S	S	*	*			trans	-63.7	127.2	179.9	0	0	0	0	0	107.3	R24	R24-A26 PolarHBondContact O-N 2.98Å
27	P	37.1	Very low	54.6	Low	119 Å²	119	103.2 Å²	103.2	77%	0.773	60%	0.598	S	S	*	*			trans	-55.3	142.3	172	-13.5	26	0	0	0	108.3	A29	P27-A29 VanDerWaalsContact C-N 3.3Å; P27-A29 PolarHBondContact O-N 2.89Å
28	E	44.9	Very low	57.5	Low	163 Å²	163	98.7 Å²	98.7	76%	0.762	57%	0.569	S	S	*	*			trans	-56.5	90.4	-175.6	-153.2	163.2	-139.6	0	0	109.8	K250	E28-K250 IonicContact OE1-NZ 2.72Å; E28-K250 PolarHBondContact OE1-NZ 3.42Å
29	A	52.2	Low	60.5	Low	85 Å²	85	97.6 Å²	97.6	70%	0.702	55%	0.553	S	S	*	*			trans	-58.5	141.6	172.3	0	0	0	0	0	106.9	P27	P27-A29 VanDerWaalsContact C-N 3.3Å; P27-A29 PolarHBondContact O-N 2.89Å
30	E	54.5	Low	63.6	Low	168 Å²	168	94.2 Å²	94.2	79%	0.785	53%	0.525	S	S	*	.	S	Bend	trans	-33.6	144.2	164.7	-66.4	178	162.1	0	0	110.5	W32	E30-W32 PolarHBondContact O-N 2.85Å
31	P	77.6	Confident	66.6	Low	83 Å²	83	88.8 Å²	88.8	54%	0.539	50%	0.499	S	S	.	.			trans	-46.8	114.5	-172.4	-22.5	29.7	0	0	0	109.4	Y33	P31-Y33 HydrophobicContact CB-CE1 3.96Å; P31-Y33 HydrophobicContact CB-CE2 4.33Å; P31-Y33 WeakPolarHBondContact O-CD2 3.3Å; P31-Y33 WeakPolarHBondContact O-CE2 3.26Å; P31-Y33 VanDerWaalsContact O-CG 3.29Å; P31-Y33 PolarHBondContact O-N 3.47Å; P31-Y33 VanDerWaalsContact O-N 3.08Å
32	W	86.1	Confident	69.5	Low	80 Å²	80	81.8 Å²	81.8	30%	0.303	47%	0.471	S	S	.	.			trans	-64.6	120.1	-178.8	175.6	67.5	0	0	0	107.6	E30 G34 P148 I277 P279	E30-W32 PolarHBondContact O-N 2.85Å; W32-G34 PolarHBondContact NE1-O 3.26Å; W32-P148 HydrophobicContact CH2-CB 3.98Å; W32-P148 HydrophobicContact CH2-CG 3.55Å; W32-P148 HydrophobicContact CZ2-CG 4.15Å; W32-I277 WeakPolarHBondContact CZ3-O 3.27Å; W32-P279 HydrophobicContact CE3-CB 3.96Å; W32-P279 HydrophobicContact CE3-CG 4.42Å; W32-P279 HydrophobicContact CZ3-CB 4.29Å; W32-P279 HydrophobicContact CZ3-CG 4.39Å; W32-P279 WeakPolarHBondContact O-CB 3.4Å
33	Y	90.3	Very high	72.2	Confident	73 Å²	73	81.7 Å²	81.7	29%	0.286	46%	0.458	S	S	.	.			trans	-95.6	10.1	-174.9	-60	-74.7	0	0	0	112.9	P31 Y53 Q61 L63	P31-Y33 HydrophobicContact CB-CE1 3.96Å; P31-Y33 HydrophobicContact CB-CE2 4.33Å; P31-Y33 WeakPolarHBondContact O-CD2 3.3Å; P31-Y33 WeakPolarHBondContact O-CE2 3.26Å; P31-Y33 VanDerWaalsContact O-CG 3.29Å; P31-Y33 PolarHBondContact O-N 3.47Å; P31-Y33 VanDerWaalsContact O-N 3.08Å; Y33-Y53 WeakPolarHBondContact O-CB 3.16Å; Y33-Q61 PolarHBondContact O-NE2 3Å; Y33-L63 HydrophobicContact CD1-CD1 3.8Å; Y33-L63 HydrophobicContact CD1-CD2 4.23Å; Y33-L63 HydrophobicContact CD1-CG 4.49Å; Y33-L63 HydrophobicContact CD2-CD1 3.29Å; Y33-L63 HydrophobicContact CE1-CD1 3.91Å; Y33-L63 HydrophobicContact CE1-CD2 4.3Å; Y33-L63 HydrophobicContact CE2-CD1 3.42Å; Y33-L63 VanDerWaalsContact CE2-CD1 3.42Å; Y33-L63 HydrophobicContact CG-CD1 3.5Å; Y33-L63 VanDerWaalsContact CG-CD1 3.5Å; Y33-L63 HydrophobicContact CG-CG 4.4Å
34	G	92.3	Very high	74.8	Confident	3 Å²	3	79.6 Å²	79.6	3%	0.031	43%	0.432	C	S	.	.	S	Bend	trans	104.7	-168.8	-175.5	0	0	0	0	0	111.8	W32 F36 L54	W32-G34 PolarHBondContact NE1-O 3.26Å; G34-F36 PolarHBondContact O-N 2.85Å; G34-L54 CarbonylContact C-O 3.47Å; G34-L54 WeakPolarHBondContact CA-O 3.32Å
35	D	93	Very high	77.3	Confident	25 Å²	25	77 Å²	77	13%	0.134	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	122.3	-178.6	-60.5	-32.3	0	0	0	110	L37 Y53 L54 R276	D35-L37 PolarHBondContact O-N 2.86Å; D35-Y53 CarbonylContact O-C 3.58Å; D35-Y53 VanDerWaalsContact O-CA 3.27Å; D35-Y53 WeakPolarHBondContact O-CA 3.34Å; D35-L54 HydrophobicContact CB-CB 4.27Å; D35-L54 PolarHBondContact N-O 2.79Å; D35-L54 PolarHBondContact O-N 3.08Å; D35-R276 IonicContact OD1-CZ 2.67Å; D35-R276 IonicContact OD1-NH1 3.91Å; D35-R276 PolarHBondContact OD1-NH1 2.88Å; D35-R276 IonicContact OD1-NH2 3.4Å; D35-R276 PolarHBondContact OD1-NH2 2.84Å; D35-R276 IonicContact OD2-CZ 3.18Å; D35-R276 IonicContact OD2-NH1 2.8Å; D35-R276 PolarHBondContact OD2-NH1 3.21Å; D35-R276 IonicContact OD2-NH2 2.78Å; D35-R276 PolarHBondContact OD2-NH2 3.22Å
36	F	93.5	Very high	79.7	Confident	113 Å²	113	74.8 Å²	74.8	50%	0.496	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	120	179.8	-178	-119.2	0	0	0	110.5	G34 G38 K51 V52 Y53	G34-F36 PolarHBondContact O-N 2.85Å; F36-G38 VanDerWaalsContact CE2-C 3.49Å; F36-G38 WeakPolarHBondContact CE2-O 3.5Å; F36-K51 HydrophobicContact CE2-CB 3.91Å; F36-K51 HydrophobicContact CE2-CG 4.16Å; F36-V52 WeakPolarHBondContact CD2-O 3.47Å; F36-Y53 HydrophobicContact CB-CD1 3.95Å; F36-Y53 HydrophobicContact CB-CE1 3.8Å; F36-Y53 AromaticContact CD2-CD1 4Å; F36-Y53 HydrophobicContact CD2-CD1 4Å; F36-Y53 AromaticContact CD2-CE1 3.55Å; F36-Y53 HydrophobicContact CD2-CE1 3.55Å; F36-Y53 HydrophobicContact CD2-CE2 4.2Å; F36-Y53 HydrophobicContact CD2-CG 4.5Å; F36-Y53 AromaticContact CD2-CZ 3.65Å; F36-Y53 HydrophobicContact CG-CD1 4.48Å; F36-Y53 HydrophobicContact CG-CE1 4.07Å
37	L	94	Very high	82.1	Confident	27 Å²	27	72.4 Å²	72.4	14%	0.141	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-27.9	-179.5	-70.6	169.1	0	0	0	112.2	D35 V52 L54 L60 V139 L141 Q143	D35-L37 PolarHBondContact O-N 2.86Å; L37-V52 HydrophobicContact CB-CB 4.36Å; L37-V52 HydrophobicContact CB-CG1 4.35Å; L37-V52 HydrophobicContact CD1-CG1 3.98Å; L37-V52 PolarHBondContact N-O 3.14Å; L37-L54 HydrophobicContact CD1-CB 3.99Å; L37-L54 HydrophobicContact CG-CB 4.27Å; L37-L60 HydrophobicContact CD1-CD2 3.44Å; L37-L60 VanDerWaalsContact CD1-CD2 3.44Å; L37-V139 HydrophobicContact CB-CG2 4.24Å; L37-L141 HydrophobicContact CD1-CD2 3.58Å; L37-L141 HydrophobicContact CD2-CD2 4.27Å; L37-L141 HydrophobicContact CG-CD2 4.49Å; L37-Q143 HydrophobicContact CD2-CG 4.11Å
38	G	94.9	Very high	84.8	Confident	14 Å²	14	67 Å²	67	14%	0.144	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.6	179.6	179.5	0	0	0	0	0	112.9	F36 V52	F36-G38 VanDerWaalsContact CE2-C 3.49Å; F36-G38 WeakPolarHBondContact CE2-O 3.5Å; G38-V52 PolarHBondContact O-N 3.04Å
39	T	97.3	Very high	87.1	Confident	59 Å²	59	63.6 Å²	63.6	36%	0.362	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	133.2	171.1	-53.7	0	0	0	0	108.2	P41 F49 G50	T39-P41 WeakPolarHBondContact O-CD 3.2Å; T39-F49 HydrophobicContact CG2-CD2 3.97Å; T39-F49 HydrophobicContact CG2-CE2 3.68Å; T39-F49 HydrophobicContact CG2-CZ 4.38Å; T39-G50 CarbonylContact C-O 3.54Å; T39-G50 WeakPolarHBondContact CA-O 3.23Å
40	L	96.9	Very high	89.3	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.016	30%	0.298	C	S	.	.			trans	-59.7	123.3	174	-72.5	169.9	0	0	0	109.3	I48 G50 V52 I62 F65 L127 V139	L40-I48 HydrophobicContact CB-CG2 4.08Å; L40-G50 PolarHBondContact N-O 3.42Å; L40-V52 HydrophobicContact CD1-CG2 4.3Å; L40-V52 HydrophobicContact CD2-CG2 4.25Å; L40-V52 HydrophobicContact CG-CG2 3.84Å; L40-I62 HydrophobicContact CD1-CG2 4.42Å; L40-F65 HydrophobicContact CD1-CD2 4.09Å; L40-F65 HydrophobicContact CD1-CE2 3.84Å; L40-L127 HydrophobicContact CD1-CD1 4.32Å; L40-L127 HydrophobicContact CD1-CG 4.49Å; L40-V139 HydrophobicContact CD2-CG1 4.37Å
41	P	94.2	Very high	91.3	Very high	44 Å²	44	55.3 Å²	55.3	29%	0.286	28%	0.278	S	S	.	.			trans	-78.4	142.5	178.4	31	-32.9	0	0	0	110.9	T39 R43	T39-P41 WeakPolarHBondContact O-CD 3.2Å; P41-R43 VanDerWaalsContact C-N 3.33Å; P41-R43 HydrophobicContact CB-CG 4.28Å; P41-R43 HydrophobicContact CG-CG 4.19Å; P41-R43 PolarHBondContact O-N 3.36Å; P41-R43 VanDerWaalsContact O-N 3.15Å
42	D	91.7	Very high	92.1	Very high	54 Å²	54	51.4 Å²	51.4	29%	0.289	25%	0.252	S	S	.	.			trans	-86.8	67	175.1	-167.9	21.1	0	0	0	111.5	Q44 E45 I46 G47 I48	D42-Q44 PolarHBondContact O-N 3.38Å; D42-Q44 VanDerWaalsContact O-N 3.16Å; D42-E45 PolarHBondContact O-N 3.39Å; D42-E45 VanDerWaalsContact O-N 3.1Å; D42-E45 VanDerWaalsContact OD2-CA 3.32Å; D42-E45 WeakPolarHBondContact OD2-CA 3.44Å; D42-I46 PolarHBondContact OD1-N 3.03Å; D42-I46 PolarHBondContact OD2-N 2.89Å; D42-G47 VanDerWaalsContact CG-N 3.33Å; D42-G47 PolarHBondContact OD1-N 3.11Å; D42-G47 WeakPolarHBondContact OD2-CA 3.49Å; D42-G47 PolarHBondContact OD2-N 2.86Å; D42-I48 HydrophobicContact CB-CB 4.36Å; D42-I48 WeakPolarHBondContact CB-O 3.33Å; D42-I48 VanDerWaalsContact CG-N 3.29Å; D42-I48 PolarHBondContact OD1-N 3.03Å
43	R	88.2	Confident	92.6	Very high	116 Å²	116	49.2 Å²	49.2	44%	0.438	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.1	-170.2	-74	-170.7	169.1	114.1	3.5	114.2	P41 D135 G137 H138	P41-R43 VanDerWaalsContact C-N 3.33Å; P41-R43 HydrophobicContact CB-CG 4.28Å; P41-R43 HydrophobicContact CG-CG 4.19Å; P41-R43 PolarHBondContact O-N 3.36Å; P41-R43 VanDerWaalsContact O-N 3.15Å; R43-D135 IonicContact CZ-OD2 2.76Å; R43-D135 IonicContact NH1-OD1 2.69Å; R43-D135 PolarHBondContact NH1-OD1 2.95Å; R43-D135 IonicContact NH1-OD2 3.07Å; R43-D135 PolarHBondContact NH1-OD2 2.76Å; R43-G137 VanDerWaalsContact NH1-CA 3.34Å; R43-H138 PolarHBondContact NH1-CE1 3.36Å; R43-H138 VanDerWaalsContact NH1-N 3.15Å; R43-H138 PolarHBondContact NH1-ND1 2.87Å; R43-H138 PolarHBondContact NH2-CE1 3.09Å
44	Q	87	Confident	92.8	Very high	53 Å²	53	45.9 Å²	45.9	25%	0.248	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	2.8	-178.8	-71.2	73.9	21	0	0	112.9	D42 I46 D135 F136	D42-Q44 PolarHBondContact O-N 3.38Å; D42-Q44 VanDerWaalsContact O-N 3.16Å; Q44-I46 VanDerWaalsContact C-N 3.26Å; Q44-I46 HydrophobicContact CB-CG1 4.26Å; Q44-I46 HydrophobicContact CB-CG2 4.12Å; Q44-I46 PolarHBondContact O-N 3.12Å; Q44-D135 PolarHBondContact NE2-O 3.42Å; Q44-F136 HydrophobicContact CG-CD1 4.35Å; Q44-F136 HydrophobicContact CG-CE1 4.14Å; Q44-F136 HydrophobicContact CG-CZ 4.37Å; Q44-F136 VanDerWaalsContact OE1-CA 3.26Å; Q44-F136 PolarHBondContact OE1-O 3.45Å
45	E	85.9	Confident	92.9	Very high	175 Å²	175	45.9 Å²	45.9	82%	0.818	23%	0.23	S	C	*	.	S	Bend	trans	56.3	38.5	-177.6	-57.5	-177.9	-179.5	0	0	113.1	D42	D42-E45 PolarHBondContact O-N 3.39Å; D42-E45 VanDerWaalsContact O-N 3.1Å; D42-E45 VanDerWaalsContact OD2-CA 3.32Å; D42-E45 WeakPolarHBondContact OD2-CA 3.44Å
46	I	85.3	Confident	92.9	Very high	26 Å²	26	46.5 Å²	46.5	13%	0.133	23%	0.234	C	C	.	.	S	Bend	trans	-105.8	14	-179.5	62.3	169.1	0	0	0	112.5	D42 Q44 I48 Y67 N68 F136	D42-I46 PolarHBondContact OD1-N 3.03Å; D42-I46 PolarHBondContact OD2-N 2.89Å; Q44-I46 VanDerWaalsContact C-N 3.26Å; Q44-I46 HydrophobicContact CB-CG1 4.26Å; Q44-I46 HydrophobicContact CB-CG2 4.12Å; Q44-I46 PolarHBondContact O-N 3.12Å; I46-I48 HydrophobicContact CD1-CD1 3.96Å; I46-I48 HydrophobicContact CD1-CG1 4.38Å; I46-I48 HydrophobicContact CG1-CD1 3.97Å; I46-I48 HydrophobicContact CG1-CG1 4.08Å; I46-Y67 HydrophobicContact CD1-CD2 4.37Å; I46-Y67 HydrophobicContact CD1-CE2 3.95Å; I46-N68 PolarHBondContact O-ND2 2.76Å; I46-N68 PolarHBondContact O-OD1 2.87Å; I46-F136 HydrophobicContact CD1-CD1 3.78Å; I46-F136 HydrophobicContact CD1-CE1 3.62Å
47	G	86.5	Confident	92.8	Very high	38 Å²	38	43.4 Å²	43.4	39%	0.392	23%	0.226	S	C	.	.			trans	79	35.5	176.9	0	0	0	0	0	113.8	D42 T66	D42-G47 VanDerWaalsContact CG-N 3.33Å; D42-G47 PolarHBondContact OD1-N 3.11Å; D42-G47 WeakPolarHBondContact OD2-CA 3.49Å; D42-G47 PolarHBondContact OD2-N 2.86Å; G47-T66 CarbonylContact O-C 3.59Å
48	I	93.6	Very high	92.7	Very high	6 Å²	6	43.6 Å²	43.6	3%	0.031	23%	0.229	C	C	.	.			trans	-76.3	125.7	169	-69.8	165.4	0	0	0	109.9	L40 D42 I46 T66 Y67 L127 F136	L40-I48 HydrophobicContact CB-CG2 4.08Å; D42-I48 HydrophobicContact CB-CB 4.36Å; D42-I48 WeakPolarHBondContact CB-O 3.33Å; D42-I48 VanDerWaalsContact CG-N 3.29Å; D42-I48 PolarHBondContact OD1-N 3.03Å; I46-I48 HydrophobicContact CD1-CD1 3.96Å; I46-I48 HydrophobicContact CD1-CG1 4.38Å; I46-I48 HydrophobicContact CG1-CD1 3.97Å; I46-I48 HydrophobicContact CG1-CG1 4.08Å; I48-T66 VanDerWaalsContact CA-O 3.32Å; I48-T66 WeakPolarHBondContact CA-O 3.4Å; I48-Y67 HydrophobicContact CD1-CD2 4.44Å; I48-Y67 HydrophobicContact CG1-CD2 3.97Å; I48-L127 HydrophobicContact CD1-CD1 3.83Å; I48-L127 HydrophobicContact CG1-CD1 4.16Å; I48-L127 HydrophobicContact CG2-CD1 3.65Å; I48-F136 HydrophobicContact CD1-CB 4.15Å; I48-F136 HydrophobicContact CD1-CD1 4.01Å
49	F	94.5	Very high	92.6	Very high	90 Å²	90	43.4 Å²	43.4	40%	0.395	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	146.6	171.6	-177	-102.2	0	0	0	110.1	T39 N64 F65 T66	T39-F49 HydrophobicContact CG2-CD2 3.97Å; T39-F49 HydrophobicContact CG2-CE2 3.68Å; T39-F49 HydrophobicContact CG2-CZ 4.38Å; F49-N64 HydrophobicContact CD1-CB 4.15Å; F49-N64 WeakPolarHBondContact CD1-O 3.29Å; F49-N64 HydrophobicContact CE1-CB 3.89Å; F49-F65 CarbonylContact O-C 3.59Å; F49-F65 VanDerWaalsContact O-CA 3.24Å; F49-F65 WeakPolarHBondContact O-CA 3.48Å; F49-F65 WeakPolarHBondContact O-CD2 3.32Å; F49-T66 PolarHBondContact N-O 3.16Å; F49-T66 PolarHBondContact O-N 2.71Å
50	G	97	Very high	92.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.2	133	172.6	0	0	0	0	0	111.9	T39 L40 L63	T39-G50 CarbonylContact C-O 3.54Å; T39-G50 WeakPolarHBondContact CA-O 3.23Å; L40-G50 PolarHBondContact N-O 3.42Å; G50-L63 WeakPolarHBondContact CA-O 3.35Å
51	K	96.6	Very high	92.3	Very high	80 Å²	80	40.6 Å²	40.6	35%	0.348	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	118.8	176.1	-69	-178.9	-175.7	175.5	0	109.5	F36 Y53 I62 L63	F36-K51 HydrophobicContact CE2-CB 3.91Å; F36-K51 HydrophobicContact CE2-CG 4.16Å; K51-Y53 HydrophobicContact CB-CD2 4.42Å; K51-Y53 HydrophobicContact CB-CE2 3.54Å; K51-Y53 WeakPolarHBondContact O-CD2 3.48Å; K51-Y53 WeakPolarHBondContact O-CE2 3.39Å; K51-I62 CarbonylContact O-C 3.36Å; K51-I62 VanDerWaalsContact O-CA 3.3Å; K51-I62 WeakPolarHBondContact O-CA 3.33Å; K51-L63 HydrophobicContact CB-CB 4.46Å; K51-L63 PolarHBondContact N-O 2.82Å; K51-L63 PolarHBondContact O-N 3.02Å
52	V	96.3	Very high	92.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	130.8	-175.2	-170.9	0	0	0	0	109.9	F36 L37 G38 L40 L60 I62 F125 V139	F36-V52 WeakPolarHBondContact CD2-O 3.47Å; L37-V52 HydrophobicContact CB-CB 4.36Å; L37-V52 HydrophobicContact CB-CG1 4.35Å; L37-V52 HydrophobicContact CD1-CG1 3.98Å; L37-V52 PolarHBondContact N-O 3.14Å; G38-V52 PolarHBondContact O-N 3.04Å; L40-V52 HydrophobicContact CD1-CG2 4.3Å; L40-V52 HydrophobicContact CD2-CG2 4.25Å; L40-V52 HydrophobicContact CG-CG2 3.84Å; V52-L60 HydrophobicContact CG1-CD2 4.45Å; V52-I62 HydrophobicContact CG2-CG1 4.48Å; V52-I62 HydrophobicContact CG2-CG2 4.4Å; V52-F125 HydrophobicContact CG1-CD1 3.76Å; V52-F125 HydrophobicContact CG1-CE1 3.93Å; V52-F125 HydrophobicContact CG2-CD1 4.25Å; V52-F125 HydrophobicContact CG2-CE1 4.15Å; V52-V139 HydrophobicContact CB-CG2 4.15Å; V52-V139 HydrophobicContact CG1-CG2 4.19Å; V52-V139 HydrophobicContact CG2-CG1 4.24Å; V52-V139 HydrophobicContact CG2-CG2 4.16Å
53	Y	94.8	Very high	92.4	Very high	35 Å²	35	36.7 Å²	36.7	14%	0.137	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140	178.3	-60.1	-96.8	0	0	0	111.3	Y33 D35 F36 K51 L60 Q61 L63	Y33-Y53 WeakPolarHBondContact O-CB 3.16Å; D35-Y53 CarbonylContact O-C 3.58Å; D35-Y53 VanDerWaalsContact O-CA 3.27Å; D35-Y53 WeakPolarHBondContact O-CA 3.34Å; F36-Y53 HydrophobicContact CB-CD1 3.95Å; F36-Y53 HydrophobicContact CB-CE1 3.8Å; F36-Y53 AromaticContact CD2-CD1 4Å; F36-Y53 HydrophobicContact CD2-CD1 4Å; F36-Y53 AromaticContact CD2-CE1 3.55Å; F36-Y53 HydrophobicContact CD2-CE1 3.55Å; F36-Y53 HydrophobicContact CD2-CE2 4.2Å; F36-Y53 HydrophobicContact CD2-CG 4.5Å; F36-Y53 AromaticContact CD2-CZ 3.65Å; F36-Y53 HydrophobicContact CG-CD1 4.48Å; F36-Y53 HydrophobicContact CG-CE1 4.07Å; K51-Y53 HydrophobicContact CB-CD2 4.42Å; K51-Y53 HydrophobicContact CB-CE2 3.54Å; K51-Y53 WeakPolarHBondContact O-CD2 3.48Å; K51-Y53 WeakPolarHBondContact O-CE2 3.39Å; Y53-L60 WeakPolarHBondContact O-CA 3.35Å; Y53-Q61 PolarHBondContact N-O 3.38Å; Y53-Q61 PolarHBondContact O-N 2.75Å; Y53-L63 HydrophobicContact CD2-CD1 4.32Å; Y53-L63 HydrophobicContact CD2-CG 4.16Å; Y53-L63 HydrophobicContact CE2-CB 4.27Å; Y53-L63 HydrophobicContact CE2-CD1 3.75Å; Y53-L63 HydrophobicContact CE2-CG 3.91Å
54	L	94.8	Very high	92.7	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.01	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	115.6	169.9	-172.7	67.8	0	0	0	110.7	G34 D35 L37 N56 L60 I119 Q143 P147	G34-L54 CarbonylContact C-O 3.47Å; G34-L54 WeakPolarHBondContact CA-O 3.32Å; D35-L54 HydrophobicContact CB-CB 4.27Å; D35-L54 PolarHBondContact N-O 2.79Å; D35-L54 PolarHBondContact O-N 3.08Å; L37-L54 HydrophobicContact CD1-CB 3.99Å; L37-L54 HydrophobicContact CG-CB 4.27Å; L54-N56 WeakPolarHBondContact CD1-O 3.4Å; L54-L60 HydrophobicContact CB-CD2 4.25Å; L54-L60 HydrophobicContact CD1-CD2 3.54Å; L54-I119 HydrophobicContact CD1-CB 4.1Å; L54-I119 HydrophobicContact CD1-CD1 3.48Å; L54-I119 VanDerWaalsContact CD1-CD1 3.48Å; L54-I119 HydrophobicContact CD1-CG1 4.4Å; L54-I119 HydrophobicContact CD1-CG2 3.85Å; L54-Q143 VanDerWaalsContact CD2-CD 3.47Å; L54-P147 HydrophobicContact CD2-CB 3.75Å; L54-P147 HydrophobicContact CD2-CG 3.82Å
55	V	94.5	Very high	93.1	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.018	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-49.6	178.4	172.5	0	0	0	0	110.4	C59 Q61 P148 P278 P279 V281	V55-C59 HydrophobicContact CB-CB 3.91Å; V55-C59 WeakPolarHBondContact CB-O 3.31Å; V55-C59 HydrophobicContact CG1-CB 4.14Å; V55-C59 PolarHBondContact N-O 3.38Å; V55-Q61 HydrophobicContact CG2-CB 4.12Å; V55-Q61 HydrophobicContact CG2-CG 3.67Å; V55-P148 WeakPolarHBondContact O-CB 3.16Å; V55-P278 HydrophobicContact CG1-CB 4.34Å; V55-P279 HydrophobicContact CB-CG 4.33Å; V55-P279 HydrophobicContact CG1-CG 3.98Å; V55-P279 HydrophobicContact CG2-CG 4.25Å; V55-P279 WeakPolarHBondContact O-CD 3.25Å; V55-V281 HydrophobicContact CB-CG2 4.24Å; V55-V281 HydrophobicContact CG1-CG2 3.53Å; V55-V281 HydrophobicContact CG2-CG2 3.7Å
56	N	93.4	Very high	93.5	Very high	38 Å²	38	25.3 Å²	25.3	20%	0.203	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	-171.1	177.1	64.1	34.9	0	0	0	109.2	L54 T58 C59 P148 P278	L54-N56 WeakPolarHBondContact CD1-O 3.4Å; N56-T58 PolarHBondContact O-N 2.95Å; N56-T58 VanDerWaalsContact O-N 3.11Å; N56-T58 PolarHBondContact OD1-N 3.39Å; N56-T58 PolarHBondContact OD1-OG1 2.59Å; N56-C59 PolarHBondContact N-O 3.06Å; N56-C59 PolarHBondContact O-N 3.49Å; N56-C59 VanDerWaalsContact OD1-CB 3.28Å; N56-C59 WeakPolarHBondContact OD1-CB 3.39Å; N56-C59 PolarHBondContact OD1-N 2.79Å; N56-P148 WeakPolarHBondContact CA-O 3.28Å; N56-P148 VanDerWaalsContact CB-O 3.28Å; N56-P148 WeakPolarHBondContact CB-O 3.26Å; N56-P278 HydrophobicContact CB-CB 4.42Å; N56-P278 HydrophobicContact CB-CG 4.02Å
57	S	92	Very high	93.9	Very high	48 Å²	48	24.1 Å²	24.1	34%	0.336	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-19.8	-177.7	57	0	0	0	0	115.6	A118 I119	S57-A118 CarbonylContact O-C 3.47Å; S57-A118 WeakPolarHBondContact O-CA 3.18Å; S57-I119 PolarHBondContact O-N 2.78Å
58	T	91.5	Very high	94	Very high	32 Å²	32	24.3 Å²	24.3	20%	0.196	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124	1.6	-177.7	64.2	0	0	0	0	113.6	N56 T112 L113 I119	N56-T58 PolarHBondContact O-N 2.95Å; N56-T58 VanDerWaalsContact O-N 3.11Å; N56-T58 PolarHBondContact OD1-N 3.39Å; N56-T58 PolarHBondContact OD1-OG1 2.59Å; T58-T112 WeakPolarHBondContact O-CA 3.48Å; T58-L113 PolarHBondContact O-N 3.45Å; T58-I119 VanDerWaalsContact C-CD1 3.45Å
59	C	92.9	Very high	93.7	Very high	9 Å²	9	25.4 Å²	25.4	6%	0.061	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	129.9	-175.7	-173	0	0	0	0	112.8	V55 N56 I111 I119	V55-C59 HydrophobicContact CB-CB 3.91Å; V55-C59 WeakPolarHBondContact CB-O 3.31Å; V55-C59 HydrophobicContact CG1-CB 4.14Å; V55-C59 PolarHBondContact N-O 3.38Å; N56-C59 PolarHBondContact N-O 3.06Å; N56-C59 PolarHBondContact O-N 3.49Å; N56-C59 VanDerWaalsContact OD1-CB 3.28Å; N56-C59 WeakPolarHBondContact OD1-CB 3.39Å; N56-C59 PolarHBondContact OD1-N 2.79Å; C59-I111 WeakPolarHBondContact CA-O 3.28Å; C59-I119 VanDerWaalsContact C-CD1 3.41Å; C59-I119 WeakPolarHBondContact O-CD1 3.47Å
60	L	93.7	Very high	93.5	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	153.5	167.6	-64.7	171.6	0	0	0	109.1	L37 V52 Y53 L54 I111 I119 F125	L37-L60 HydrophobicContact CD1-CD2 3.44Å; L37-L60 VanDerWaalsContact CD1-CD2 3.44Å; V52-L60 HydrophobicContact CG1-CD2 4.45Å; Y53-L60 WeakPolarHBondContact O-CA 3.35Å; L54-L60 HydrophobicContact CB-CD2 4.25Å; L54-L60 HydrophobicContact CD1-CD2 3.54Å; L60-I111 HydrophobicContact CB-CB 4.25Å; L60-I111 PolarHBondContact N-O 3.45Å; L60-I111 PolarHBondContact O-N 2.9Å; L60-I119 HydrophobicContact CD1-CD1 4.43Å; L60-I119 HydrophobicContact CD1-CG2 4.38Å; L60-I119 HydrophobicContact CD2-CD1 3.95Å; L60-I119 HydrophobicContact CD2-CG2 4.13Å; L60-I119 HydrophobicContact CG-CD1 3.61Å; L60-I119 HydrophobicContact CG-CG1 4.26Å; L60-I119 HydrophobicContact CG-CG2 4.37Å; L60-F125 HydrophobicContact CD1-CB 4.09Å; L60-F125 HydrophobicContact CD1-CD1 3.98Å; L60-F125 HydrophobicContact CD1-CD2 3.55Å; L60-F125 HydrophobicContact CD1-CE1 4.3Å; L60-F125 HydrophobicContact CD1-CE2 3.9Å; L60-F125 HydrophobicContact CD1-CG 3.58Å; L60-F125 HydrophobicContact CD1-CZ 4.26Å
61	Q	93.5	Very high	93	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.009	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	146.9	164.7	64.7	-173.9	-28.7	0	0	111.7	Y33 Y53 V55 H108 V109 V110	Y33-Q61 PolarHBondContact O-NE2 3Å; Y53-Q61 PolarHBondContact N-O 3.38Å; Y53-Q61 PolarHBondContact O-N 2.75Å; V55-Q61 HydrophobicContact CG2-CB 4.12Å; V55-Q61 HydrophobicContact CG2-CG 3.67Å; Q61-H108 PolarHBondContact OE1-CE1 2.77Å; Q61-H108 PolarHBondContact OE1-NE2 2.79Å; Q61-V109 CarbonylContact C-O 3.56Å; Q61-V109 WeakPolarHBondContact CA-O 3.36Å; Q61-V110 HydrophobicContact CB-CG2 4.46Å
62	I	95.1	Very high	92.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	120.3	-179.8	-42.7	173.4	0	0	0	107.9	L40 K51 V52 F65 F76 H108 V109 F125	L40-I62 HydrophobicContact CD1-CG2 4.42Å; K51-I62 CarbonylContact O-C 3.36Å; K51-I62 VanDerWaalsContact O-CA 3.3Å; K51-I62 WeakPolarHBondContact O-CA 3.33Å; V52-I62 HydrophobicContact CG2-CG1 4.48Å; V52-I62 HydrophobicContact CG2-CG2 4.4Å; I62-F65 HydrophobicContact CB-CB 4.29Å; I62-F65 HydrophobicContact CG2-CB 3.85Å; I62-F65 HydrophobicContact CG2-CD2 3.95Å; I62-F65 HydrophobicContact CG2-CG 4.21Å; I62-F76 HydrophobicContact CD1-CD1 4.09Å; I62-F76 HydrophobicContact CD1-CE1 3.39Å; I62-F76 HydrophobicContact CD1-CZ 3.94Å; I62-H108 WeakPolarHBondContact O-CA 3.39Å; I62-V109 HydrophobicContact CB-CB 4.27Å; I62-V109 HydrophobicContact CD1-CB 4.38Å; I62-V109 HydrophobicContact CD1-CG1 4.47Å; I62-V109 PolarHBondContact N-O 2.73Å; I62-V109 PolarHBondContact O-N 2.76Å; I62-F125 HydrophobicContact CD1-CE1 3.89Å; I62-F125 HydrophobicContact CD1-CZ 3.88Å; I62-F125 HydrophobicContact CG1-CE1 4.29Å
63	L	93.8	Very high	92.4	Very high	16 Å²	16	31.3 Å²	31.3	8%	0.084	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	144.2	175.7	-62.5	-171.4	0	0	0	111.5	Y33 G50 K51 Y53 F65	Y33-L63 HydrophobicContact CD1-CD1 3.8Å; Y33-L63 HydrophobicContact CD1-CD2 4.23Å; Y33-L63 HydrophobicContact CD1-CG 4.49Å; Y33-L63 HydrophobicContact CD2-CD1 3.29Å; Y33-L63 HydrophobicContact CE1-CD1 3.91Å; Y33-L63 HydrophobicContact CE1-CD2 4.3Å; Y33-L63 HydrophobicContact CE2-CD1 3.42Å; Y33-L63 VanDerWaalsContact CE2-CD1 3.42Å; Y33-L63 HydrophobicContact CG-CD1 3.5Å; Y33-L63 VanDerWaalsContact CG-CD1 3.5Å; Y33-L63 HydrophobicContact CG-CG 4.4Å; G50-L63 WeakPolarHBondContact CA-O 3.35Å; K51-L63 HydrophobicContact CB-CB 4.46Å; K51-L63 PolarHBondContact N-O 2.82Å; K51-L63 PolarHBondContact O-N 3.02Å; Y53-L63 HydrophobicContact CD2-CD1 4.32Å; Y53-L63 HydrophobicContact CD2-CG 4.16Å; Y53-L63 HydrophobicContact CE2-CB 4.27Å; Y53-L63 HydrophobicContact CE2-CD1 3.75Å; Y53-L63 HydrophobicContact CE2-CG 3.91Å; L63-F65 PolarHBondContact O-N 2.9Å
64	N	94	Very high	92.3	Very high	68 Å²	68	29.6 Å²	29.6	36%	0.364	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	54.7	33.5	179.6	-51.6	99.9	0	0	0	112.5	F49 T66 D106 K107	F49-N64 HydrophobicContact CD1-CB 4.15Å; F49-N64 WeakPolarHBondContact CD1-O 3.29Å; F49-N64 HydrophobicContact CE1-CB 3.89Å; N64-T66 PolarHBondContact O-N 2.82Å; N64-T66 PolarHBondContact O-OG1 2.9Å; N64-D106 VanDerWaalsContact CA-OD1 3.3Å; N64-D106 WeakPolarHBondContact CA-OD1 3.48Å; N64-D106 VanDerWaalsContact CB-OD1 3.29Å; N64-D106 WeakPolarHBondContact CB-OD1 3.15Å; N64-D106 PolarHBondContact ND2-OD1 2.76Å; N64-K107 PolarHBondContact N-O 2.92Å
65	F	95.5	Very high	92.4	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	123	-178.1	-174.5	-119	0	0	0	110.6	L40 F49 I62 L63 F76 Y104 D106 K107 V109 L127	L40-F65 HydrophobicContact CD1-CD2 4.09Å; L40-F65 HydrophobicContact CD1-CE2 3.84Å; F49-F65 CarbonylContact O-C 3.59Å; F49-F65 VanDerWaalsContact O-CA 3.24Å; F49-F65 WeakPolarHBondContact O-CA 3.48Å; F49-F65 WeakPolarHBondContact O-CD2 3.32Å; I62-F65 HydrophobicContact CB-CB 4.29Å; I62-F65 HydrophobicContact CG2-CB 3.85Å; I62-F65 HydrophobicContact CG2-CD2 3.95Å; I62-F65 HydrophobicContact CG2-CG 4.21Å; L63-F65 PolarHBondContact O-N 2.9Å; F65-F76 HydrophobicContact CD1-CZ 4.2Å; F65-F76 HydrophobicContact CE1-CE1 4.14Å; F65-F76 AromaticContact CE1-CZ 3.69Å; F65-F76 HydrophobicContact CE1-CZ 3.69Å; F65-F76 HydrophobicContact CE2-CE1 4.26Å; F65-F76 AromaticContact CZ-CE1 3.88Å; F65-F76 HydrophobicContact CZ-CE1 3.88Å; F65-F76 AromaticContact CZ-CZ 3.92Å; F65-F76 HydrophobicContact CZ-CZ 3.92Å; F65-Y104 AromaticContact CD1-CD1 3.69Å; F65-Y104 HydrophobicContact CD1-CD1 3.69Å; F65-Y104 AromaticContact CD1-CD2 3.91Å; F65-Y104 HydrophobicContact CD1-CD2 3.91Å; F65-Y104 HydrophobicContact CD1-CE1 4.33Å; F65-Y104 AromaticContact CD1-CG 3.46Å; F65-Y104 HydrophobicContact CD1-CG 3.46Å; F65-Y104 VanDerWaalsContact CD1-CG 3.46Å; F65-Y104 HydrophobicContact CE1-CD1 4.13Å; F65-Y104 AromaticContact CE1-CD2 3.5Å; F65-Y104 HydrophobicContact CE1-CD2 3.5Å; F65-Y104 VanDerWaalsContact CE1-CD2 3.5Å; F65-Y104 HydrophobicContact CE1-CE2 4.01Å; F65-Y104 AromaticContact CE1-CG 3.57Å; F65-Y104 HydrophobicContact CE1-CG 3.57Å; F65-D106 PolarHBondContact O-N 2.8Å; F65-K107 WeakPolarHBondContact CB-O 3.47Å; F65-K107 PolarHBondContact N-O 2.89Å; F65-K107 PolarHBondContact O-N 3Å; F65-V109 HydrophobicContact CB-CG2 3.9Å; F65-V109 HydrophobicContact CD1-CG2 3.66Å; F65-V109 HydrophobicContact CG-CG2 4.09Å; F65-L127 HydrophobicContact CE2-CD1 4.11Å; F65-L127 HydrophobicContact CE2-CD2 4.48Å; F65-L127 HydrophobicContact CZ-CD1 4.25Å; F65-L127 HydrophobicContact CZ-CD2 4.14Å
66	T	95	Very high	92.4	Very high	38 Å²	38	29.8 Å²	29.8	23%	0.233	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	133.2	-178.2	-57.4	0	0	0	0	108.6	G47 I48 F49 N64 Y104 Y105 D106	G47-T66 CarbonylContact O-C 3.59Å; I48-T66 VanDerWaalsContact CA-O 3.32Å; I48-T66 WeakPolarHBondContact CA-O 3.4Å; F49-T66 PolarHBondContact N-O 3.16Å; F49-T66 PolarHBondContact O-N 2.71Å; N64-T66 PolarHBondContact O-N 2.82Å; N64-T66 PolarHBondContact O-OG1 2.9Å; T66-Y104 CarbonylContact C-O 3.55Å; T66-Y104 VanDerWaalsContact CA-O 3.3Å; T66-Y104 WeakPolarHBondContact CA-O 3.34Å; T66-Y105 HydrophobicContact CG2-CD1 4.4Å; T66-D106 PolarHBondContact OG1-N 2.78Å; T66-D106 VanDerWaalsContact OG1-N 3.15Å
67	Y	93.4	Very high	92.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	128.6	178	163.4	-122.9	0	0	0	108.1	I46 I48 G69 Q70 A71 L74 L101 P102 P103 Y104	I46-Y67 HydrophobicContact CD1-CD2 4.37Å; I46-Y67 HydrophobicContact CD1-CE2 3.95Å; I48-Y67 HydrophobicContact CD1-CD2 4.44Å; I48-Y67 HydrophobicContact CG1-CD2 3.97Å; Y67-G69 VanDerWaalsContact C-N 3.33Å; Y67-G69 VanDerWaalsContact CE1-CA 3.45Å; Y67-G69 PolarHBondContact O-N 2.85Å; Y67-G69 WeakPolarHBondContact OH-CA 3.41Å; Y67-Q70 PolarHBondContact OH-N 3.36Å; Y67-A71 HydrophobicContact CE2-CB 4.25Å; Y67-A71 WeakPolarHBondContact OH-CA 3.15Å; Y67-A71 VanDerWaalsContact OH-CB 3.23Å; Y67-A71 WeakPolarHBondContact OH-CB 3.46Å; Y67-A71 PolarHBondContact OH-N 3Å; Y67-A71 PolarHBondContact OH-O 3.49Å; Y67-A71 VanDerWaalsContact OH-O 3.12Å; Y67-L74 HydrophobicContact CD1-CD2 4.08Å; Y67-L74 HydrophobicContact CD2-CD2 3.87Å; Y67-L74 HydrophobicContact CE1-CB 4.47Å; Y67-L74 HydrophobicContact CE1-CD2 3.7Å; Y67-L74 HydrophobicContact CE2-CD2 3.49Å; Y67-L74 VanDerWaalsContact CE2-CD2 3.49Å; Y67-L74 HydrophobicContact CG-CD2 4.16Å; Y67-L101 HydrophobicContact CD1-CB 4.19Å; Y67-L101 HydrophobicContact CE1-CB 4Å; Y67-L101 WeakPolarHBondContact CE1-O 3.36Å; Y67-P102 WeakPolarHBondContact CD1-O 3.41Å; Y67-P103 CarbonylContact O-C 3.56Å; Y67-P103 WeakPolarHBondContact O-CA 3.42Å; Y67-Y104 PolarHBondContact N-O 2.85Å; Y67-Y104 PolarHBondContact O-N 3.29Å
68	N	88.6	Confident	92.8	Very high	43 Å²	43	26.3 Å²	26.3	23%	0.23	15%	0.151	C	C	.	.			trans	-80.6	-6.5	-170.8	71	1.9	0	0	0	115.1	I46 Q70	I46-N68 PolarHBondContact O-ND2 2.76Å; I46-N68 PolarHBondContact O-OD1 2.87Å; N68-Q70 WeakPolarHBondContact ND2-CG 3.34Å; N68-Q70 PolarHBondContact ND2-OE1 3.13Å; N68-Q70 VanDerWaalsContact OD1-CB 3.3Å; N68-Q70 WeakPolarHBondContact OD1-CB 3.34Å; N68-Q70 WeakPolarHBondContact OD1-CG 3.18Å; N68-Q70 PolarHBondContact OD1-N 2.85Å
69	G	87.7	Confident	93	Very high	29 Å²	29	25.2 Å²	25.2	30%	0.299	14%	0.144	S	C	.	.	S	Bend	trans	83.3	8.8	-179.3	0	0	0	0	0	116.2	Y67	Y67-G69 VanDerWaalsContact C-N 3.33Å; Y67-G69 VanDerWaalsContact CE1-CA 3.45Å; Y67-G69 PolarHBondContact O-N 2.85Å; Y67-G69 WeakPolarHBondContact OH-CA 3.41Å
70	Q	88.5	Confident	93	Very high	140 Å²	140	28 Å²	28	65%	0.654	16%	0.164	S	C	*	.			trans	-75.6	-21.6	-175.1	-76.7	-178.6	-16.8	0	0	115	Y67 N68	Y67-Q70 PolarHBondContact OH-N 3.36Å; N68-Q70 WeakPolarHBondContact ND2-CG 3.34Å; N68-Q70 PolarHBondContact ND2-OE1 3.13Å; N68-Q70 VanDerWaalsContact OD1-CB 3.3Å; N68-Q70 WeakPolarHBondContact OD1-CB 3.34Å; N68-Q70 WeakPolarHBondContact OD1-CG 3.18Å; N68-Q70 PolarHBondContact OD1-N 2.85Å
71	A	88.1	Confident	93	Very high	9 Å²	9	32 Å²	32	7%	0.074	18%	0.182	C	C	.	.	S	Bend	trans	-76.9	135.7	179.1	0	0	0	0	0	110.4	Y67 D73 L74 F136	Y67-A71 HydrophobicContact CE2-CB 4.25Å; Y67-A71 WeakPolarHBondContact OH-CA 3.15Å; Y67-A71 VanDerWaalsContact OH-CB 3.23Å; Y67-A71 WeakPolarHBondContact OH-CB 3.46Å; Y67-A71 PolarHBondContact OH-N 3Å; Y67-A71 PolarHBondContact OH-O 3.49Å; Y67-A71 VanDerWaalsContact OH-O 3.12Å; A71-D73 PolarHBondContact O-N 2.89Å; A71-L74 HydrophobicContact CB-CB 3.95Å; A71-L74 HydrophobicContact CB-CD1 4.22Å; A71-L74 HydrophobicContact CB-CD2 4.31Å; A71-L74 HydrophobicContact CB-CG 4.4Å; A71-F136 HydrophobicContact CB-CD1 4.13Å; A71-F136 HydrophobicContact CB-CE1 3.41Å; A71-F136 VanDerWaalsContact CB-CE1 3.41Å; A71-F136 HydrophobicContact CB-CZ 3.71Å
72	P	86.2	Confident	92.9	Very high	86 Å²	86	35.9 Å²	35.9	56%	0.558	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-30.8	-168.6	25.4	-34.4	0	0	0	113.8	C132	P72-C132 VanDerWaalsContact CG-SG 3.57Å
73	D	92.4	Very high	92.7	Very high	58 Å²	58	40.2 Å²	40.2	31%	0.31	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-151.5	56.1	-171.9	-133.1	4.7	0	0	0	111.2	A71 F75 S100 C129 Q130 S131	A71-D73 PolarHBondContact O-N 2.89Å; D73-F75 HydrophobicContact CB-CE2 4.18Å; D73-F75 WeakPolarHBondContact O-CD2 3.46Å; D73-F75 WeakPolarHBondContact O-CE2 3.44Å; D73-F75 WeakPolarHBondContact OD1-CZ 3.42Å; D73-S100 WeakPolarHBondContact CA-OG 3.28Å; D73-C129 CarbonylContact O-C 3.53Å; D73-C129 VanDerWaalsContact O-CA 3.28Å; D73-C129 WeakPolarHBondContact O-CA 3.22Å; D73-Q130 PolarHBondContact O-N 3.48Å; D73-S131 WeakPolarHBondContact CB-OG 3.07Å
74	L	94.7	Very high	92.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	138.9	-176.7	-161.3	69.7	0	0	0	112.5	Y67 A71 S100 L101 L127 C129 F136	Y67-L74 HydrophobicContact CD1-CD2 4.08Å; Y67-L74 HydrophobicContact CD2-CD2 3.87Å; Y67-L74 HydrophobicContact CE1-CB 4.47Å; Y67-L74 HydrophobicContact CE1-CD2 3.7Å; Y67-L74 HydrophobicContact CE2-CD2 3.49Å; Y67-L74 VanDerWaalsContact CE2-CD2 3.49Å; Y67-L74 HydrophobicContact CG-CD2 4.16Å; A71-L74 HydrophobicContact CB-CB 3.95Å; A71-L74 HydrophobicContact CB-CD1 4.22Å; A71-L74 HydrophobicContact CB-CD2 4.31Å; A71-L74 HydrophobicContact CB-CG 4.4Å; L74-S100 PolarHBondContact N-OG 3.06Å; L74-S100 CarbonylContact O-C 3.56Å; L74-S100 WeakPolarHBondContact O-CA 3.3Å; L74-S100 PolarHBondContact O-OG 2.75Å; L74-S100 VanDerWaalsContact O-OG 3.06Å; L74-L101 HydrophobicContact CD2-CD1 4.41Å; L74-L101 HydrophobicContact CG-CD1 4.38Å; L74-L101 WeakPolarHBondContact O-CG 3.44Å; L74-L101 PolarHBondContact O-N 2.85Å; L74-L127 HydrophobicContact CD1-CB 4.06Å; L74-L127 HydrophobicContact CD2-CB 4.41Å; L74-L127 HydrophobicContact CD2-CD1 4.32Å; L74-L127 HydrophobicContact CG-CB 4.31Å; L74-C129 HydrophobicContact CD1-CB 4.12Å; L74-F136 HydrophobicContact CD1-CB 3.64Å; L74-F136 HydrophobicContact CD1-CD1 3.74Å; L74-F136 HydrophobicContact CD1-CD2 3.86Å; L74-F136 HydrophobicContact CD1-CE1 4.37Å; L74-F136 HydrophobicContact CD1-CE2 4.49Å; L74-F136 HydrophobicContact CD1-CG 3.44Å; L74-F136 VanDerWaalsContact CD1-CG 3.44Å
75	F	95.3	Very high	92.8	Very high	9 Å²	9	37.7 Å²	37.7	4%	0.039	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	156.2	180	-58.2	-84.3	0	0	0	111.8	D73 W77 K90 D98 K99 S100 L127 W128 Q130	D73-F75 HydrophobicContact CB-CE2 4.18Å; D73-F75 WeakPolarHBondContact O-CD2 3.46Å; D73-F75 WeakPolarHBondContact O-CE2 3.44Å; D73-F75 WeakPolarHBondContact OD1-CZ 3.42Å; F75-W77 HydrophobicContact CB-CE3 4.27Å; F75-K90 HydrophobicContact CB-CD 4.3Å; F75-K90 HydrophobicContact CB-CG 4.01Å; F75-K90 HydrophobicContact CD1-CD 3.47Å; F75-K90 VanDerWaalsContact CD1-CD 3.47Å; F75-K90 HydrophobicContact CD1-CG 4Å; F75-K90 HydrophobicContact CD2-CD 4.31Å; F75-K90 HydrophobicContact CE1-CD 3.73Å; F75-K90 HydrophobicContact CG-CD 3.76Å; F75-K90 HydrophobicContact CG-CG 4.04Å; F75-K90 HydrophobicContact CZ-CD 4.31Å; F75-D98 WeakPolarHBondContact CE1-O 3.4Å; F75-K99 WeakPolarHBondContact CE1-O 3.27Å; F75-S100 VanDerWaalsContact CE1-CA 3.48Å; F75-S100 VanDerWaalsContact CE1-N 3.29Å; F75-L127 WeakPolarHBondContact O-CA 3.15Å; F75-W128 PolarHBondContact N-O 2.96Å; F75-W128 PolarHBondContact O-N 2.88Å; F75-Q130 HydrophobicContact CD2-CB 4.03Å; F75-Q130 HydrophobicContact CE2-CB 3.83Å
76	F	95.8	Very high	92.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	135.9	161.1	-65.6	-63.3	0	0	0	109.5	I62 F65 I91 L101 V109 I111 F125 G126 L127	I62-F76 HydrophobicContact CD1-CD1 4.09Å; I62-F76 HydrophobicContact CD1-CE1 3.39Å; I62-F76 HydrophobicContact CD1-CZ 3.94Å; F65-F76 HydrophobicContact CD1-CZ 4.2Å; F65-F76 HydrophobicContact CE1-CE1 4.14Å; F65-F76 AromaticContact CE1-CZ 3.69Å; F65-F76 HydrophobicContact CE1-CZ 3.69Å; F65-F76 HydrophobicContact CE2-CE1 4.26Å; F65-F76 AromaticContact CZ-CE1 3.88Å; F65-F76 HydrophobicContact CZ-CE1 3.88Å; F65-F76 AromaticContact CZ-CZ 3.92Å; F65-F76 HydrophobicContact CZ-CZ 3.92Å; F76-I91 HydrophobicContact CB-CB 4.19Å; F76-I91 HydrophobicContact CB-CD1 4.45Å; F76-I91 PolarHBondContact O-N 2.92Å; F76-L101 HydrophobicContact CD1-CD1 4.38Å; F76-L101 HydrophobicContact CD2-CD1 4.21Å; F76-L101 HydrophobicContact CD2-CD2 3.67Å; F76-L101 HydrophobicContact CE1-CD1 4.23Å; F76-L101 HydrophobicContact CE2-CD1 4.06Å; F76-L101 HydrophobicContact CE2-CD2 3.46Å; F76-L101 VanDerWaalsContact CE2-CD2 3.46Å; F76-L101 HydrophobicContact CE2-CG 4.43Å; F76-L101 HydrophobicContact CG-CD1 4.36Å; F76-L101 HydrophobicContact CZ-CD1 4.06Å; F76-L101 HydrophobicContact CZ-CD2 4.19Å; F76-V109 HydrophobicContact CE2-CG1 3.91Å; F76-V109 HydrophobicContact CZ-CG1 3.84Å; F76-I111 HydrophobicContact CD2-CD1 3.58Å; F76-I111 HydrophobicContact CE2-CD1 3.86Å; F76-I111 HydrophobicContact CG-CD1 4Å; F76-I111 HydrophobicContact CZ-CD1 4.49Å; F76-F125 HydrophobicContact CB-CE2 4.23Å; F76-F125 HydrophobicContact CB-CZ 4.48Å; F76-F125 HydrophobicContact CD1-CE2 4.35Å; F76-F125 AromaticContact CD1-CZ 3.78Å; F76-F125 HydrophobicContact CD1-CZ 3.78Å; F76-F125 HydrophobicContact CE1-CZ 4.46Å; F76-F125 HydrophobicContact CG-CZ 4.4Å; F76-G126 WeakPolarHBondContact CA-O 3.14Å; F76-L127 HydrophobicContact CD1-CD2 3.62Å; F76-L127 HydrophobicContact CE1-CD2 3.71Å
77	W	96.2	Very high	92.8	Very high	12 Å²	12	48.7 Å²	48.7	5%	0.045	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	136	-167.6	-152.4	-105.3	0	0	0	111.3	F75 S85 G88 K90 F125 G126 W128	F75-W77 HydrophobicContact CB-CE3 4.27Å; W77-S85 PolarHBondContact NE1-O 3.24Å; W77-S85 VanDerWaalsContact NE1-O 3.08Å; W77-G88 VanDerWaalsContact CZ2-C 3.49Å; W77-G88 WeakPolarHBondContact CZ2-O 3.38Å; W77-G88 VanDerWaalsContact NE1-CA 3.3Å; W77-K90 HydrophobicContact CE3-CB 3.95Å; W77-K90 HydrophobicContact CE3-CG 4.31Å; W77-K90 HydrophobicContact CH2-CB 4.19Å; W77-K90 HydrophobicContact CZ3-CB 3.45Å; W77-K90 VanDerWaalsContact CZ3-CB 3.45Å; W77-K90 HydrophobicContact CZ3-CD 4.48Å; W77-K90 HydrophobicContact CZ3-CG 3.95Å; W77-F125 CarbonylContact O-C 3.52Å; W77-F125 WeakPolarHBondContact O-CA 3.25Å; W77-G126 PolarHBondContact N-O 3.18Å; W77-G126 PolarHBondContact O-N 2.97Å; W77-W128 HydrophobicContact CB-CB 3.55Å; W77-W128 HydrophobicContact CD2-CB 3.57Å; W77-W128 AromaticContact CD2-CD1 3.86Å; W77-W128 AromaticContact CD2-CG 3.81Å; W77-W128 HydrophobicContact CD2-CG 3.81Å; W77-W128 AromaticContact CE2-CD1 3.81Å; W77-W128 AromaticContact CE2-CG 3.92Å; W77-W128 HydrophobicContact CE3-CB 3.95Å; W77-W128 AromaticContact CE3-CD1 3.94Å; W77-W128 HydrophobicContact CE3-CG 4.22Å; W77-W128 HydrophobicContact CG-CB 3.38Å; W77-W128 AromaticContact CG-CG 3.98Å; W77-W128 HydrophobicContact CG-CG 3.98Å; W77-W128 AromaticContact CZ2-CD1 3.94Å; W77-W128 HydrophobicContact CZ2-CG 4.47Å
78	L	95.9	Very high	92.8	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	137.1	168.5	-79.6	166.9	0	0	0	109.5	G88 V89 I91 L113 F122 T124 F125 L141	L78-G88 CarbonylContact O-C 3.46Å; L78-G88 WeakPolarHBondContact O-CA 3.43Å; L78-V89 PolarHBondContact N-O 3.13Å; L78-V89 PolarHBondContact O-N 2.79Å; L78-I91 HydrophobicContact CB-CD1 4.28Å; L78-I91 HydrophobicContact CD1-CD1 3.48Å; L78-I91 VanDerWaalsContact CD1-CD1 3.48Å; L78-I91 HydrophobicContact CD1-CG1 4Å; L78-I91 HydrophobicContact CD2-CD1 4.49Å; L78-I91 HydrophobicContact CG-CD1 3.43Å; L78-I91 VanDerWaalsContact CG-CD1 3.43Å; L78-I91 HydrophobicContact CG-CG1 4.16Å; L78-L113 HydrophobicContact CD1-CD1 3.61Å; L78-L113 HydrophobicContact CD1-CD2 3.81Å; L78-L113 HydrophobicContact CD1-CG 4.32Å; L78-F122 HydrophobicContact CB-CB 4.28Å; L78-F122 HydrophobicContact CB-CD1 3.65Å; L78-F122 HydrophobicContact CB-CD2 4.07Å; L78-F122 HydrophobicContact CB-CE1 3.89Å; L78-F122 HydrophobicContact CB-CE2 4.3Å; L78-F122 HydrophobicContact CB-CG 3.73Å; L78-F122 HydrophobicContact CB-CZ 4.21Å; L78-F122 HydrophobicContact CD1-CD2 3.79Å; L78-F122 HydrophobicContact CD1-CE2 3.79Å; L78-F122 HydrophobicContact CD1-CG 4.3Å; L78-F122 HydrophobicContact CD1-CZ 4.3Å; L78-F122 HydrophobicContact CD2-CB 3.95Å; L78-F122 HydrophobicContact CD2-CD2 4.11Å; L78-F122 HydrophobicContact CD2-CG 4.05Å; L78-F122 HydrophobicContact CG-CD2 4.21Å; L78-F122 HydrophobicContact CG-CG 4.23Å; L78-T124 WeakPolarHBondContact CA-O 3.4Å; L78-T124 WeakPolarHBondContact CD2-O 3.46Å; L78-F125 HydrophobicContact CD2-CB 3.86Å; L78-F125 HydrophobicContact CD2-CD2 3.92Å; L78-F125 HydrophobicContact CD2-CG 4.39Å; L78-F125 HydrophobicContact CG-CD2 4.22Å; L78-L141 HydrophobicContact CD2-CD1 3.54Å
79	D	95.6	Very high	93	Very high	8 Å²	8	50.5 Å²	50.5	4%	0.043	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	143.3	174.6	-154.7	-35.8	0	0	0	111.3	E81 P84 S85 G88 S123 T124	D79-E81 VanDerWaalsContact C-N 3.26Å; D79-E81 PolarHBondContact OD1-N 2.9Å; D79-P84 HydrophobicContact CB-CB 3.95Å; D79-S85 WeakPolarHBondContact OD2-CA 3.44Å; D79-S85 WeakPolarHBondContact OD2-CB 3.46Å; D79-S85 PolarHBondContact OD2-N 3.01Å; D79-S85 PolarHBondContact OD2-OG 3.18Å; D79-G88 PolarHBondContact OD2-N 3.33Å; D79-S123 PolarHBondContact O-N 2.85Å; D79-T124 PolarHBondContact N-O 3.18Å; D79-T124 PolarHBondContact O-N 2.86Å; D79-T124 PolarHBondContact O-OG1 2.86Å
80	S	93.9	Very high	93.2	Very high	69 Å²	69	52.8 Å²	52.8	48%	0.483	28%	0.283	S	S	.	.	S	Bend	trans	-78.7	-13.8	174.2	-57.6	0	0	0	0	111.9	D121 S123	S80-D121 PolarHBondContact OG-O 3.15Å; S80-S123 VanDerWaalsContact O-CB 3.26Å; S80-S123 WeakPolarHBondContact O-CB 3.14Å; S80-S123 PolarHBondContact O-OG 3.46Å
81	E	92.8	Very high	93.3	Very high	85 Å²	85	46.7 Å²	46.7	40%	0.397	26%	0.255	S	S	.	.	S	Bend	trans	-98.8	158.9	174.5	-62.9	-174.4	167.4	0	0	112.4	D79 R87 T124	D79-E81 VanDerWaalsContact C-N 3.26Å; D79-E81 PolarHBondContact OD1-N 2.9Å; E81-R87 IonicContact OE1-CZ 3.59Å; E81-R87 IonicContact OE1-NH1 3.92Å; E81-R87 IonicContact OE1-NH2 2.64Å; E81-R87 PolarHBondContact OE1-NH2 3.28Å; E81-R87 IonicContact OE2-CZ 3.85Å; E81-R87 IonicContact OE2-NH2 2.77Å; E81-R87 PolarHBondContact OE2-NH2 2.81Å; E81-T124 WeakPolarHBondContact O-CG2 3.29Å; E81-T124 PolarHBondContact O-OG1 3.24Å
82	E	91.9	Very high	93	Very high	82 Å²	82	48.2 Å²	48.2	38%	0.383	27%	0.267	S	S	.	.	S	Bend	trans	-133.3	121.4	168.7	-171.1	-176.5	161.2	0	0	109.6	T124 H138 R140	E82-T124 HydrophobicContact CB-CG2 3.73Å; E82-T124 HydrophobicContact CG-CG2 3.71Å; E82-H138 IonicContact OE1-NE2 2.81Å; E82-R140 IonicContact OE1-CZ 3.9Å; E82-R140 IonicContact OE1-NE 3.78Å; E82-R140 PolarHBondContact OE1-NE 3.01Å; E82-R140 IonicContact OE1-NH2 3.71Å; E82-R140 PolarHBondContact OE1-NH2 2.8Å; E82-R140 WeakPolarHBondContact OE2-CD 3.17Å; E82-R140 VanDerWaalsContact OE2-CG 3.31Å; E82-R140 WeakPolarHBondContact OE2-CG 3.35Å; E82-R140 IonicContact OE2-CZ 2.7Å; E82-R140 IonicContact OE2-NE 3.1Å; E82-R140 PolarHBondContact OE2-NE 2.83Å; E82-R140 IonicContact OE2-NH2 3.48Å
83	P	92.1	Very high	92.8	Very high	91 Å²	91	44.4 Å²	44.4	59%	0.591	24%	0.242	S	C	*	.	S	Bend	cis	-68.7	162.8	0.5	31.7	-36.5	0	0	0	112.9
84	P	94.7	Very high	92	Very high	16 Å²	16	45.8 Å²	45.8	10%	0.104	25%	0.246	C	C	.	.			trans	-62.9	154.2	177.4	27	-34.8	0	0	0	111.8	D79 W128 D135 H138	D79-P84 HydrophobicContact CB-CB 3.95Å; P84-W128 HydrophobicContact CB-CE3 4.47Å; P84-W128 WeakPolarHBondContact O-CZ3 3.27Å; P84-D135 HydrophobicContact CG-CB 4.02Å; P84-H138 VanDerWaalsContact CD-CE1 3.42Å; P84-H138 WeakPolarHBondContact CD-CE1 3.46Å; P84-H138 WeakPolarHBondContact CD-ND1 3.03Å; P84-H138 HydrophobicContact CG-CB 4.21Å
85	S	95.4	Very high	91.2	Very high	15 Å²	15	50.3 Å²	50.3	11%	0.105	27%	0.267	C	S	.	.			trans	-130.9	168.7	-170.2	81	0	0	0	0	111.5	W77 D79 R87 G88	W77-S85 PolarHBondContact NE1-O 3.24Å; W77-S85 VanDerWaalsContact NE1-O 3.08Å; D79-S85 WeakPolarHBondContact OD2-CA 3.44Å; D79-S85 WeakPolarHBondContact OD2-CB 3.46Å; D79-S85 PolarHBondContact OD2-N 3.01Å; D79-S85 PolarHBondContact OD2-OG 3.18Å; S85-R87 PolarHBondContact O-N 3.48Å; S85-R87 PolarHBondContact OG-N 3.37Å; S85-R87 VanDerWaalsContact OG-N 3.16Å; S85-G88 PolarHBondContact O-N 3.36Å
86	P	95	Very high	90.4	Very high	88 Å²	88	50.5 Å²	50.5	57%	0.571	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-10.6	172.6	-15.6	25.4	0	0	0	114.6	W128	P86-W128 HydrophobicContact CB-CZ2 3.96Å; P86-W128 HydrophobicContact CG-CH2 4.01Å; P86-W128 HydrophobicContact CG-CZ2 3.64Å
87	R	93.9	Very high	89.7	Confident	181 Å²	181	51.9 Å²	51.9	68%	0.683	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-5.1	-178.7	-65.2	-176.8	-68.3	158.1	-3.5	113.8	E81 S85	E81-R87 IonicContact OE1-CZ 3.59Å; E81-R87 IonicContact OE1-NH1 3.92Å; E81-R87 IonicContact OE1-NH2 2.64Å; E81-R87 PolarHBondContact OE1-NH2 3.28Å; E81-R87 IonicContact OE2-CZ 3.85Å; E81-R87 IonicContact OE2-NH2 2.77Å; E81-R87 PolarHBondContact OE2-NH2 2.81Å; S85-R87 PolarHBondContact O-N 3.48Å; S85-R87 PolarHBondContact OG-N 3.37Å; S85-R87 VanDerWaalsContact OG-N 3.16Å
88	G	93.5	Very high	89	Confident	15 Å²	15	56.7 Å²	56.7	16%	0.155	31%	0.31	C	S	.	.	S	Bend	trans	-65.9	-179.2	175.9	0	0	0	0	0	113.3	W77 L78 D79 S85	W77-G88 VanDerWaalsContact CZ2-C 3.49Å; W77-G88 WeakPolarHBondContact CZ2-O 3.38Å; W77-G88 VanDerWaalsContact NE1-CA 3.3Å; L78-G88 CarbonylContact O-C 3.46Å; L78-G88 WeakPolarHBondContact O-CA 3.43Å; D79-G88 PolarHBondContact OD2-N 3.33Å; S85-G88 PolarHBondContact O-N 3.36Å
89	V	92.8	Very high	88.6	Confident	67 Å²	67	64.5 Å²	64.5	41%	0.406	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.3	-173.9	-177.8	0	0	0	0	109.5	L78 F122	L78-V89 PolarHBondContact N-O 3.13Å; L78-V89 PolarHBondContact O-N 2.79Å; V89-F122 HydrophobicContact CB-CE1 4.36Å; V89-F122 HydrophobicContact CG2-CE1 3.88Å; V89-F122 HydrophobicContact CG2-CZ 4.19Å
90	K	92.5	Very high	88.4	Confident	77 Å²	77	65.7 Å²	65.7	34%	0.335	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	130.8	170	-170.8	172.1	62.9	168.2	0	110.2	F75 W77 D98	F75-K90 HydrophobicContact CB-CD 4.3Å; F75-K90 HydrophobicContact CB-CG 4.01Å; F75-K90 HydrophobicContact CD1-CD 3.47Å; F75-K90 VanDerWaalsContact CD1-CD 3.47Å; F75-K90 HydrophobicContact CD1-CG 4Å; F75-K90 HydrophobicContact CD2-CD 4.31Å; F75-K90 HydrophobicContact CE1-CD 3.73Å; F75-K90 HydrophobicContact CG-CD 3.76Å; F75-K90 HydrophobicContact CG-CG 4.04Å; F75-K90 HydrophobicContact CZ-CD 4.31Å; W77-K90 HydrophobicContact CE3-CB 3.95Å; W77-K90 HydrophobicContact CE3-CG 4.31Å; W77-K90 HydrophobicContact CH2-CB 4.19Å; W77-K90 HydrophobicContact CZ3-CB 3.45Å; W77-K90 VanDerWaalsContact CZ3-CB 3.45Å; W77-K90 HydrophobicContact CZ3-CD 4.48Å; W77-K90 HydrophobicContact CZ3-CG 3.95Å; K90-D98 PolarHBondContact NZ-O 3.37Å
91	I	89.8	Confident	88.3	Confident	12 Å²	12	62.8 Å²	62.8	6%	0.062	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	127.3	175	-46.1	162.9	0	0	0	110.4	F76 L78 I111 L113 F125	F76-I91 HydrophobicContact CB-CB 4.19Å; F76-I91 HydrophobicContact CB-CD1 4.45Å; F76-I91 PolarHBondContact O-N 2.92Å; L78-I91 HydrophobicContact CB-CD1 4.28Å; L78-I91 HydrophobicContact CD1-CD1 3.48Å; L78-I91 VanDerWaalsContact CD1-CD1 3.48Å; L78-I91 HydrophobicContact CD1-CG1 4Å; L78-I91 HydrophobicContact CD2-CD1 4.49Å; L78-I91 HydrophobicContact CG-CD1 3.43Å; L78-I91 VanDerWaalsContact CG-CD1 3.43Å; L78-I91 HydrophobicContact CG-CG1 4.16Å; I91-I111 HydrophobicContact CB-CG2 4.45Å; I91-I111 HydrophobicContact CD1-CG2 4.02Å; I91-I111 HydrophobicContact CG2-CG2 3.52Å; I91-L113 HydrophobicContact CD1-CD2 4.26Å; I91-L113 HydrophobicContact CG1-CD2 4.26Å; I91-L113 HydrophobicContact CG2-CD2 3.97Å; I91-F125 HydrophobicContact CD1-CD2 4Å; I91-F125 HydrophobicContact CD1-CE2 3.79Å
92	A	83.5	Confident	88.1	Confident	40 Å²	40	61.4 Å²	61.4	33%	0.331	33%	0.331	S	S	.	.			trans	-75.3	129.6	170	0	0	0	0	0	110.6	G97	A92-G97 WeakPolarHBondContact CA-O 3.36Å; A92-G97 WeakPolarHBondContact CB-O 3.42Å
93	S	80.6	Confident	88	Confident	6 Å²	6	60.7 Å²	60.7	4%	0.042	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-87.3	163.7	165.1	72.5	0	0	0	0	110.4	E95 S96 G97 Y104	S93-E95 VanDerWaalsContact C-N 3.25Å; S93-E95 PolarHBondContact O-N 2.81Å; S93-S96 WeakPolarHBondContact OG-CB 3.4Å; S93-S96 PolarHBondContact OG-N 2.96Å; S93-S96 PolarHBondContact OG-OG 3.35Å; S93-G97 WeakPolarHBondContact O-CA 3.36Å; S93-G97 PolarHBondContact O-N 3.3Å; S93-Y104 PolarHBondContact OG-OH 2.74Å
94	F	76.7	Confident	87.9	Confident	88 Å²	88	56.8 Å²	56.8	39%	0.386	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-36.6	175.2	-179.9	-96	0	0	0	112	A284 K285 H286	F94-A284 HydrophobicContact CB-CB 4.08Å; F94-A284 HydrophobicContact CD1-CB 3.65Å; F94-A284 HydrophobicContact CD2-CB 3.52Å; F94-A284 HydrophobicContact CE1-CB 3.9Å; F94-A284 HydrophobicContact CE2-CB 3.77Å; F94-A284 HydrophobicContact CG-CB 3.45Å; F94-A284 VanDerWaalsContact CG-CB 3.45Å; F94-A284 HydrophobicContact CZ-CB 3.95Å; F94-K285 WeakPolarHBondContact CE1-O 3.27Å; F94-H286 AromaticContact CE2-CD2 3.87Å; F94-H286 AromaticContact CE2-NE2 3.75Å; F94-H286 HydrophobicContact CZ-CB 4.38Å; F94-H286 AromaticContact CZ-CD2 3.71Å; F94-H286 AromaticContact CZ-CG 3.8Å; F94-H286 AromaticContact CZ-NE2 3.93Å
95	E	77.8	Confident	87.7	Confident	95 Å²	95	62.9 Å²	62.9	44%	0.444	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-38.7	-175.3	-63.3	82.2	175.6	0	0	113.3	S93 Y104	S93-E95 VanDerWaalsContact C-N 3.25Å; S93-E95 PolarHBondContact O-N 2.81Å; E95-Y104 HydrophobicContact CB-CE1 4.32Å; E95-Y104 WeakPolarHBondContact CB-OH 3.5Å; E95-Y104 HydrophobicContact CG-CE1 4.34Å
96	S	77.8	Confident	87.5	Confident	13 Å²	13	67.2 Å²	67.2	9%	0.091	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-22.1	-176.6	70.1	0	0	0	0	114.1	S93 D98 K99	S93-S96 WeakPolarHBondContact OG-CB 3.4Å; S93-S96 PolarHBondContact OG-N 2.96Å; S93-S96 PolarHBondContact OG-OG 3.35Å; S96-D98 PolarHBondContact O-N 2.85Å; S96-K99 WeakPolarHBondContact O-CB 3.31Å; S96-K99 PolarHBondContact O-N 2.8Å
97	G	81.9	Confident	87.3	Confident	29 Å²	29	68.4 Å²	68.4	30%	0.299	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	53.6	-138.2	-164.3	0	0	0	0	0	110.9	A92 S93 K99	A92-G97 WeakPolarHBondContact CA-O 3.36Å; A92-G97 WeakPolarHBondContact CB-O 3.42Å; S93-G97 WeakPolarHBondContact O-CA 3.36Å; S93-G97 PolarHBondContact O-N 3.3Å; G97-K99 VanDerWaalsContact C-N 3.26Å; G97-K99 PolarHBondContact O-N 2.75Å
98	D	80.5	Confident	87.1	Confident	113 Å²	113	63.3 Å²	63.3	60%	0.604	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-0.5	178.6	-67.7	-41.1	0	0	0	115	F75 K90 S96	F75-D98 WeakPolarHBondContact CE1-O 3.4Å; K90-D98 PolarHBondContact NZ-O 3.37Å; S96-D98 PolarHBondContact O-N 2.85Å
99	K	88.4	Confident	87	Confident	164 Å²	164	62.6 Å²	62.6	71%	0.713	32%	0.323	S	S	*	.	S	Bend	trans	-83.4	159.8	-179.8	-59.2	-179.6	179.8	177.7	0	111	F75 S96 G97	F75-K99 WeakPolarHBondContact CE1-O 3.27Å; S96-K99 WeakPolarHBondContact O-CB 3.31Å; S96-K99 PolarHBondContact O-N 2.8Å; G97-K99 VanDerWaalsContact C-N 3.26Å; G97-K99 PolarHBondContact O-N 2.75Å
100	S	90.8	Very high	87	Confident	34 Å²	34	60.9 Å²	60.9	24%	0.238	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-56.7	145.5	174.4	-175.3	0	0	0	0	110.8	D73 L74 F75 P102	D73-S100 WeakPolarHBondContact CA-OG 3.28Å; L74-S100 PolarHBondContact N-OG 3.06Å; L74-S100 CarbonylContact O-C 3.56Å; L74-S100 WeakPolarHBondContact O-CA 3.3Å; L74-S100 PolarHBondContact O-OG 2.75Å; L74-S100 VanDerWaalsContact O-OG 3.06Å; F75-S100 VanDerWaalsContact CE1-CA 3.48Å; F75-S100 VanDerWaalsContact CE1-N 3.29Å; S100-P102 WeakPolarHBondContact O-CD 3.45Å
101	L	92.1	Very high	86.9	Confident	7 Å²	7	57.3 Å²	57.3	4%	0.037	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-59.9	123.6	-177.7	-66	179.6	0	0	0	110.2	Y67 L74 F76 Y104 L127	Y67-L101 HydrophobicContact CD1-CB 4.19Å; Y67-L101 HydrophobicContact CE1-CB 4Å; Y67-L101 WeakPolarHBondContact CE1-O 3.36Å; L74-L101 HydrophobicContact CD2-CD1 4.41Å; L74-L101 HydrophobicContact CG-CD1 4.38Å; L74-L101 WeakPolarHBondContact O-CG 3.44Å; L74-L101 PolarHBondContact O-N 2.85Å; F76-L101 HydrophobicContact CD1-CD1 4.38Å; F76-L101 HydrophobicContact CD2-CD1 4.21Å; F76-L101 HydrophobicContact CD2-CD2 3.67Å; F76-L101 HydrophobicContact CE1-CD1 4.23Å; F76-L101 HydrophobicContact CE2-CD1 4.06Å; F76-L101 HydrophobicContact CE2-CD2 3.46Å; F76-L101 VanDerWaalsContact CE2-CD2 3.46Å; F76-L101 HydrophobicContact CE2-CG 4.43Å; F76-L101 HydrophobicContact CG-CD1 4.36Å; F76-L101 HydrophobicContact CZ-CD1 4.06Å; F76-L101 HydrophobicContact CZ-CD2 4.19Å; L101-Y104 HydrophobicContact CB-CE2 4.18Å; L101-Y104 HydrophobicContact CD2-CE2 4.12Å; L101-L127 HydrophobicContact CD1-CD2 3.62Å
102	P	88.8	Confident	86.8	Confident	56 Å²	56	61 Å²	61	36%	0.364	32%	0.32	S	S	.	.			trans	-69.4	174.4	167.2	32.4	-36.1	0	0	0	110.1	Y67 S100 Y104	Y67-P102 WeakPolarHBondContact CD1-O 3.41Å; S100-P102 WeakPolarHBondContact O-CD 3.45Å; P102-Y104 HydrophobicContact CG-CE2 4Å; P102-Y104 WeakPolarHBondContact O-CD2 3.31Å; P102-Y104 VanDerWaalsContact O-CE2 3.27Å; P102-Y104 WeakPolarHBondContact O-CE2 3.31Å; P102-Y104 PolarHBondContact O-N 2.94Å
103	P	88.7	Confident	87.1	Confident	68 Å²	68	59.8 Å²	59.8	44%	0.442	31%	0.309	S	S	.	.			trans	-57.9	136.9	169.1	-19.9	28.3	0	0	0	112.4	Y67 Y105	Y67-P103 CarbonylContact O-C 3.56Å; Y67-P103 WeakPolarHBondContact O-CA 3.42Å; P103-Y105 HydrophobicContact CB-CE2 3.7Å
104	Y	90.7	Very high	87.1	Confident	8 Å²	8	63 Å²	63	3%	0.031	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	139.8	170.2	-70.1	-104.4	0	0	0	109.2	F65 T66 Y67 S93 E95 L101 P102 K107 V109	F65-Y104 AromaticContact CD1-CD1 3.69Å; F65-Y104 HydrophobicContact CD1-CD1 3.69Å; F65-Y104 AromaticContact CD1-CD2 3.91Å; F65-Y104 HydrophobicContact CD1-CD2 3.91Å; F65-Y104 HydrophobicContact CD1-CE1 4.33Å; F65-Y104 AromaticContact CD1-CG 3.46Å; F65-Y104 HydrophobicContact CD1-CG 3.46Å; F65-Y104 VanDerWaalsContact CD1-CG 3.46Å; F65-Y104 HydrophobicContact CE1-CD1 4.13Å; F65-Y104 AromaticContact CE1-CD2 3.5Å; F65-Y104 HydrophobicContact CE1-CD2 3.5Å; F65-Y104 VanDerWaalsContact CE1-CD2 3.5Å; F65-Y104 HydrophobicContact CE1-CE2 4.01Å; F65-Y104 AromaticContact CE1-CG 3.57Å; F65-Y104 HydrophobicContact CE1-CG 3.57Å; T66-Y104 CarbonylContact C-O 3.55Å; T66-Y104 VanDerWaalsContact CA-O 3.3Å; T66-Y104 WeakPolarHBondContact CA-O 3.34Å; Y67-Y104 PolarHBondContact N-O 2.85Å; Y67-Y104 PolarHBondContact O-N 3.29Å; S93-Y104 PolarHBondContact OG-OH 2.74Å; E95-Y104 HydrophobicContact CB-CE1 4.32Å; E95-Y104 WeakPolarHBondContact CB-OH 3.5Å; E95-Y104 HydrophobicContact CG-CE1 4.34Å; L101-Y104 HydrophobicContact CB-CE2 4.18Å; L101-Y104 HydrophobicContact CD2-CE2 4.12Å; P102-Y104 HydrophobicContact CG-CE2 4Å; P102-Y104 WeakPolarHBondContact O-CD2 3.31Å; P102-Y104 VanDerWaalsContact O-CE2 3.27Å; P102-Y104 WeakPolarHBondContact O-CE2 3.31Å; P102-Y104 PolarHBondContact O-N 2.94Å; Y104-K107 HydrophobicContact CD1-CB 3.83Å; Y104-K107 HydrophobicContact CD1-CG 3.85Å; Y104-V109 HydrophobicContact CD1-CG2 3.84Å; Y104-V109 HydrophobicContact CE1-CG2 3.7Å
105	Y	90.8	Very high	86.9	Confident	145 Å²	145	64.7 Å²	64.7	57%	0.569	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.1	110	175.5	-60.1	-78	0	0	0	108.6	T66 P103 K107	T66-Y105 HydrophobicContact CG2-CD1 4.4Å; P103-Y105 HydrophobicContact CB-CE2 3.7Å; Y105-K107 VanDerWaalsContact C-N 3.33Å; Y105-K107 WeakPolarHBondContact O-CG 3.42Å; Y105-K107 PolarHBondContact O-N 3.46Å
106	D	90.3	Very high	87	Confident	106 Å²	106	66.4 Å²	66.4	57%	0.567	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	49.3	48.8	178.9	-164.3	26.6	0	0	0	113.6	N64 F65 T66	N64-D106 VanDerWaalsContact CA-OD1 3.3Å; N64-D106 WeakPolarHBondContact CA-OD1 3.48Å; N64-D106 VanDerWaalsContact CB-OD1 3.29Å; N64-D106 WeakPolarHBondContact CB-OD1 3.15Å; N64-D106 PolarHBondContact ND2-OD1 2.76Å; F65-D106 PolarHBondContact O-N 2.8Å; T66-D106 PolarHBondContact OG1-N 2.78Å; T66-D106 VanDerWaalsContact OG1-N 3.15Å
107	K	90.6	Very high	87.4	Confident	113 Å²	113	68.2 Å²	68.2	49%	0.491	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	148.2	-175.9	-63.7	-57.9	-178.1	-176	0	112.5	N64 F65 Y104 Y105 V109	N64-K107 PolarHBondContact N-O 2.92Å; F65-K107 WeakPolarHBondContact CB-O 3.47Å; F65-K107 PolarHBondContact N-O 2.89Å; F65-K107 PolarHBondContact O-N 3Å; Y104-K107 HydrophobicContact CD1-CB 3.83Å; Y104-K107 HydrophobicContact CD1-CG 3.85Å; Y105-K107 VanDerWaalsContact C-N 3.33Å; Y105-K107 WeakPolarHBondContact O-CG 3.42Å; Y105-K107 PolarHBondContact O-N 3.46Å; K107-V109 HydrophobicContact CB-CG2 4.37Å
108	H	90.8	Very high	87.8	Confident	73 Å²	73	67.8 Å²	67.8	34%	0.338	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	109.5	165.4	-177.5	-179.2	0	0	0	108.1	Q61 I62	Q61-H108 PolarHBondContact OE1-CE1 2.77Å; Q61-H108 PolarHBondContact OE1-NE2 2.79Å; I62-H108 WeakPolarHBondContact O-CA 3.39Å
109	V	91.7	Very high	88.3	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	135.9	179	-179.7	0	0	0	0	109.4	Q61 I62 F65 F76 Y104 K107 I111	Q61-V109 CarbonylContact C-O 3.56Å; Q61-V109 WeakPolarHBondContact CA-O 3.36Å; I62-V109 HydrophobicContact CB-CB 4.27Å; I62-V109 HydrophobicContact CD1-CB 4.38Å; I62-V109 HydrophobicContact CD1-CG1 4.47Å; I62-V109 PolarHBondContact N-O 2.73Å; I62-V109 PolarHBondContact O-N 2.76Å; F65-V109 HydrophobicContact CB-CG2 3.9Å; F65-V109 HydrophobicContact CD1-CG2 3.66Å; F65-V109 HydrophobicContact CG-CG2 4.09Å; F76-V109 HydrophobicContact CE2-CG1 3.91Å; F76-V109 HydrophobicContact CZ-CG1 3.84Å; Y104-V109 HydrophobicContact CD1-CG2 3.84Å; Y104-V109 HydrophobicContact CE1-CG2 3.7Å; K107-V109 HydrophobicContact CB-CG2 4.37Å; V109-I111 HydrophobicContact CG1-CD1 3.83Å; V109-I111 HydrophobicContact CG1-CG1 4.3Å
110	V	91.4	Very high	88.3	Confident	31 Å²	31	58.5 Å²	58.5	19%	0.188	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	127.8	176.1	176.9	0	0	0	0	108.4	Q61 V281	Q61-V110 HydrophobicContact CB-CG2 4.46Å; V110-V281 HydrophobicContact CB-CG1 4.13Å; V110-V281 HydrophobicContact CG1-CG1 3.55Å; V110-V281 HydrophobicContact CG2-CG1 3.41Å; V110-V281 VanDerWaalsContact CG2-CG1 3.41Å
111	I	90.8	Very high	88.3	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.01	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	121.8	178.8	-57.5	-60.3	0	0	0	108.1	C59 L60 F76 I91 V109 F125	C59-I111 WeakPolarHBondContact CA-O 3.28Å; L60-I111 HydrophobicContact CB-CB 4.25Å; L60-I111 PolarHBondContact N-O 3.45Å; L60-I111 PolarHBondContact O-N 2.9Å; F76-I111 HydrophobicContact CD2-CD1 3.58Å; F76-I111 HydrophobicContact CE2-CD1 3.86Å; F76-I111 HydrophobicContact CG-CD1 4Å; F76-I111 HydrophobicContact CZ-CD1 4.49Å; I91-I111 HydrophobicContact CB-CG2 4.45Å; I91-I111 HydrophobicContact CD1-CG2 4.02Å; I91-I111 HydrophobicContact CG2-CG2 3.52Å; V109-I111 HydrophobicContact CG1-CD1 3.83Å; V109-I111 HydrophobicContact CG1-CG1 4.3Å; I111-F125 HydrophobicContact CG1-CE2 4.48Å; I111-F125 HydrophobicContact CG1-CZ 4.24Å
112	T	89	Confident	88.4	Confident	89 Å²	89	62.4 Å²	62.4	55%	0.546	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	120.9	-179.7	-55.2	0	0	0	0	109.7	T58	T58-T112 WeakPolarHBondContact O-CA 3.48Å
113	L	88.4	Confident	88.7	Confident	16 Å²	16	62.1 Å²	62.1	8%	0.084	34%	0.344	C	S	.	.			trans	-83.7	154.4	176.1	-57.7	-171.3	0	0	0	110.7	T58 L78 I91 I117 I119	T58-L113 PolarHBondContact O-N 3.45Å; L78-L113 HydrophobicContact CD1-CD1 3.61Å; L78-L113 HydrophobicContact CD1-CD2 3.81Å; L78-L113 HydrophobicContact CD1-CG 4.32Å; I91-L113 HydrophobicContact CD1-CD2 4.26Å; I91-L113 HydrophobicContact CG1-CD2 4.26Å; I91-L113 HydrophobicContact CG2-CD2 3.97Å; L113-I117 HydrophobicContact CD1-CG2 3.93Å; L113-I119 HydrophobicContact CD1-CG1 3.57Å; L113-I119 HydrophobicContact CG-CG1 4.24Å
114	P	81.5	Confident	89.1	Confident	72 Å²	72	59 Å²	59	47%	0.468	32%	0.323	S	S	.	.			trans	-62.7	154	171.2	29.7	-36.4	0	0	0	110.7	N116 I117	P114-N116 WeakPolarHBondContact CB-OD1 3.27Å; P114-N116 PolarHBondContact O-N 3.01Å; P114-I117 HydrophobicContact CG-CB 4.25Å; P114-I117 HydrophobicContact CG-CD1 3.69Å; P114-I117 HydrophobicContact CG-CG1 3.97Å; P114-I117 PolarHBondContact O-N 2.78Å
115	S	71.7	Confident	89.3	Confident	124 Å²	124	58.6 Å²	58.6	87%	0.867	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-14.1	-170.3	47.7	0	0	0	0	115.6
116	N	79.9	Confident	89.6	Confident	131 Å²	131	51.9 Å²	51.9	70%	0.701	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	5	179	66.4	-57.9	0	0	0	113.8	P114	P114-N116 WeakPolarHBondContact CB-OD1 3.27Å; P114-N116 PolarHBondContact O-N 3.01Å
117	I	87.2	Confident	89.9	Confident	51 Å²	51	46.9 Å²	46.9	26%	0.262	27%	0.27	S	S	.	.			trans	-127.2	122.2	179.3	-59	-178.7	0	0	0	108.3	L113 P114 F122	L113-I117 HydrophobicContact CD1-CG2 3.93Å; P114-I117 HydrophobicContact CG-CB 4.25Å; P114-I117 HydrophobicContact CG-CD1 3.69Å; P114-I117 HydrophobicContact CG-CG1 3.97Å; P114-I117 PolarHBondContact O-N 2.78Å; I117-F122 HydrophobicContact CG2-CE2 3.52Å; I117-F122 HydrophobicContact CG2-CZ 3.9Å
118	A	89.7	Confident	90.1	Very high	21 Å²	21	42.1 Å²	42.1	17%	0.174	25%	0.248	C	C	.	.			trans	-98.8	144.2	175.6	0	0	0	0	0	110.9	S57 T120 D121 F122	S57-A118 CarbonylContact O-C 3.47Å; S57-A118 WeakPolarHBondContact O-CA 3.18Å; A118-T120 PolarHBondContact O-N 3.11Å; A118-D121 WeakPolarHBondContact CB-OD2 3.2Å; A118-D121 PolarHBondContact N-OD2 3.09Å; A118-D121 VanDerWaalsContact O-CB 3.3Å; A118-D121 WeakPolarHBondContact O-CB 3.23Å; A118-D121 PolarHBondContact O-N 3.41Å; A118-F122 WeakPolarHBondContact O-CD2 3.16Å
119	I	91.1	Very high	90.3	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.021	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-60.8	-32.2	174.2	-66.9	159	0	0	0	110.6	L54 S57 T58 C59 L60 L113 D121 F122 L141	L54-I119 HydrophobicContact CD1-CB 4.1Å; L54-I119 HydrophobicContact CD1-CD1 3.48Å; L54-I119 VanDerWaalsContact CD1-CD1 3.48Å; L54-I119 HydrophobicContact CD1-CG1 4.4Å; L54-I119 HydrophobicContact CD1-CG2 3.85Å; S57-I119 PolarHBondContact O-N 2.78Å; T58-I119 VanDerWaalsContact C-CD1 3.45Å; C59-I119 VanDerWaalsContact C-CD1 3.41Å; C59-I119 WeakPolarHBondContact O-CD1 3.47Å; L60-I119 HydrophobicContact CD1-CD1 4.43Å; L60-I119 HydrophobicContact CD1-CG2 4.38Å; L60-I119 HydrophobicContact CD2-CD1 3.95Å; L60-I119 HydrophobicContact CD2-CG2 4.13Å; L60-I119 HydrophobicContact CG-CD1 3.61Å; L60-I119 HydrophobicContact CG-CG1 4.26Å; L60-I119 HydrophobicContact CG-CG2 4.37Å; L113-I119 HydrophobicContact CD1-CG1 3.57Å; L113-I119 HydrophobicContact CG-CG1 4.24Å; I119-D121 PolarHBondContact O-N 2.94Å; I119-F122 PolarHBondContact O-N 3Å; I119-L141 HydrophobicContact CG2-CD1 3.84Å; I119-L141 HydrophobicContact CG2-CD2 3.87Å; I119-L141 HydrophobicContact CG2-CG 4.38Å
120	T	88.2	Confident	90.4	Very high	78 Å²	78	43 Å²	43	48%	0.479	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-67.8	-10.9	177.1	50.6	0	0	0	0	114.1	A118 F122 P147	A118-T120 PolarHBondContact O-N 3.11Å; T120-F122 PolarHBondContact O-N 3.36Å; T120-P147 HydrophobicContact CG2-CG 3.74Å
121	D	91	Very high	90.4	Very high	97 Å²	97	44.8 Å²	44.8	52%	0.519	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-78.3	-6.1	174.6	-56.3	-27.2	0	0	0	112	S80 A118 I119	S80-D121 PolarHBondContact OG-O 3.15Å; A118-D121 WeakPolarHBondContact CB-OD2 3.2Å; A118-D121 PolarHBondContact N-OD2 3.09Å; A118-D121 VanDerWaalsContact O-CB 3.3Å; A118-D121 WeakPolarHBondContact O-CB 3.23Å; A118-D121 PolarHBondContact O-N 3.41Å; I119-D121 PolarHBondContact O-N 2.94Å
122	F	94.1	Very high	90.4	Very high	26 Å²	26	47.9 Å²	47.9	11%	0.114	29%	0.288	C	S	.	.			trans	-117.8	150.8	-178.2	-57.1	-84.5	0	0	0	111.3	L78 V89 I117 A118 I119 T120 L141	L78-F122 HydrophobicContact CB-CB 4.28Å; L78-F122 HydrophobicContact CB-CD1 3.65Å; L78-F122 HydrophobicContact CB-CD2 4.07Å; L78-F122 HydrophobicContact CB-CE1 3.89Å; L78-F122 HydrophobicContact CB-CE2 4.3Å; L78-F122 HydrophobicContact CB-CG 3.73Å; L78-F122 HydrophobicContact CB-CZ 4.21Å; L78-F122 HydrophobicContact CD1-CD2 3.79Å; L78-F122 HydrophobicContact CD1-CE2 3.79Å; L78-F122 HydrophobicContact CD1-CG 4.3Å; L78-F122 HydrophobicContact CD1-CZ 4.3Å; L78-F122 HydrophobicContact CD2-CB 3.95Å; L78-F122 HydrophobicContact CD2-CD2 4.11Å; L78-F122 HydrophobicContact CD2-CG 4.05Å; L78-F122 HydrophobicContact CG-CD2 4.21Å; L78-F122 HydrophobicContact CG-CG 4.23Å; V89-F122 HydrophobicContact CB-CE1 4.36Å; V89-F122 HydrophobicContact CG2-CE1 3.88Å; V89-F122 HydrophobicContact CG2-CZ 4.19Å; I117-F122 HydrophobicContact CG2-CE2 3.52Å; I117-F122 HydrophobicContact CG2-CZ 3.9Å; A118-F122 WeakPolarHBondContact O-CD2 3.16Å; I119-F122 PolarHBondContact O-N 3Å; T120-F122 PolarHBondContact O-N 3.36Å; F122-L141 HydrophobicContact CB-CD1 3.77Å; F122-L141 WeakPolarHBondContact O-CB 3.46Å
123	S	94.7	Very high	90.7	Very high	50 Å²	50	47.1 Å²	47.1	35%	0.35	29%	0.286	S	S	.	.	S	Bend	trans	-90.5	-30.3	177.7	-64.1	0	0	0	0	111.8	D79 S80 L141	D79-S123 PolarHBondContact O-N 2.85Å; S80-S123 VanDerWaalsContact O-CB 3.26Å; S80-S123 WeakPolarHBondContact O-CB 3.14Å; S80-S123 PolarHBondContact O-OG 3.46Å; S123-L141 PolarHBondContact O-N 2.86Å
124	T	96.4	Very high	90.9	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.012	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	146.9	-175.6	63.2	0	0	0	0	112.7	L78 D79 E81 E82 V139	L78-T124 WeakPolarHBondContact CA-O 3.4Å; L78-T124 WeakPolarHBondContact CD2-O 3.46Å; D79-T124 PolarHBondContact N-O 3.18Å; D79-T124 PolarHBondContact O-N 2.86Å; D79-T124 PolarHBondContact O-OG1 2.86Å; E81-T124 WeakPolarHBondContact O-CG2 3.29Å; E81-T124 PolarHBondContact O-OG1 3.24Å; E82-T124 HydrophobicContact CB-CG2 3.73Å; E82-T124 HydrophobicContact CG-CG2 3.71Å; T124-V139 WeakPolarHBondContact CA-O 3.35Å
125	F	96.3	Very high	91.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	135.2	165.7	170.1	-100.9	0	0	0	108.7	V52 L60 I62 F76 W77 L78 I91 I111 H138 V139 L141	V52-F125 HydrophobicContact CG1-CD1 3.76Å; V52-F125 HydrophobicContact CG1-CE1 3.93Å; V52-F125 HydrophobicContact CG2-CD1 4.25Å; V52-F125 HydrophobicContact CG2-CE1 4.15Å; L60-F125 HydrophobicContact CD1-CB 4.09Å; L60-F125 HydrophobicContact CD1-CD1 3.98Å; L60-F125 HydrophobicContact CD1-CD2 3.55Å; L60-F125 HydrophobicContact CD1-CE1 4.3Å; L60-F125 HydrophobicContact CD1-CE2 3.9Å; L60-F125 HydrophobicContact CD1-CG 3.58Å; L60-F125 HydrophobicContact CD1-CZ 4.26Å; I62-F125 HydrophobicContact CD1-CE1 3.89Å; I62-F125 HydrophobicContact CD1-CZ 3.88Å; I62-F125 HydrophobicContact CG1-CE1 4.29Å; F76-F125 HydrophobicContact CB-CE2 4.23Å; F76-F125 HydrophobicContact CB-CZ 4.48Å; F76-F125 HydrophobicContact CD1-CE2 4.35Å; F76-F125 AromaticContact CD1-CZ 3.78Å; F76-F125 HydrophobicContact CD1-CZ 3.78Å; F76-F125 HydrophobicContact CE1-CZ 4.46Å; F76-F125 HydrophobicContact CG-CZ 4.4Å; W77-F125 CarbonylContact O-C 3.52Å; W77-F125 WeakPolarHBondContact O-CA 3.25Å; L78-F125 HydrophobicContact CD2-CB 3.86Å; L78-F125 HydrophobicContact CD2-CD2 3.92Å; L78-F125 HydrophobicContact CD2-CG 4.39Å; L78-F125 HydrophobicContact CG-CD2 4.22Å; I91-F125 HydrophobicContact CD1-CD2 4Å; I91-F125 HydrophobicContact CD1-CE2 3.79Å; I111-F125 HydrophobicContact CG1-CE2 4.48Å; I111-F125 HydrophobicContact CG1-CZ 4.24Å; F125-H138 CarbonylContact O-C 3.59Å; F125-H138 VanDerWaalsContact O-CA 3.31Å; F125-H138 WeakPolarHBondContact O-CA 3.03Å; F125-V139 HydrophobicContact CB-CG2 4.23Å; F125-V139 HydrophobicContact CD1-CG2 4.16Å; F125-V139 PolarHBondContact N-O 2.92Å; F125-V139 WeakPolarHBondContact O-CG2 3.35Å; F125-V139 PolarHBondContact O-N 3.27Å; F125-L141 HydrophobicContact CB-CD1 4.06Å; F125-L141 HydrophobicContact CB-CD2 3.8Å; F125-L141 HydrophobicContact CB-CG 4.09Å
126	G	96.1	Very high	92.7	Very high	3 Å²	3	43.2 Å²	43.2	3%	0.031	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.1	-157.6	-177.4	0	0	0	0	0	114.7	F76 W77 G137	F76-G126 WeakPolarHBondContact CA-O 3.14Å; W77-G126 PolarHBondContact N-O 3.18Å; W77-G126 PolarHBondContact O-N 2.97Å; G126-G137 CarbonylContact C-O 3.43Å; G126-G137 WeakPolarHBondContact CA-O 3.38Å
127	L	96.4	Very high	93.4	Very high	2 Å²	2	37 Å²	37	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	125.6	177.3	-61.6	172.5	0	0	0	108.9	L40 I48 F65 L74 F75 F76 L101 F136 G137	L40-L127 HydrophobicContact CD1-CD1 4.32Å; L40-L127 HydrophobicContact CD1-CG 4.49Å; I48-L127 HydrophobicContact CD1-CD1 3.83Å; I48-L127 HydrophobicContact CG1-CD1 4.16Å; I48-L127 HydrophobicContact CG2-CD1 3.65Å; F65-L127 HydrophobicContact CE2-CD1 4.11Å; F65-L127 HydrophobicContact CE2-CD2 4.48Å; F65-L127 HydrophobicContact CZ-CD1 4.25Å; F65-L127 HydrophobicContact CZ-CD2 4.14Å; L74-L127 HydrophobicContact CD1-CB 4.06Å; L74-L127 HydrophobicContact CD2-CB 4.41Å; L74-L127 HydrophobicContact CD2-CD1 4.32Å; L74-L127 HydrophobicContact CG-CB 4.31Å; F75-L127 WeakPolarHBondContact O-CA 3.15Å; F76-L127 HydrophobicContact CD1-CD2 3.62Å; F76-L127 HydrophobicContact CE1-CD2 3.71Å; L101-L127 HydrophobicContact CD1-CD2 3.62Å; L127-F136 HydrophobicContact CB-CB 3.86Å; L127-F136 WeakPolarHBondContact O-CB 3.41Å; L127-F136 PolarHBondContact O-N 3Å; L127-G137 PolarHBondContact N-O 3.36Å
128	W	95.9	Very high	93.8	Very high	12 Å²	12	35.5 Å²	35.5	5%	0.045	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	129.6	-179.7	179.1	-97.1	0	0	0	110	F75 W77 P84 P86 S133 D135	F75-W128 PolarHBondContact N-O 2.96Å; F75-W128 PolarHBondContact O-N 2.88Å; W77-W128 HydrophobicContact CB-CB 3.55Å; W77-W128 HydrophobicContact CD2-CB 3.57Å; W77-W128 AromaticContact CD2-CD1 3.86Å; W77-W128 AromaticContact CD2-CG 3.81Å; W77-W128 HydrophobicContact CD2-CG 3.81Å; W77-W128 AromaticContact CE2-CD1 3.81Å; W77-W128 AromaticContact CE2-CG 3.92Å; W77-W128 HydrophobicContact CE3-CB 3.95Å; W77-W128 AromaticContact CE3-CD1 3.94Å; W77-W128 HydrophobicContact CE3-CG 4.22Å; W77-W128 HydrophobicContact CG-CB 3.38Å; W77-W128 AromaticContact CG-CG 3.98Å; W77-W128 HydrophobicContact CG-CG 3.98Å; W77-W128 AromaticContact CZ2-CD1 3.94Å; W77-W128 HydrophobicContact CZ2-CG 4.47Å; P84-W128 HydrophobicContact CB-CE3 4.47Å; P84-W128 WeakPolarHBondContact O-CZ3 3.27Å; P86-W128 HydrophobicContact CB-CZ2 3.96Å; P86-W128 HydrophobicContact CG-CH2 4.01Å; P86-W128 HydrophobicContact CG-CZ2 3.64Å; W128-S133 VanDerWaalsContact CH2-C 3.49Å; W128-S133 WeakPolarHBondContact CH2-O 3.37Å; W128-S133 VanDerWaalsContact CZ2-CA 3.48Å; W128-D135 HydrophobicContact CE3-CB 4.26Å; W128-D135 HydrophobicContact CZ3-CB 4.19Å
129	C	94.8	Very high	94.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	108.5	172.6	-171.7	0	0	0	0	109.3	D73 L74 C132 S133 Q134 F136	D73-C129 CarbonylContact O-C 3.53Å; D73-C129 VanDerWaalsContact O-CA 3.28Å; D73-C129 WeakPolarHBondContact O-CA 3.22Å; L74-C129 HydrophobicContact CD1-CB 4.12Å; C129-C132 HydrophobicContact CB-CB 4.26Å; C129-C132 VanDerWaalsContact SG-SG 3.6Å; C129-S133 WeakPolarHBondContact O-CA 3.28Å; C129-S133 PolarHBondContact O-N 3.28Å; C129-Q134 PolarHBondContact N-O 3.12Å; C129-Q134 PolarHBondContact O-N 3.21Å; C129-F136 HydrophobicContact CB-CD2 3.59Å; C129-F136 HydrophobicContact CB-CE2 3.23Å; C129-F136 HydrophobicContact CB-CZ 3.99Å
130	Q	93.2	Very high	94.3	Very high	91 Å²	91	41.7 Å²	41.7	43%	0.425	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-43.6	-172	-172.5	167.5	-1.4	0	0	112.3	D73 F75 C132 S133	D73-Q130 PolarHBondContact O-N 3.48Å; F75-Q130 HydrophobicContact CD2-CB 4.03Å; F75-Q130 HydrophobicContact CE2-CB 3.83Å; Q130-C132 PolarHBondContact O-N 3.13Å; Q130-S133 PolarHBondContact O-N 3.46Å
131	S	92.5	Very high	94.4	Very high	70 Å²	70	38.5 Å²	38.5	49%	0.49	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-34.2	-179.3	60.2	0	0	0	0	113.3	D73	D73-S131 WeakPolarHBondContact CB-OG 3.07Å
132	C	91.2	Very high	93.7	Very high	67 Å²	67	38.6 Å²	38.6	45%	0.453	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-8	178.7	-54.7	0	0	0	0	113	P72 C129 Q130 Q134	P72-C132 VanDerWaalsContact CG-SG 3.57Å; C129-C132 HydrophobicContact CB-CB 4.26Å; C129-C132 VanDerWaalsContact SG-SG 3.6Å; Q130-C132 PolarHBondContact O-N 3.13Å; C132-Q134 VanDerWaalsContact C-N 3.29Å; C132-Q134 HydrophobicContact CB-CB 4.3Å; C132-Q134 PolarHBondContact O-N 2.78Å
133	S	93.6	Very high	92.6	Very high	72 Å²	72	40.2 Å²	40.2	50%	0.503	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	48	-173.6	-64.6	0	0	0	0	113.1	W128 C129 Q130	W128-S133 VanDerWaalsContact CH2-C 3.49Å; W128-S133 WeakPolarHBondContact CH2-O 3.37Å; W128-S133 VanDerWaalsContact CZ2-CA 3.48Å; C129-S133 WeakPolarHBondContact O-CA 3.28Å; C129-S133 PolarHBondContact O-N 3.28Å; Q130-S133 PolarHBondContact O-N 3.46Å
134	Q	94.1	Very high	91.2	Very high	92 Å²	92	44.3 Å²	44.3	43%	0.43	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	139.9	-172.5	-173.5	175.3	13.9	0	0	112	C129 C132 F136	C129-Q134 PolarHBondContact N-O 3.12Å; C129-Q134 PolarHBondContact O-N 3.21Å; C132-Q134 VanDerWaalsContact C-N 3.29Å; C132-Q134 HydrophobicContact CB-CB 4.3Å; C132-Q134 PolarHBondContact O-N 2.78Å; Q134-F136 HydrophobicContact CB-CD2 4.4Å; Q134-F136 HydrophobicContact CB-CE2 4.07Å; Q134-F136 HydrophobicContact CG-CD2 4.38Å; Q134-F136 HydrophobicContact CG-CE2 4.18Å; Q134-F136 WeakPolarHBondContact O-CD2 3.29Å
135	D	94.9	Very high	90.4	Very high	27 Å²	27	49.4 Å²	49.4	14%	0.144	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	120.8	171.2	173.9	18.4	0	0	0	110.7	R43 Q44 P84 W128 G137 H138	R43-D135 IonicContact CZ-OD2 2.76Å; R43-D135 IonicContact NH1-OD1 2.69Å; R43-D135 PolarHBondContact NH1-OD1 2.95Å; R43-D135 IonicContact NH1-OD2 3.07Å; R43-D135 PolarHBondContact NH1-OD2 2.76Å; Q44-D135 PolarHBondContact NE2-O 3.42Å; P84-D135 HydrophobicContact CG-CB 4.02Å; W128-D135 HydrophobicContact CE3-CB 4.26Å; W128-D135 HydrophobicContact CZ3-CB 4.19Å; D135-G137 PolarHBondContact OD1-N 3.38Å; D135-H138 IonicContact OD1-ND1 3.94Å; D135-H138 IonicContact OD2-CE1 3.15Å; D135-H138 PolarHBondContact OD2-CE1 3.16Å; D135-H138 VanDerWaalsContact OD2-CE1 3.25Å; D135-H138 IonicContact OD2-CG 2.87Å; D135-H138 IonicContact OD2-ND1 2.73Å; D135-H138 PolarHBondContact OD2-ND1 2.96Å
136	F	95.2	Very high	89.9	Confident	12 Å²	12	52.9 Å²	52.9	5%	0.053	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-1	-179.8	-88.6	-115.2	0	0	0	113.5	Q44 I46 I48 A71 L74 L127 C129 Q134	Q44-F136 HydrophobicContact CG-CD1 4.35Å; Q44-F136 HydrophobicContact CG-CE1 4.14Å; Q44-F136 HydrophobicContact CG-CZ 4.37Å; Q44-F136 VanDerWaalsContact OE1-CA 3.26Å; Q44-F136 PolarHBondContact OE1-O 3.45Å; I46-F136 HydrophobicContact CD1-CD1 3.78Å; I46-F136 HydrophobicContact CD1-CE1 3.62Å; I48-F136 HydrophobicContact CD1-CB 4.15Å; I48-F136 HydrophobicContact CD1-CD1 4.01Å; A71-F136 HydrophobicContact CB-CD1 4.13Å; A71-F136 HydrophobicContact CB-CE1 3.41Å; A71-F136 VanDerWaalsContact CB-CE1 3.41Å; A71-F136 HydrophobicContact CB-CZ 3.71Å; L74-F136 HydrophobicContact CD1-CB 3.64Å; L74-F136 HydrophobicContact CD1-CD1 3.74Å; L74-F136 HydrophobicContact CD1-CD2 3.86Å; L74-F136 HydrophobicContact CD1-CE1 4.37Å; L74-F136 HydrophobicContact CD1-CE2 4.49Å; L74-F136 HydrophobicContact CD1-CG 3.44Å; L74-F136 VanDerWaalsContact CD1-CG 3.44Å; L127-F136 HydrophobicContact CB-CB 3.86Å; L127-F136 WeakPolarHBondContact O-CB 3.41Å; L127-F136 PolarHBondContact O-N 3Å; C129-F136 HydrophobicContact CB-CD2 3.59Å; C129-F136 HydrophobicContact CB-CE2 3.23Å; C129-F136 HydrophobicContact CB-CZ 3.99Å; Q134-F136 HydrophobicContact CB-CD2 4.4Å; Q134-F136 HydrophobicContact CB-CE2 4.07Å; Q134-F136 HydrophobicContact CG-CD2 4.38Å; Q134-F136 HydrophobicContact CG-CE2 4.18Å; Q134-F136 WeakPolarHBondContact O-CD2 3.29Å
137	G	94.5	Very high	89.7	Confident	0 Å²	0	54 Å²	54	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	137.2	128.4	-176.8	0	0	0	0	0	110.9	R43 G126 L127 D135	R43-G137 VanDerWaalsContact NH1-CA 3.34Å; G126-G137 CarbonylContact C-O 3.43Å; G126-G137 WeakPolarHBondContact CA-O 3.38Å; L127-G137 PolarHBondContact N-O 3.36Å; D135-G137 PolarHBondContact OD1-N 3.38Å
138	H	96.4	Very high	89.6	Confident	20 Å²	20	53.9 Å²	53.9	9%	0.093	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	158	177.2	67	-99.2	0	0	0	111.3	R43 E82 P84 F125 D135	R43-H138 PolarHBondContact NH1-CE1 3.36Å; R43-H138 VanDerWaalsContact NH1-N 3.15Å; R43-H138 PolarHBondContact NH1-ND1 2.87Å; R43-H138 PolarHBondContact NH2-CE1 3.09Å; E82-H138 IonicContact OE1-NE2 2.81Å; P84-H138 VanDerWaalsContact CD-CE1 3.42Å; P84-H138 WeakPolarHBondContact CD-CE1 3.46Å; P84-H138 WeakPolarHBondContact CD-ND1 3.03Å; P84-H138 HydrophobicContact CG-CB 4.21Å; F125-H138 CarbonylContact O-C 3.59Å; F125-H138 VanDerWaalsContact O-CA 3.31Å; F125-H138 WeakPolarHBondContact O-CA 3.03Å; D135-H138 IonicContact OD1-ND1 3.94Å; D135-H138 IonicContact OD2-CE1 3.15Å; D135-H138 PolarHBondContact OD2-CE1 3.16Å; D135-H138 VanDerWaalsContact OD2-CE1 3.25Å; D135-H138 IonicContact OD2-CG 2.87Å; D135-H138 IonicContact OD2-ND1 2.73Å; D135-H138 PolarHBondContact OD2-ND1 2.96Å
139	V	95.9	Very high	89.5	Confident	8 Å²	8	57 Å²	57	5%	0.048	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	152.2	168.4	-60.8	0	0	0	0	109.4	L37 L40 V52 T124 F125	L37-V139 HydrophobicContact CB-CG2 4.24Å; L40-V139 HydrophobicContact CD2-CG1 4.37Å; V52-V139 HydrophobicContact CB-CG2 4.15Å; V52-V139 HydrophobicContact CG1-CG2 4.19Å; V52-V139 HydrophobicContact CG2-CG1 4.24Å; V52-V139 HydrophobicContact CG2-CG2 4.16Å; T124-V139 WeakPolarHBondContact CA-O 3.35Å; F125-V139 HydrophobicContact CB-CG2 4.23Å; F125-V139 HydrophobicContact CD1-CG2 4.16Å; F125-V139 PolarHBondContact N-O 2.92Å; F125-V139 WeakPolarHBondContact O-CG2 3.35Å; F125-V139 PolarHBondContact O-N 3.27Å
140	R	94.9	Very high	89.5	Confident	147 Å²	147	59.3 Å²	59.3	56%	0.555	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	140.7	172.6	-68.6	-177.3	177.5	129	10.5	110.2	E82	E82-R140 IonicContact OE1-CZ 3.9Å; E82-R140 IonicContact OE1-NE 3.78Å; E82-R140 PolarHBondContact OE1-NE 3.01Å; E82-R140 IonicContact OE1-NH2 3.71Å; E82-R140 PolarHBondContact OE1-NH2 2.8Å; E82-R140 WeakPolarHBondContact OE2-CD 3.17Å; E82-R140 VanDerWaalsContact OE2-CG 3.31Å; E82-R140 WeakPolarHBondContact OE2-CG 3.35Å; E82-R140 IonicContact OE2-CZ 2.7Å; E82-R140 IonicContact OE2-NE 3.1Å; E82-R140 PolarHBondContact OE2-NE 2.83Å; E82-R140 IonicContact OE2-NH2 3.48Å
141	L	91	Very high	89.7	Confident	10 Å²	10	57.2 Å²	57.2	5%	0.052	34%	0.339	C	S	.	.			trans	-98	-4.3	175.7	-64.1	175.7	0	0	0	112.9	L37 L78 I119 F122 S123 F125 Q143	L37-L141 HydrophobicContact CD1-CD2 3.58Å; L37-L141 HydrophobicContact CD2-CD2 4.27Å; L37-L141 HydrophobicContact CG-CD2 4.49Å; L78-L141 HydrophobicContact CD2-CD1 3.54Å; I119-L141 HydrophobicContact CG2-CD1 3.84Å; I119-L141 HydrophobicContact CG2-CD2 3.87Å; I119-L141 HydrophobicContact CG2-CG 4.38Å; F122-L141 HydrophobicContact CB-CD1 3.77Å; F122-L141 WeakPolarHBondContact O-CB 3.46Å; S123-L141 PolarHBondContact O-N 2.86Å; F125-L141 HydrophobicContact CB-CD1 4.06Å; F125-L141 HydrophobicContact CB-CD2 3.8Å; F125-L141 HydrophobicContact CB-CG 4.09Å; L141-Q143 WeakPolarHBondContact O-CG 3.42Å; L141-Q143 PolarHBondContact O-N 2.04Å
142	S	76.5	Confident	89.9	Confident	100 Å²	100	59 Å²	59	70%	0.699	34%	0.338	S	S	*	.			trans	-62.9	117.8	178.5	50.7	0	0	0	0	110.9
143	Q	69.5	Low	90.2	Very high	60 Å²	60	56.3 Å²	56.3	28%	0.28	32%	0.319	S	S	.	.			trans	-116	141.5	-179.5	-62.8	-168.5	-17.6	0	0	111.1	L37 L54 L141 Q145	L37-Q143 HydrophobicContact CD2-CG 4.11Å; L54-Q143 VanDerWaalsContact CD2-CD 3.47Å; L141-Q143 WeakPolarHBondContact O-CG 3.42Å; L141-Q143 PolarHBondContact O-N 2.04Å; Q143-Q145 VanDerWaalsContact C-N 3.26Å; Q143-Q145 WeakPolarHBondContact CB-O 3Å; Q143-Q145 PolarHBondContact OE1-O 3.13Å
144	S	66.7	Low	90.1	Very high	136 Å²	136	60.2 Å²	60.2	95%	0.951	33%	0.33	S	S	*	.	S	Bend	trans	-77.5	-15	170.6	69	0	0	0	0	112.9
145	Q	78.1	Confident	89.9	Confident	109 Å²	109	56.8 Å²	56.8	51%	0.509	32%	0.319	S	S	.	.	S	Bend	trans	-124.9	146.4	-172.9	-170.6	168.5	8.8	0	0	110.4	Q143	Q143-Q145 VanDerWaalsContact C-N 3.26Å; Q143-Q145 WeakPolarHBondContact CB-O 3Å; Q143-Q145 PolarHBondContact OE1-O 3.13Å
146	A	87.2	Confident	89.9	Confident	73 Å²	73	56.1 Å²	56.1	60%	0.603	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-63.6	142.3	175.8	0	0	0	0	0	111.2	R276	A146-R276 PolarHBondContact O-NH2 2.95Å
147	P	90.9	Very high	90	Very high	26 Å²	26	55.8 Å²	55.8	17%	0.169	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-55.1	155.2	179.1	-27.7	35.2	0	0	0	113.4	L54 T120	L54-P147 HydrophobicContact CD2-CB 3.75Å; L54-P147 HydrophobicContact CD2-CG 3.82Å; T120-P147 HydrophobicContact CG2-CG 3.74Å
148	P	94.2	Very high	90	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-61.3	141.1	170	-17.9	31.8	0	0	0	110.6	W32 V55 N56 R276 P278	W32-P148 HydrophobicContact CH2-CB 3.98Å; W32-P148 HydrophobicContact CH2-CG 3.55Å; W32-P148 HydrophobicContact CZ2-CG 4.15Å; V55-P148 WeakPolarHBondContact O-CB 3.16Å; N56-P148 WeakPolarHBondContact CA-O 3.28Å; N56-P148 VanDerWaalsContact CB-O 3.28Å; N56-P148 WeakPolarHBondContact CB-O 3.26Å; P148-R276 CarbonylContact C-O 3.43Å; P148-R276 WeakPolarHBondContact CA-O 3.45Å; P148-R276 VanDerWaalsContact CB-O 3.31Å; P148-R276 WeakPolarHBondContact CB-O 3.13Å; P148-P278 HydrophobicContact CB-CB 4.42Å; P148-P278 HydrophobicContact CB-CG 4.1Å
149	T	94.4	Very high	90	Very high	76 Å²	76	65.1 Å²	65.1	47%	0.466	36%	0.359	S	S	.	.			trans	-134.7	142.9	-173.2	49.7	0	0	0	0	113.1	R276 P278	T149-R276 PolarHBondContact N-O 3.14Å; T149-P278 WeakPolarHBondContact O-CD 3.33Å
150	A	95.2	Very high	90	Very high	49 Å²	49	66.4 Å²	66.4	41%	0.405	37%	0.367	S	S	.	.			trans	-61.5	151.9	170.9	0	0	0	0	0	110.5	L174 I175	A150-L174 HydrophobicContact CB-CD1 3.98Å; A150-I175 CarbonylContact C-O 3.53Å; A150-I175 VanDerWaalsContact CA-O 3.27Å; A150-I175 WeakPolarHBondContact CA-O 3.48Å; A150-I175 VanDerWaalsContact CB-O 3.29Å; A150-I175 WeakPolarHBondContact CB-O 3.47Å
151	Q	97	Very high	89.8	Confident	48 Å²	48	64.4 Å²	64.4	22%	0.224	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	134.1	-175.5	-176.1	-178.7	-5	0	0	111.7	I175 N272 I277	Q151-I175 PolarHBondContact N-O 3.21Å; Q151-I175 WeakPolarHBondContact O-CB 3.29Å; Q151-I175 PolarHBondContact O-N 3.3Å; Q151-N272 PolarHBondContact NE2-O 3.38Å; Q151-I277 HydrophobicContact CB-CD1 3.54Å
152	F	97.6	Very high	89.7	Confident	106 Å²	106	68 Å²	68	47%	0.465	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	138.8	167.5	-76.5	-77.1	0	0	0	111.1	P172 V173 L174 Y184	F152-P172 HydrophobicContact CD1-CB 3.83Å; F152-P172 HydrophobicContact CD1-CG 4.45Å; F152-P172 HydrophobicContact CE1-CB 3.98Å; F152-P172 HydrophobicContact CE1-CG 4.1Å; F152-V173 WeakPolarHBondContact CA-O 3.12Å; F152-L174 HydrophobicContact CD1-CB 3.92Å; F152-L174 HydrophobicContact CD1-CD1 4.09Å; F152-L174 HydrophobicContact CD2-CD1 3.96Å; F152-L174 HydrophobicContact CE1-CB 3.71Å; F152-L174 HydrophobicContact CE1-CD1 4.09Å; F152-L174 HydrophobicContact CE1-CG 4.36Å; F152-L174 HydrophobicContact CE2-CD1 3.94Å; F152-L174 HydrophobicContact CG-CD1 4.04Å; F152-L174 HydrophobicContact CZ-CB 4.28Å; F152-L174 HydrophobicContact CZ-CD1 4.01Å; F152-L174 HydrophobicContact CZ-CD2 4.42Å; F152-L174 HydrophobicContact CZ-CG 4.48Å; F152-Y184 HydrophobicContact CE1-CD2 4.22Å; F152-Y184 AromaticContact CE1-CE2 3.86Å; F152-Y184 HydrophobicContact CE1-CE2 3.86Å; F152-Y184 HydrophobicContact CZ-CE2 4.27Å
153	L	96.6	Very high	90.4	Very high	11 Å²	11	63.2 Å²	63.2	6%	0.058	36%	0.358	C	S	.	.			trans	-71.5	160	165.2	-63.5	178.1	0	0	0	110.3	G155 V173 I175 V268 I270 I273	L153-G155 PolarHBondContact O-N 2.91Å; L153-V173 HydrophobicContact CD1-CB 4.09Å; L153-V173 HydrophobicContact CD1-CG1 3.8Å; L153-V173 HydrophobicContact CG-CG1 4.49Å; L153-V173 PolarHBondContact N-O 3.24Å; L153-I175 HydrophobicContact CD2-CD1 3.54Å; L153-I175 HydrophobicContact CD2-CG1 4.32Å; L153-I175 HydrophobicContact CG-CD1 4.1Å; L153-I175 HydrophobicContact CG-CG1 4.34Å; L153-V268 HydrophobicContact CB-CG2 4.27Å; L153-V268 HydrophobicContact CD1-CG1 3.92Å; L153-V268 HydrophobicContact CD1-CG2 3.76Å; L153-I270 HydrophobicContact CD1-CD1 3.43Å; L153-I270 VanDerWaalsContact CD1-CD1 3.43Å; L153-I270 HydrophobicContact CD2-CD1 4.14Å; L153-I270 HydrophobicContact CG-CD1 4.42Å; L153-I273 HydrophobicContact CD2-CG2 4.06Å
154	E	90.3	Very high	91.5	Very high	155 Å²	155	66.8 Å²	66.8	72%	0.724	38%	0.376	S	S	*	.	S	Bend	trans	-62.2	-6.3	179.7	-65.6	-177.7	-177.9	0	0	114.1	N272	E154-N272 PolarHBondContact OE1-ND2 3.33Å
155	G	90.1	Very high	92.5	Very high	20 Å²	20	64.1 Å²	64.1	21%	0.206	35%	0.345	C	S	.	.	S	Bend	trans	-171.1	-172.6	174.5	0	0	0	0	0	114	L153	L153-G155 PolarHBondContact O-N 2.91Å
156	G	94.7	Very high	93.2	Very high	12 Å²	12	59.4 Å²	59.4	12%	0.124	32%	0.322	C	S	.	.			trans	-89.9	-174	173.7	0	0	0	0	0	113.8	R158 S170 G171	G156-R158 PolarHBondContact O-N 2.88Å; G156-S170 WeakPolarHBondContact CA-OG 3.08Å; G156-G171 WeakPolarHBondContact CA-O 3.33Å
157	L	97.6	Very high	93.5	Very high	6 Å²	6	60 Å²	60	3%	0.031	32%	0.316	C	S	.	.			trans	-62.6	115.7	166.3	-72.3	171	0	0	0	109.6	S170 I183 L186 F198 I254 A266 V268	L157-S170 PolarHBondContact N-OG 2.83Å; L157-I183 HydrophobicContact CD1-CD1 3.97Å; L157-I183 HydrophobicContact CD1-CG2 4.26Å; L157-L186 HydrophobicContact CD1-CD1 4.06Å; L157-F198 HydrophobicContact CD1-CE1 3.8Å; L157-I254 WeakPolarHBondContact CD2-O 3.45Å; L157-A266 HydrophobicContact CB-CB 4.15Å; L157-V268 HydrophobicContact CD2-CB 4.38Å; L157-V268 HydrophobicContact CD2-CG1 4.08Å
158	R	95.2	Very high	93.8	Very high	180 Å²	180	59.1 Å²	59.1	68%	0.679	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	124.8	178	-62.2	-171	-179.6	-158.3	1.6	110	G156 A266 H267	G156-R158 PolarHBondContact O-N 2.88Å; R158-A266 WeakPolarHBondContact O-CA 3.42Å; R158-A266 VanDerWaalsContact O-CB 3.27Å; R158-A266 WeakPolarHBondContact O-CB 3.36Å; R158-H267 PolarHBondContact N-O 2.98Å; R158-H267 PolarHBondContact O-N 2.68Å; R158-H267 VanDerWaalsContact O-N 3.1Å
159	A	96.8	Very high	93.8	Very high	35 Å²	35	59.8 Å²	59.8	29%	0.289	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	136.7	177.9	0	0	0	0	0	111.6	M164 V168	A159-M164 HydrophobicContact CB-CG 3.76Å; A159-M164 HydrophobicContact CB-SD 3.76Å; A159-V168 VanDerWaalsContact CB-O 3.28Å; A159-V168 WeakPolarHBondContact CB-O 3.39Å
160	T	95.9	Very high	94	Very high	36 Å²	36	57.4 Å²	57.4	22%	0.221	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-79.8	169	158.4	73.8	0	0	0	0	109.1	K162 G163 M164 N264 F265	T160-K162 PolarHBondContact O-N 3.14Å; T160-K162 VanDerWaalsContact O-N 3.17Å; T160-K162 PolarHBondContact OG1-N 3.41Å; T160-G163 PolarHBondContact O-N 3.24Å; T160-G163 PolarHBondContact OG1-N 2.87Å; T160-M164 WeakPolarHBondContact O-CG 3.33Å; T160-M164 PolarHBondContact O-N 3.26Å; T160-N264 HydrophobicContact CG2-CB 4.4Å; T160-N264 WeakPolarHBondContact CG2-O 3.33Å; T160-N264 PolarHBondContact OG1-O 2.96Å; T160-F265 PolarHBondContact N-O 3.22Å; T160-F265 PolarHBondContact OG1-O 3.24Å
161	S	90.2	Very high	93.9	Very high	105 Å²	105	56.4 Å²	56.4	73%	0.734	30%	0.297	S	S	*	.	H	α-helix	trans	-53.7	-35.7	172.4	54.6	0	0	0	0	112.5
162	K	89	Confident	93.9	Very high	85 Å²	85	57.2 Å²	57.2	37%	0.37	31%	0.307	S	S	.	.	H	α-helix	trans	-74.9	-25.4	176.8	-63.6	-174.6	176.7	-169.2	0	113.3	T160 R165 V263 F265	T160-K162 PolarHBondContact O-N 3.14Å; T160-K162 VanDerWaalsContact O-N 3.17Å; T160-K162 PolarHBondContact OG1-N 3.41Å; K162-R165 WeakPolarHBondContact O-CD 3.47Å; K162-R165 WeakPolarHBondContact O-CG 3.48Å; K162-V263 HydrophobicContact CB-CG1 3.7Å; K162-V263 HydrophobicContact CD-CB 4.33Å; K162-V263 HydrophobicContact CD-CG1 3.37Å; K162-V263 HydrophobicContact CD-CG2 3.95Å; K162-V263 HydrophobicContact CG-CG1 4.17Å; K162-F265 HydrophobicContact CB-CD1 4.5Å
163	G	91.4	Very high	93.9	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-82.2	-29.4	173.4	0	0	0	0	0	114.5	T160 R165 Y166 N167 V168 F265	T160-G163 PolarHBondContact O-N 3.24Å; T160-G163 PolarHBondContact OG1-N 2.87Å; G163-R165 PolarHBondContact O-N 3.31Å; G163-Y166 CarbonylContact O-C 3.4Å; G163-Y166 WeakPolarHBondContact O-CA 3.29Å; G163-Y166 PolarHBondContact O-N 3.07Å; G163-N167 PolarHBondContact O-N 3.46Å; G163-V168 WeakPolarHBondContact O-CG2 3.33Å; G163-V168 PolarHBondContact O-N 2.92Å; G163-F265 VanDerWaalsContact CA-O 3.26Å; G163-F265 WeakPolarHBondContact CA-O 3.27Å
164	M	92.2	Very high	94	Very high	134 Å²	134	52.7 Å²	52.7	66%	0.66	29%	0.287	S	S	*	.	H	α-helix	trans	-56.7	-36.4	-178.9	-73.7	-79.7	-78.7	0	0	113	A159 T160 Y166 N167	A159-M164 HydrophobicContact CB-CG 3.76Å; A159-M164 HydrophobicContact CB-SD 3.76Å; T160-M164 WeakPolarHBondContact O-CG 3.33Å; T160-M164 PolarHBondContact O-N 3.26Å; M164-Y166 PolarHBondContact O-N 2.7Å; M164-Y166 VanDerWaalsContact O-N 3.16Å; M164-N167 PolarHBondContact O-N 2.72Å
165	R	88.9	Confident	94.3	Very high	81 Å²	81	45.3 Å²	45.3	31%	0.306	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-17.4	174.8	45	-176.3	-89.9	-152.3	-2.2	114.3	K162 G163 D392	K162-R165 WeakPolarHBondContact O-CD 3.47Å; K162-R165 WeakPolarHBondContact O-CG 3.48Å; G163-R165 PolarHBondContact O-N 3.31Å; R165-D392 IonicContact NH1-OD2 3.51Å; R165-D392 IonicContact NH2-OD2 2.76Å
166	Y	91.4	Very high	94.6	Very high	9 Å²	9	47.4 Å²	47.4	4%	0.035	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	20.3	174.7	-56.1	-64.6	0	0	0	112.3	G163 M164 V168 F188 D189 R192 A193 P194 F265	G163-Y166 CarbonylContact O-C 3.4Å; G163-Y166 WeakPolarHBondContact O-CA 3.29Å; G163-Y166 PolarHBondContact O-N 3.07Å; M164-Y166 PolarHBondContact O-N 2.7Å; M164-Y166 VanDerWaalsContact O-N 3.16Å; Y166-V168 PolarHBondContact O-N 2.85Å; Y166-F188 HydrophobicContact CG-CE2 4.39Å; Y166-D189 PolarHBondContact O-N 2.76Å; Y166-R192 HydrophobicContact CD1-CB 4.27Å; Y166-R192 HydrophobicContact CE1-CB 4.3Å; Y166-R192 WeakPolarHBondContact CE1-O 3.22Å; Y166-A193 HydrophobicContact CD1-CB 3.85Å; Y166-A193 HydrophobicContact CD2-CB 4.32Å; Y166-A193 HydrophobicContact CE1-CB 4.04Å; Y166-A193 HydrophobicContact CE2-CB 4.49Å; Y166-A193 HydrophobicContact CG-CB 3.99Å; Y166-P194 WeakPolarHBondContact OH-CD 3.28Å; Y166-F265 HydrophobicContact CD2-CD1 4.42Å; Y166-F265 HydrophobicContact CD2-CD2 4.41Å; Y166-F265 HydrophobicContact CD2-CE1 4.01Å; Y166-F265 AromaticContact CD2-CE2 3.95Å; Y166-F265 HydrophobicContact CD2-CE2 3.95Å; Y166-F265 AromaticContact CD2-CZ 3.74Å; Y166-F265 HydrophobicContact CD2-CZ 3.74Å; Y166-F265 AromaticContact CE2-CE1 3.79Å; Y166-F265 HydrophobicContact CE2-CE1 3.79Å; Y166-F265 HydrophobicContact CE2-CE2 4.12Å; Y166-F265 AromaticContact CE2-CZ 3.49Å; Y166-F265 HydrophobicContact CE2-CZ 3.49Å; Y166-F265 VanDerWaalsContact CE2-CZ 3.49Å
167	N	93.8	Very high	94.6	Very high	87 Å²	87	47.8 Å²	47.8	47%	0.465	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	35.1	178.2	-167	33.2	0	0	0	113.9	G163 M164 G169 T187	G163-N167 PolarHBondContact O-N 3.46Å; M164-N167 PolarHBondContact O-N 2.72Å; N167-G169 PolarHBondContact O-N 3.39Å; N167-T187 CarbonylContact O-C 3.57Å; N167-T187 WeakPolarHBondContact O-CB 3.35Å; N167-T187 PolarHBondContact O-OG1 3.23Å
168	V	96.5	Very high	94.5	Very high	7 Å²	7	50.3 Å²	50.3	4%	0.042	27%	0.266	C	S	.	.			trans	-73.3	126.1	-174	-174.9	0	0	0	0	109.6	A159 G163 Y166 T187 F188 L256 F265 A266	A159-V168 VanDerWaalsContact CB-O 3.28Å; A159-V168 WeakPolarHBondContact CB-O 3.39Å; G163-V168 WeakPolarHBondContact O-CG2 3.33Å; G163-V168 PolarHBondContact O-N 2.92Å; Y166-V168 PolarHBondContact O-N 2.85Å; V168-T187 CarbonylContact C-O 3.05Å; V168-T187 VanDerWaalsContact CA-O 3.28Å; V168-T187 WeakPolarHBondContact CA-O 3.37Å; V168-F188 HydrophobicContact CB-CD2 4.43Å; V168-F188 HydrophobicContact CG2-CD2 3.38Å; V168-F188 HydrophobicContact CG2-CE2 3.72Å; V168-F188 HydrophobicContact CG2-CG 4.41Å; V168-L256 HydrophobicContact CB-CD2 4.49Å; V168-L256 HydrophobicContact CG1-CB 4.37Å; V168-L256 HydrophobicContact CG1-CD2 3.57Å; V168-L256 HydrophobicContact CG2-CD2 4.06Å; V168-F265 HydrophobicContact CG2-CB 4.07Å; V168-A266 HydrophobicContact CB-CB 4.25Å; V168-A266 HydrophobicContact CG1-CB 3.33Å
169	G	95.7	Very high	94.5	Very high	13 Å²	13	44 Å²	44	13%	0.134	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-171.1	170.3	175	0	0	0	0	0	111	N167 L186 T187	N167-G169 PolarHBondContact O-N 3.39Å; G169-L186 WeakPolarHBondContact O-CD1 3.36Å; G169-T187 WeakPolarHBondContact CA-OG1 3.19Å; G169-T187 PolarHBondContact N-O 2.91Å; G169-T187 PolarHBondContact N-OG1 3.34Å; G169-T187 PolarHBondContact O-N 3.36Å; G169-T187 PolarHBondContact O-OG1 2.85Å
170	S	97.8	Very high	94.5	Very high	27 Å²	27	42.4 Å²	42.4	19%	0.189	23%	0.229	C	C	.	.			trans	-149.4	162.7	169.2	76	0	0	0	0	111.3	G156 L157 G185	G156-S170 WeakPolarHBondContact CA-OG 3.08Å; L157-S170 PolarHBondContact N-OG 2.83Å; S170-G185 WeakPolarHBondContact CA-O 3.47Å
171	G	94.1	Very high	94.6	Very high	28 Å²	28	40.7 Å²	40.7	29%	0.289	22%	0.219	S	C	.	.	S	Bend	trans	-64.5	-165.1	155.4	0	0	0	0	0	112.3	G156 Y184 G185	G156-G171 WeakPolarHBondContact CA-O 3.33Å; G171-Y184 VanDerWaalsContact CA-O 3.27Å; G171-Y184 WeakPolarHBondContact CA-O 3.33Å; G171-Y184 PolarHBondContact N-O 3.25Å; G171-G185 PolarHBondContact N-O 3.45Å
172	P	95.7	Very high	94.9	Very high	65 Å²	65	37.6 Å²	37.6	42%	0.422	19%	0.192	S	C	.	.			trans	-61.8	156.9	-176.8	27.7	-35.7	0	0	0	112.3	F152 Y184	F152-P172 HydrophobicContact CD1-CB 3.83Å; F152-P172 HydrophobicContact CD1-CG 4.45Å; F152-P172 HydrophobicContact CE1-CB 3.98Å; F152-P172 HydrophobicContact CE1-CG 4.1Å; P172-Y184 HydrophobicContact CG-CD2 4.41Å; P172-Y184 HydrophobicContact CG-CG 4.46Å; P172-Y184 WeakPolarHBondContact O-CB 3.46Å; P172-Y184 WeakPolarHBondContact O-CD2 3.12Å; P172-Y184 PolarHBondContact O-N 3.25Å; P172-Y184 VanDerWaalsContact O-N 3.1Å
173	V	98.3	Very high	95.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	124.8	176.5	175.8	0	0	0	0	109.2	F152 L153 V181 K182 I183 V268	F152-V173 WeakPolarHBondContact CA-O 3.12Å; L153-V173 HydrophobicContact CD1-CB 4.09Å; L153-V173 HydrophobicContact CD1-CG1 3.8Å; L153-V173 HydrophobicContact CG-CG1 4.49Å; L153-V173 PolarHBondContact N-O 3.24Å; V173-V181 HydrophobicContact CG1-CG1 3.35Å; V173-K182 WeakPolarHBondContact CA-O 3.28Å; V173-I183 HydrophobicContact CG2-CG1 4.17Å; V173-I183 HydrophobicContact CG2-CG2 4.48Å; V173-V268 HydrophobicContact CG2-CG1 4.35Å
174	L	97.7	Very high	95.6	Very high	21 Å²	21	36.7 Å²	36.7	11%	0.11	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	119.3	-178.9	178.1	66.6	0	0	0	110.1	A150 F152 M176 V181 K182 Y184	A150-L174 HydrophobicContact CB-CD1 3.98Å; F152-L174 HydrophobicContact CD1-CB 3.92Å; F152-L174 HydrophobicContact CD1-CD1 4.09Å; F152-L174 HydrophobicContact CD2-CD1 3.96Å; F152-L174 HydrophobicContact CE1-CB 3.71Å; F152-L174 HydrophobicContact CE1-CD1 4.09Å; F152-L174 HydrophobicContact CE1-CG 4.36Å; F152-L174 HydrophobicContact CE2-CD1 3.94Å; F152-L174 HydrophobicContact CG-CD1 4.04Å; F152-L174 HydrophobicContact CZ-CB 4.28Å; F152-L174 HydrophobicContact CZ-CD1 4.01Å; F152-L174 HydrophobicContact CZ-CD2 4.42Å; F152-L174 HydrophobicContact CZ-CG 4.48Å; L174-M176 HydrophobicContact CD2-CG 3.97Å; L174-M176 HydrophobicContact CG-CG 4.09Å; L174-M176 PolarHBondContact O-N 2.6Å; L174-V181 CarbonylContact O-C 3.51Å; L174-V181 WeakPolarHBondContact O-CA 3.17Å; L174-K182 HydrophobicContact CB-CB 4.33Å; L174-K182 PolarHBondContact N-O 2.87Å; L174-K182 PolarHBondContact O-N 3.46Å; L174-Y184 HydrophobicContact CB-CE2 3.81Å; L174-Y184 HydrophobicContact CD2-CE2 4.22Å
175	I	97.9	Very high	95.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	102.8	163.7	-60.7	163.5	0	0	0	106.5	A150 Q151 L153 D177 I248 I273 I277	A150-I175 CarbonylContact C-O 3.53Å; A150-I175 VanDerWaalsContact CA-O 3.27Å; A150-I175 WeakPolarHBondContact CA-O 3.48Å; A150-I175 VanDerWaalsContact CB-O 3.29Å; A150-I175 WeakPolarHBondContact CB-O 3.47Å; Q151-I175 PolarHBondContact N-O 3.21Å; Q151-I175 WeakPolarHBondContact O-CB 3.29Å; Q151-I175 PolarHBondContact O-N 3.3Å; L153-I175 HydrophobicContact CD2-CD1 3.54Å; L153-I175 HydrophobicContact CD2-CG1 4.32Å; L153-I175 HydrophobicContact CG-CD1 4.1Å; L153-I175 HydrophobicContact CG-CG1 4.34Å; I175-D177 VanDerWaalsContact CG2-O 3.31Å; I175-D177 WeakPolarHBondContact CG2-O 3.37Å; I175-I248 HydrophobicContact CD1-CD1 3.96Å; I175-I248 HydrophobicContact CD1-CG1 3.54Å; I175-I248 HydrophobicContact CG1-CD1 3.97Å; I175-I248 HydrophobicContact CG1-CG1 3.86Å; I175-I248 HydrophobicContact CG2-CB 4.33Å; I175-I248 HydrophobicContact CG2-CG1 3.92Å; I175-I248 HydrophobicContact CG2-CG2 4.24Å; I175-I273 HydrophobicContact CD1-CG2 3.58Å; I175-I277 HydrophobicContact CG2-CD1 4.22Å; I175-I277 HydrophobicContact CG2-CG1 4.42Å; I175-I277 HydrophobicContact CG2-CG2 3.64Å
176	M	95.1	Very high	96.1	Very high	65 Å²	65	27.3 Å²	27.3	32%	0.32	15%	0.149	S	C	.	.			trans	-75.6	-42.4	179.9	-62.3	-177.8	67.1	0	0	110.6	L174 T180 K182	L174-M176 HydrophobicContact CD2-CG 3.97Å; L174-M176 HydrophobicContact CG-CG 4.09Å; L174-M176 PolarHBondContact O-N 2.6Å; M176-T180 HydrophobicContact CB-CG2 4.28Å; M176-T180 WeakPolarHBondContact CB-O 3.45Å; M176-T180 PolarHBondContact N-O 2.9Å; M176-T180 HydrophobicContact SD-CG2 3.93Å; M176-K182 HydrophobicContact CG-CB 4.09Å; M176-K182 HydrophobicContact SD-CB 3.77Å; M176-K182 HydrophobicContact SD-CD 4.49Å
177	D	95.5	Very high	96.4	Very high	20 Å²	20	28.6 Å²	28.6	11%	0.107	16%	0.158	C	C	.	.	S	Bend	trans	-153.1	-178.1	175.8	68.1	56.9	0	0	0	109.7	I175 R179 T180 P278 P279	I175-D177 VanDerWaalsContact CG2-O 3.31Å; I175-D177 WeakPolarHBondContact CG2-O 3.37Å; D177-R179 PolarHBondContact O-N 3.42Å; D177-R179 WeakPolarHBondContact OD1-CA 3.21Å; D177-R179 PolarHBondContact OD1-N 3.13Å; D177-T180 VanDerWaalsContact CG-CB 3.49Å; D177-T180 VanDerWaalsContact CG-OG1 3.28Å; D177-T180 PolarHBondContact N-O 3.13Å; D177-T180 PolarHBondContact O-N 3.19Å; D177-T180 WeakPolarHBondContact OD1-CB 3.41Å; D177-T180 PolarHBondContact OD1-N 3.17Å; D177-T180 PolarHBondContact OD1-OG1 3.44Å; D177-T180 WeakPolarHBondContact OD2-CB 3.49Å; D177-T180 PolarHBondContact OD2-OG1 2.88Å; D177-P278 CarbonylContact C-O 3.57Å; D177-P278 WeakPolarHBondContact CA-O 3.43Å; D177-P278 HydrophobicContact CB-CB 4.1Å; D177-P278 WeakPolarHBondContact CB-O 3.42Å; D177-P279 WeakPolarHBondContact CB-O 3.4Å
178	R	95.6	Very high	96.5	Very high	58 Å²	58	24.4 Å²	24.4	22%	0.219	14%	0.136	C	C	.	.	S	Bend	trans	-57.6	-17.6	-177.6	-77.2	175.9	-172.7	-145.9	-6.9	115.1	N247 I248 Y249 I277 P278	R178-N247 HydrophobicContact CB-CB 4.28Å; R178-N247 CarbonylContact O-C 3.55Å; R178-N247 WeakPolarHBondContact O-CA 2.96Å; R178-N247 VanDerWaalsContact O-CB 3.29Å; R178-N247 WeakPolarHBondContact O-CB 3.21Å; R178-I248 PolarHBondContact O-N 2.99Å; R178-Y249 HydrophobicContact CG-CD2 4.27Å; R178-Y249 HydrophobicContact CG-CE2 3.79Å; R178-I277 HydrophobicContact CG-CB 4.46Å; R178-I277 HydrophobicContact CG-CG2 4.15Å; R178-I277 PolarHBondContact NE-O 3.21Å; R178-P278 WeakPolarHBondContact CG-O 3.39Å; R178-P278 PolarHBondContact N-O 2.9Å
179	R	95.1	Very high	96.2	Very high	47 Å²	47	25.1 Å²	25.1	18%	0.177	14%	0.139	C	C	.	.	S	Bend	trans	-133.6	-5.7	-179.2	-65	178.2	53	-146.3	-13.9	114.3	D177 L242 P244 H246 N247 Y280	D177-R179 PolarHBondContact O-N 3.42Å; D177-R179 WeakPolarHBondContact OD1-CA 3.21Å; D177-R179 PolarHBondContact OD1-N 3.13Å; R179-L242 HydrophobicContact CB-CB 4.15Å; R179-L242 HydrophobicContact CG-CB 4.47Å; R179-L242 PolarHBondContact NE-O 3.26Å; R179-L242 PolarHBondContact NH2-O 2.84Å; R179-L242 WeakPolarHBondContact O-CD1 3.4Å; R179-L242 PolarHBondContact O-N 3.08Å; R179-P244 VanDerWaalsContact CZ-CA 3.49Å; R179-H246 VanDerWaalsContact CG-O 3.31Å; R179-H246 WeakPolarHBondContact CG-O 3.2Å; R179-N247 HydrophobicContact CG-CB 4.28Å; R179-Y280 HydrophobicContact CB-CD2 3.65Å; R179-Y280 HydrophobicContact CB-CE2 4.37Å; R179-Y280 HydrophobicContact CB-CG 3.89Å; R179-Y280 HydrophobicContact CG-CG 4.32Å; R179-Y280 VanDerWaalsContact NH1-CD1 3.32Å
180	T	96.2	Very high	95.8	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.012	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.3	179.2	-49.3	0	0	0	0	110.2	M176 D177 I239 L240	M176-T180 HydrophobicContact CB-CG2 4.28Å; M176-T180 WeakPolarHBondContact CB-O 3.45Å; M176-T180 PolarHBondContact N-O 2.9Å; M176-T180 HydrophobicContact SD-CG2 3.93Å; D177-T180 VanDerWaalsContact CG-CB 3.49Å; D177-T180 VanDerWaalsContact CG-OG1 3.28Å; D177-T180 PolarHBondContact N-O 3.13Å; D177-T180 PolarHBondContact O-N 3.19Å; D177-T180 WeakPolarHBondContact OD1-CB 3.41Å; D177-T180 PolarHBondContact OD1-N 3.17Å; D177-T180 PolarHBondContact OD1-OG1 3.44Å; D177-T180 WeakPolarHBondContact OD2-CB 3.49Å; D177-T180 PolarHBondContact OD2-OG1 2.88Å; T180-I239 HydrophobicContact CG2-CG2 3.49Å; T180-I239 VanDerWaalsContact CG2-CG2 3.49Å; T180-L240 WeakPolarHBondContact CA-O 3.22Å
181	V	98	Very high	94.9	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	131.9	178.4	179.4	0	0	0	0	109.2	V173 L174 I239 L240 L242 I248 I254	V173-V181 HydrophobicContact CG1-CG1 3.35Å; L174-V181 CarbonylContact O-C 3.51Å; L174-V181 WeakPolarHBondContact O-CA 3.17Å; V181-I239 CarbonylContact O-C 3.5Å; V181-I239 WeakPolarHBondContact O-CA 3.46Å; V181-L240 HydrophobicContact CB-CB 4.47Å; V181-L240 PolarHBondContact N-O 2.97Å; V181-L240 PolarHBondContact O-N 3.17Å; V181-L242 HydrophobicContact CG2-CD1 4.14Å; V181-I248 HydrophobicContact CG2-CD1 4.28Å; V181-I254 HydrophobicContact CB-CD1 4.19Å; V181-I254 HydrophobicContact CG1-CD1 3.75Å; V181-I254 HydrophobicContact CG2-CD1 3.87Å
182	K	97.6	Very high	94.2	Very high	41 Å²	41	32 Å²	32	18%	0.178	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	126.2	174.1	-176.9	173.1	177.9	-172.2	0	110.4	V173 L174 M176 Y184 D237 L238 I239	V173-K182 WeakPolarHBondContact CA-O 3.28Å; L174-K182 HydrophobicContact CB-CB 4.33Å; L174-K182 PolarHBondContact N-O 2.87Å; L174-K182 PolarHBondContact O-N 3.46Å; M176-K182 HydrophobicContact CG-CB 4.09Å; M176-K182 HydrophobicContact SD-CB 3.77Å; M176-K182 HydrophobicContact SD-CD 4.49Å; K182-Y184 HydrophobicContact CB-CE2 4.3Å; K182-Y184 HydrophobicContact CD-CD2 4.49Å; K182-Y184 HydrophobicContact CD-CE1 4.12Å; K182-Y184 HydrophobicContact CD-CE2 3.78Å; K182-Y184 HydrophobicContact CG-CD2 4.19Å; K182-Y184 HydrophobicContact CG-CE2 3.83Å; K182-Y184 VanDerWaalsContact NZ-CE1 3.35Å; K182-D237 VanDerWaalsContact CE-CG 3.47Å; K182-D237 WeakPolarHBondContact CE-OD2 3.48Å; K182-D237 IonicContact NZ-OD2 2.85Å; K182-D237 PolarHBondContact NZ-OD2 2.97Å; K182-L238 CarbonylContact C-O 3.58Å; K182-L238 WeakPolarHBondContact CA-O 3.34Å; K182-I239 HydrophobicContact CB-CG1 4.4Å; K182-I239 HydrophobicContact CD-CG1 4.41Å; K182-I239 HydrophobicContact CG-CG1 4.18Å
183	I	98.4	Very high	93.7	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118.7	173.5	-61.4	170	0	0	0	107.2	L157 V173 F198 D237 L238 L240	L157-I183 HydrophobicContact CD1-CD1 3.97Å; L157-I183 HydrophobicContact CD1-CG2 4.26Å; V173-I183 HydrophobicContact CG2-CG1 4.17Å; V173-I183 HydrophobicContact CG2-CG2 4.48Å; I183-F198 HydrophobicContact CD1-CD1 3.97Å; I183-F198 HydrophobicContact CD1-CE1 3.41Å; I183-F198 VanDerWaalsContact CD1-CE1 3.41Å; I183-F198 HydrophobicContact CD1-CZ 3.7Å; I183-D237 CarbonylContact O-C 3.56Å; I183-D237 VanDerWaalsContact O-CA 3.32Å; I183-D237 WeakPolarHBondContact O-CA 3.43Å; I183-L238 PolarHBondContact N-O 2.93Å; I183-L238 PolarHBondContact O-N 3.19Å; I183-L240 HydrophobicContact CD1-CD1 3.52Å; I183-L240 HydrophobicContact CD1-CD2 4.43Å; I183-L240 HydrophobicContact CD1-CG 3.94Å; I183-L240 HydrophobicContact CG1-CD1 4.39Å
184	Y	96.1	Very high	92.9	Very high	65 Å²	65	29 Å²	29	26%	0.255	14%	0.136	S	C	.	.			trans	-86.2	136	178.8	-72.8	-96.2	0	0	0	111.3	F152 G171 P172 L174 K182 L186 D237	F152-Y184 HydrophobicContact CE1-CD2 4.22Å; F152-Y184 AromaticContact CE1-CE2 3.86Å; F152-Y184 HydrophobicContact CE1-CE2 3.86Å; F152-Y184 HydrophobicContact CZ-CE2 4.27Å; G171-Y184 VanDerWaalsContact CA-O 3.27Å; G171-Y184 WeakPolarHBondContact CA-O 3.33Å; G171-Y184 PolarHBondContact N-O 3.25Å; P172-Y184 HydrophobicContact CG-CD2 4.41Å; P172-Y184 HydrophobicContact CG-CG 4.46Å; P172-Y184 WeakPolarHBondContact O-CB 3.46Å; P172-Y184 WeakPolarHBondContact O-CD2 3.12Å; P172-Y184 PolarHBondContact O-N 3.25Å; P172-Y184 VanDerWaalsContact O-N 3.1Å; L174-Y184 HydrophobicContact CB-CE2 3.81Å; L174-Y184 HydrophobicContact CD2-CE2 4.22Å; K182-Y184 HydrophobicContact CB-CE2 4.3Å; K182-Y184 HydrophobicContact CD-CD2 4.49Å; K182-Y184 HydrophobicContact CD-CE1 4.12Å; K182-Y184 HydrophobicContact CD-CE2 3.78Å; K182-Y184 HydrophobicContact CG-CD2 4.19Å; K182-Y184 HydrophobicContact CG-CE2 3.83Å; K182-Y184 VanDerWaalsContact NZ-CE1 3.35Å; Y184-L186 PolarHBondContact O-N 3.29Å; Y184-D237 VanDerWaalsContact CA-OD1 3.26Å; Y184-D237 WeakPolarHBondContact CA-OD1 3.15Å; Y184-D237 VanDerWaalsContact CD1-OD2 3.28Å; Y184-D237 WeakPolarHBondContact CD1-OD2 3.18Å; Y184-D237 WeakPolarHBondContact CE1-OD2 3.32Å
185	G	95.2	Very high	92.3	Very high	17 Å²	17	28.8 Å²	28.8	18%	0.175	14%	0.135	C	C	.	.	S	Bend	trans	45.8	66.1	172.7	0	0	0	0	0	115.1	S170 G171 T187 G234 D237	S170-G185 WeakPolarHBondContact CA-O 3.47Å; G171-G185 PolarHBondContact N-O 3.45Å; G185-T187 PolarHBondContact O-N 2.97Å; G185-G234 WeakPolarHBondContact CA-O 3.43Å; G185-D237 PolarHBondContact N-OD1 2.77Å
186	L	97.4	Very high	92	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	14%	0.135	C	C	.	.			trans	-67.2	129.6	175.1	-178.4	78.5	0	0	0	110.5	L157 G169 Y184 F188 F198 L228 Y232 G234 K236 L238	L157-L186 HydrophobicContact CD1-CD1 4.06Å; G169-L186 WeakPolarHBondContact O-CD1 3.36Å; Y184-L186 PolarHBondContact O-N 3.29Å; L186-F188 HydrophobicContact CD2-CB 4.16Å; L186-F188 HydrophobicContact CG-CB 4.26Å; L186-F198 HydrophobicContact CD1-CZ 4.29Å; L186-F198 HydrophobicContact CD2-CZ 4.08Å; L186-L228 HydrophobicContact CD2-CD2 4.12Å; L186-Y232 HydrophobicContact CD2-CD1 3.91Å; L186-Y232 HydrophobicContact CD2-CD2 4.14Å; L186-Y232 HydrophobicContact CD2-CE1 4.38Å; L186-Y232 HydrophobicContact CD2-CG 3.79Å; L186-Y232 HydrophobicContact CG-CG 4.49Å; L186-Y232 WeakPolarHBondContact O-CB 3.42Å; L186-G234 VanDerWaalsContact O-CA 3.25Å; L186-G234 WeakPolarHBondContact O-CA 3.45Å; L186-G234 PolarHBondContact O-N 3.34Å; L186-K236 PolarHBondContact N-O 2.83Å; L186-L238 HydrophobicContact CB-CD1 4.38Å; L186-L238 HydrophobicContact CD2-CD1 3.6Å
187	T	96.8	Very high	92.1	Very high	36 Å²	36	26.2 Å²	26.2	22%	0.221	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	129.2	161.5	62.8	0	0	0	0	109	N167 V168 G169 G185 Y232	N167-T187 CarbonylContact O-C 3.57Å; N167-T187 WeakPolarHBondContact O-CB 3.35Å; N167-T187 PolarHBondContact O-OG1 3.23Å; V168-T187 CarbonylContact C-O 3.05Å; V168-T187 VanDerWaalsContact CA-O 3.28Å; V168-T187 WeakPolarHBondContact CA-O 3.37Å; G169-T187 WeakPolarHBondContact CA-OG1 3.19Å; G169-T187 PolarHBondContact N-O 2.91Å; G169-T187 PolarHBondContact N-OG1 3.34Å; G169-T187 PolarHBondContact O-N 3.36Å; G169-T187 PolarHBondContact O-OG1 2.85Å; G185-T187 PolarHBondContact O-N 2.97Å; T187-Y232 CarbonylContact C-O 2.99Å; T187-Y232 VanDerWaalsContact CA-O 3.29Å; T187-Y232 WeakPolarHBondContact CA-O 3.49Å
188	F	95.6	Very high	92.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.3	126.3	178.5	177	-136.1	0	0	0	111.6	Y166 V168 L186 G190 A193 L228 Y232 L256 F265	Y166-F188 HydrophobicContact CG-CE2 4.39Å; V168-F188 HydrophobicContact CB-CD2 4.43Å; V168-F188 HydrophobicContact CG2-CD2 3.38Å; V168-F188 HydrophobicContact CG2-CE2 3.72Å; V168-F188 HydrophobicContact CG2-CG 4.41Å; L186-F188 HydrophobicContact CD2-CB 4.16Å; L186-F188 HydrophobicContact CG-CB 4.26Å; F188-G190 PolarHBondContact O-N 2.88Å; F188-A193 HydrophobicContact CE1-CB 4.41Å; F188-A193 HydrophobicContact CE2-CB 3.64Å; F188-A193 HydrophobicContact CZ-CB 3.36Å; F188-L228 HydrophobicContact CD1-CB 4.18Å; F188-L228 HydrophobicContact CD1-CD2 4.38Å; F188-L228 HydrophobicContact CE1-CB 3.8Å; F188-Y232 HydrophobicContact CB-CD2 4.13Å; F188-Y232 HydrophobicContact CD1-CD2 4.06Å; F188-Y232 HydrophobicContact CD1-CE2 4.33Å; F188-Y232 PolarHBondContact N-O 3.37Å; F188-Y232 PolarHBondContact O-N 3.21Å; F188-L256 HydrophobicContact CB-CD2 4.4Å; F188-L256 HydrophobicContact CD1-CD2 3.83Å; F188-L256 HydrophobicContact CD2-CD2 3.76Å; F188-L256 HydrophobicContact CE1-CD1 4.49Å; F188-L256 HydrophobicContact CE1-CD2 3.92Å; F188-L256 HydrophobicContact CE2-CD2 3.83Å; F188-L256 HydrophobicContact CG-CD2 3.74Å; F188-L256 HydrophobicContact CZ-CD2 3.9Å; F188-F265 HydrophobicContact CE2-CD2 4.19Å; F188-F265 HydrophobicContact CE2-CE2 4.4Å; F188-F265 HydrophobicContact CZ-CD2 4.36Å; F188-F265 HydrophobicContact CZ-CE2 4.4Å
189	D	90.2	Very high	92.3	Very high	21 Å²	21	22.6 Å²	22.6	11%	0.112	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	58.4	174.7	-58.1	-21.7	0	0	0	111.1	Y166 N191 R192 A193 L231	Y166-D189 PolarHBondContact O-N 2.76Å; D189-N191 PolarHBondContact O-N 2.82Å; D189-N191 VanDerWaalsContact O-N 3.13Å; D189-R192 PolarHBondContact O-N 2.96Å; D189-R192 IonicContact OD2-CZ 3.82Å; D189-R192 IonicContact OD2-NE 3.5Å; D189-R192 IonicContact OD2-NH2 3.46Å; D189-R192 PolarHBondContact OD2-NH2 2.81Å; D189-A193 PolarHBondContact O-N 3.46Å; D189-L231 HydrophobicContact CB-CD1 4.38Å; D189-L231 VanDerWaalsContact OD1-CD1 3.23Å; D189-L231 WeakPolarHBondContact OD1-CD1 3.39Å
190	G	86.9	Confident	92.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-22.9	-175.6	0	0	0	0	0	114.1	F188 R192 A193 K229 E230	F188-G190 PolarHBondContact O-N 2.88Å; G190-R192 PolarHBondContact O-N 2.98Å; G190-A193 PolarHBondContact O-N 2.76Å; G190-K229 CarbonylContact C-O 3.57Å; G190-K229 WeakPolarHBondContact O-CA 3.48Å; G190-E230 VanDerWaalsContact CA-O 3.25Å; G190-E230 WeakPolarHBondContact CA-O 3.24Å; G190-E230 PolarHBondContact N-O 2.87Å; G190-E230 VanDerWaalsContact N-O 3.15Å
191	N	80.3	Confident	92.5	Very high	89 Å²	89	20.4 Å²	20.4	48%	0.476	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-18.2	173.9	65.6	-30.6	0	0	0	113.8	D189 K229	D189-N191 PolarHBondContact O-N 2.82Å; D189-N191 VanDerWaalsContact O-N 3.13Å; N191-K229 WeakPolarHBondContact CA-O 3.38Å; N191-K229 WeakPolarHBondContact CB-O 3.46Å; N191-K229 PolarHBondContact N-O 3.31Å
192	R	79.6	Confident	92.3	Very high	125 Å²	125	26.1 Å²	26.1	47%	0.472	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-18.4	175.1	-57.6	-166.9	-65.1	158.8	-0.5	112.6	Y166 D189 G190	Y166-R192 HydrophobicContact CD1-CB 4.27Å; Y166-R192 HydrophobicContact CE1-CB 4.3Å; Y166-R192 WeakPolarHBondContact CE1-O 3.22Å; D189-R192 PolarHBondContact O-N 2.96Å; D189-R192 IonicContact OD2-CZ 3.82Å; D189-R192 IonicContact OD2-NE 3.5Å; D189-R192 IonicContact OD2-NH2 3.46Å; D189-R192 PolarHBondContact OD2-NH2 2.81Å; G190-R192 PolarHBondContact O-N 2.98Å
193	A	83.6	Confident	92.2	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.008	13%	0.129	C	C	.	.	S	Bend	trans	-80.2	148.5	-175.5	0	0	0	0	0	112.4	Y166 F188 D189 G190 F265	Y166-A193 HydrophobicContact CD1-CB 3.85Å; Y166-A193 HydrophobicContact CD2-CB 4.32Å; Y166-A193 HydrophobicContact CE1-CB 4.04Å; Y166-A193 HydrophobicContact CE2-CB 4.49Å; Y166-A193 HydrophobicContact CG-CB 3.99Å; F188-A193 HydrophobicContact CE1-CB 4.41Å; F188-A193 HydrophobicContact CE2-CB 3.64Å; F188-A193 HydrophobicContact CZ-CB 3.36Å; D189-A193 PolarHBondContact O-N 3.46Å; G190-A193 PolarHBondContact O-N 2.76Å; A193-F265 HydrophobicContact CB-CE2 4.13Å
194	P	82.6	Confident	91.9	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.006	16%	0.155	C	C	.	.	S	Bend	trans	-65.8	-170.5	168	30.3	-36.6	0	0	0	111.4	Y166 S196 C258 F261 F265	Y166-P194 WeakPolarHBondContact OH-CD 3.28Å; P194-S196 PolarHBondContact O-N 3.14Å; P194-S196 PolarHBondContact O-OG 3.48Å; P194-C258 VanDerWaalsContact CG-SG 3.53Å; P194-F261 HydrophobicContact CB-CD2 3.92Å; P194-F261 HydrophobicContact CB-CE2 3.6Å; P194-F261 HydrophobicContact CG-CD2 3.86Å; P194-F261 HydrophobicContact CG-CE2 3.94Å; P194-F265 HydrophobicContact CG-CZ 3.93Å
195	D	85	Confident	91.7	Very high	16 Å²	16	29.8 Å²	29.8	9%	0.086	16%	0.159	C	C	.	.	S	Bend	trans	-56.8	108.3	-178	-94	19.4	0	0	0	113	F197 K229 C258 Y259 R260 Y382	D195-F197 HydrophobicContact CB-CE2 4.01Å; D195-K229 IonicContact OD1-NZ 2.71Å; D195-K229 PolarHBondContact OD1-NZ 3.42Å; D195-C258 CarbonylContact O-C 3.59Å; D195-C258 WeakPolarHBondContact O-CA 3.29Å; D195-C258 PolarHBondContact O-SG 2.97Å; D195-Y259 PolarHBondContact O-N 3.17Å; D195-R260 HydrophobicContact CB-CB 3.87Å; D195-Y382 WeakPolarHBondContact OD2-CE1 3.49Å
196	S	92.1	Very high	91.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.7	-166.7	-58.7	0	0	0	0	110.4	P194 S227 L228 Y257 F265	P194-S196 PolarHBondContact O-N 3.14Å; P194-S196 PolarHBondContact O-OG 3.48Å; S196-S227 PolarHBondContact N-OG 2.92Å; S196-S227 CarbonylContact O-C 3.6Å; S196-S227 VanDerWaalsContact O-CA 3.27Å; S196-S227 WeakPolarHBondContact O-CA 3.43Å; S196-S227 PolarHBondContact O-OG 2.99Å; S196-L228 WeakPolarHBondContact O-CD1 3.36Å; S196-L228 PolarHBondContact O-N 3.05Å; S196-Y257 WeakPolarHBondContact CA-O 3.5Å; S196-F265 VanDerWaalsContact OG-CE2 3.29Å; S196-F265 WeakPolarHBondContact OG-CE2 3.33Å
197	F	96.1	Very high	91.5	Very high	10 Å²	10	36.1 Å²	36.1	4%	0.044	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	152.7	-175.4	-59.7	-93.1	0	0	0	110.1	D195 K213 I225 S227 Y257	D195-F197 HydrophobicContact CB-CE2 4.01Å; F197-K213 HydrophobicContact CB-CG 4.29Å; F197-K213 HydrophobicContact CD1-CD 3.87Å; F197-K213 HydrophobicContact CD1-CG 4.43Å; F197-K213 HydrophobicContact CD2-CD 4.48Å; F197-K213 HydrophobicContact CE1-CD 4.1Å; F197-K213 HydrophobicContact CG-CD 4.06Å; F197-K213 HydrophobicContact CG-CG 4.31Å; F197-I225 HydrophobicContact CD1-CG2 4.14Å; F197-S227 VanDerWaalsContact CE1-N 3.28Å; F197-Y257 PolarHBondContact N-O 2.81Å; F197-Y257 PolarHBondContact O-N 3.08Å
198	F	98.3	Very high	91.3	Very high	1 Å²	1	38.9 Å²	38.9	0%	0.004	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	137.1	158.8	-71.5	-68.5	0	0	0	109.8	L157 I183 L186 K213 V214 V216 L228 L238 L240 S255 L256	L157-F198 HydrophobicContact CD1-CE1 3.8Å; I183-F198 HydrophobicContact CD1-CD1 3.97Å; I183-F198 HydrophobicContact CD1-CE1 3.41Å; I183-F198 VanDerWaalsContact CD1-CE1 3.41Å; I183-F198 HydrophobicContact CD1-CZ 3.7Å; L186-F198 HydrophobicContact CD1-CZ 4.29Å; L186-F198 HydrophobicContact CD2-CZ 4.08Å; F198-K213 WeakPolarHBondContact O-CA 3.1Å; F198-V214 HydrophobicContact CB-CB 4.08Å; F198-V214 PolarHBondContact O-N 2.83Å; F198-V216 HydrophobicContact CD2-CG2 3.64Å; F198-V216 HydrophobicContact CE2-CG2 4.06Å; F198-L228 HydrophobicContact CD2-CD1 4.04Å; F198-L228 HydrophobicContact CD2-CD2 4.32Å; F198-L228 HydrophobicContact CE2-CD1 4.24Å; F198-L228 HydrophobicContact CE2-CD2 3.67Å; F198-L228 HydrophobicContact CZ-CD2 4.19Å; F198-L238 HydrophobicContact CE2-CD1 3.6Å; F198-L238 HydrophobicContact CZ-CD1 3.86Å; F198-L240 HydrophobicContact CB-CD1 3.89Å; F198-L240 HydrophobicContact CB-CD2 4.13Å; F198-L240 HydrophobicContact CD1-CD1 3.85Å; F198-L240 HydrophobicContact CD1-CD2 4.44Å; F198-L240 HydrophobicContact CD2-CD1 4.26Å; F198-L240 HydrophobicContact CD2-CD2 3.4Å; F198-L240 HydrophobicContact CD2-CG 4.47Å; F198-L240 HydrophobicContact CE1-CD1 4.46Å; F198-L240 HydrophobicContact CE2-CD2 3.81Å; F198-L240 HydrophobicContact CG-CD1 3.72Å; F198-L240 HydrophobicContact CG-CD2 3.73Å; F198-L240 HydrophobicContact CG-CG 4.4Å; F198-L240 HydrophobicContact CZ-CD2 4.5Å; F198-S255 CarbonylContact C-O 3.56Å; F198-S255 WeakPolarHBondContact CA-O 3.25Å; F198-L256 HydrophobicContact CD1-CD1 4.34Å; F198-L256 HydrophobicContact CE1-CB 4.42Å; F198-L256 HydrophobicContact CE1-CD1 4.21Å; F198-L256 HydrophobicContact CZ-CD1 4.47Å
199	F	97.9	Very high	91.1	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.009	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	135.1	-170.4	-150.9	-125.2	0	0	0	108.2	R207 G211 V212 K213 W253 S255 Y257 Y259	F199-R207 WeakPolarHBondContact CE1-O 3.2Å; F199-G211 WeakPolarHBondContact CZ-O 3.46Å; F199-V212 WeakPolarHBondContact CA-O 3.43Å; F199-V212 WeakPolarHBondContact CD2-O 3.12Å; F199-V212 VanDerWaalsContact CE2-CA 3.43Å; F199-K213 HydrophobicContact CD2-CG 4.05Å; F199-K213 HydrophobicContact CE2-CG 4.08Å; F199-W253 HydrophobicContact CB-CZ3 4.1Å; F199-W253 AromaticContact CD1-CH2 3.43Å; F199-W253 HydrophobicContact CD1-CH2 3.43Å; F199-W253 VanDerWaalsContact CD1-CH2 3.43Å; F199-W253 AromaticContact CD1-CZ3 3.66Å; F199-W253 HydrophobicContact CD1-CZ3 3.66Å; F199-W253 AromaticContact CE1-CH2 3.89Å; F199-W253 HydrophobicContact CE1-CH2 3.89Å; F199-W253 HydrophobicContact CG-CH2 4.35Å; F199-W253 HydrophobicContact CG-CZ3 4.23Å; F199-W253 WeakPolarHBondContact O-CZ3 3.28Å; F199-S255 PolarHBondContact N-O 2.97Å; F199-S255 PolarHBondContact O-N 3.1Å; F199-Y257 HydrophobicContact CB-CG 4.37Å; F199-Y257 HydrophobicContact CD1-CD1 4.14Å; F199-Y257 HydrophobicContact CD1-CD2 4.42Å; F199-Y257 HydrophobicContact CD1-CG 4Å; F199-Y257 HydrophobicContact CE1-CD1 4.44Å; F199-Y257 HydrophobicContact CG-CD1 4.48Å; F199-Y257 HydrophobicContact CG-CG 4.33Å; F199-Y259 HydrophobicContact CE2-CD2 4.19Å; F199-Y259 HydrophobicContact CE2-CE2 4.24Å; F199-Y259 HydrophobicContact CZ-CD2 4.42Å; F199-Y259 HydrophobicContact CZ-CE2 4.29Å
200	V	98.3	Very high	91.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	151.7	173.4	-64.2	0	0	0	0	109.4	G211 V212 V214 L242 I251 W253 I254	V200-G211 CarbonylContact O-C 3.52Å; V200-G211 WeakPolarHBondContact O-CA 3.29Å; V200-V212 HydrophobicContact CG2-CG2 3.69Å; V200-V212 PolarHBondContact N-O 3.48Å; V200-V212 PolarHBondContact O-N 3.32Å; V200-V214 HydrophobicContact CB-CG2 3.97Å; V200-V214 HydrophobicContact CG1-CG2 3.43Å; V200-V214 VanDerWaalsContact CG1-CG2 3.43Å; V200-V214 HydrophobicContact CG2-CG2 3.68Å; V200-L242 HydrophobicContact CG1-CD1 4.39Å; V200-L242 HydrophobicContact CG1-CG 4.4Å; V200-L242 HydrophobicContact CG2-CG 4.47Å; V200-I251 HydrophobicContact CB-CD1 3.8Å; V200-I251 HydrophobicContact CB-CG2 4.13Å; V200-I251 HydrophobicContact CG1-CD1 3.72Å; V200-I251 HydrophobicContact CG2-CG2 4.18Å; V200-W253 VanDerWaalsContact C-CZ3 3.49Å; V200-W253 WeakPolarHBondContact CA-O 3.5Å; V200-I254 HydrophobicContact CG1-CB 4.4Å; V200-I254 HydrophobicContact CG1-CG1 3.92Å; V200-I254 HydrophobicContact CG1-CG2 4.3Å
201	G	97.1	Very high	91.6	Very high	2 Å²	2	46.1 Å²	46.1	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.6	-169.2	179.4	0	0	0	0	0	113.5	D210 I251 D252 W253	G201-D210 WeakPolarHBondContact CA-O 3.45Å; G201-I251 CarbonylContact O-C 3.51Å; G201-I251 WeakPolarHBondContact O-CA 3.29Å; G201-I251 WeakPolarHBondContact O-CB 3.46Å; G201-D252 PolarHBondContact O-N 2.82Å; G201-W253 PolarHBondContact N-O 2.95Å; G201-W253 PolarHBondContact O-N 3.09Å
202	K	94.2	Very high	92.3	Very high	120 Å²	120	44.2 Å²	44.2	52%	0.522	24%	0.237	S	C	.	.			trans	-111.3	169.4	-179.9	-74.8	-166.3	175.4	-171.4	0	111.8	D210 K250 D252 W253	K202-D210 PolarHBondContact N-O 3.23Å; K202-K250 WeakPolarHBondContact CE-O 3.24Å; K202-K250 WeakPolarHBondContact CG-O 3.46Å; K202-D252 VanDerWaalsContact CA-OD2 3.26Å; K202-D252 WeakPolarHBondContact CA-OD2 3.36Å; K202-D252 WeakPolarHBondContact CB-OD2 3.49Å; K202-W253 PolarHBondContact O-NE1 2.83Å
203	G	94.3	Very high	93.2	Very high	28 Å²	28	41.6 Å²	41.6	29%	0.289	23%	0.229	S	C	.	.	S	Bend	trans	93.8	177.1	176.5	0	0	0	0	0	113	E205 D252 W253	G203-E205 VanDerWaalsContact C-N 3.3Å; G203-E205 PolarHBondContact O-N 2.75Å; G203-D252 PolarHBondContact N-OD2 3.08Å; G203-W253 VanDerWaalsContact O-CD1 3.3Å
204	P	92.7	Very high	93.8	Very high	85 Å²	85	41.7 Å²	41.7	55%	0.552	23%	0.229	S	C	*	.	S	Bend	trans	-69.8	-27.5	-171.2	27.7	-35.1	0	0	0	112.9	R269	P204-R269 VanDerWaalsContact O-CZ 3.3Å; P204-R269 PolarHBondContact O-NH2 3.43Å
205	E	92.1	Very high	94.4	Very high	71 Å²	71	42.4 Å²	42.4	33%	0.332	23%	0.233	S	C	.	.	S	Bend	trans	-144.2	148.1	-175.8	-72.1	-60.6	138.6	0	0	111.1	G203 R207 H267 R269	G203-E205 VanDerWaalsContact C-N 3.3Å; G203-E205 PolarHBondContact O-N 2.75Å; E205-R207 PolarHBondContact O-N 3.17Å; E205-H267 IonicContact OE2-CE1 2.72Å; E205-H267 PolarHBondContact OE2-CE1 2.76Å; E205-H267 IonicContact OE2-NE2 3.56Å; E205-R269 IonicContact OE1-CZ 3.35Å; E205-R269 IonicContact OE1-NH2 3.68Å; E205-R269 PolarHBondContact OE1-NH2 3.22Å
206	P	95.8	Very high	94.9	Very high	9 Å²	9	41.9 Å²	41.9	6%	0.058	23%	0.231	C	C	.	.			trans	-60.8	123.3	175	-23.2	32.6	0	0	0	113.8	W253 Y257 N264 H267	P206-W253 HydrophobicContact CB-CD2 3.92Å; P206-W253 HydrophobicContact CB-CE3 3.77Å; P206-W253 HydrophobicContact CB-CH2 3.91Å; P206-W253 HydrophobicContact CB-CZ2 4.06Å; P206-W253 HydrophobicContact CB-CZ3 3.75Å; P206-W253 HydrophobicContact CG-CB 4.44Å; P206-W253 HydrophobicContact CG-CD2 3.62Å; P206-W253 HydrophobicContact CG-CE3 3.68Å; P206-W253 HydrophobicContact CG-CG 3.94Å; P206-W253 HydrophobicContact CG-CZ3 4.2Å; P206-Y257 HydrophobicContact CB-CD2 4.08Å; P206-Y257 HydrophobicContact CB-CE2 4.27Å; P206-N264 HydrophobicContact CB-CB 4.17Å; P206-N264 WeakPolarHBondContact CD-ND2 3.11Å; P206-N264 HydrophobicContact CG-CB 4.49Å; P206-N264 WeakPolarHBondContact CG-ND2 3.45Å; P206-H267 HydrophobicContact CG-CB 3.79Å
207	R	92.8	Very high	94.8	Very high	142 Å²	142	46.2 Å²	46.2	54%	0.536	25%	0.247	S	C	.	.			trans	-139.4	146.8	179.6	-67.2	172.6	179.7	-177	0.5	110.6	F199 E205 G209 D210	F199-R207 WeakPolarHBondContact CE1-O 3.2Å; E205-R207 PolarHBondContact O-N 3.17Å; R207-G209 VanDerWaalsContact C-N 3.26Å; R207-G209 PolarHBondContact O-N 3.23Å; R207-D210 HydrophobicContact CB-CB 4.28Å; R207-D210 WeakPolarHBondContact CB-OD2 3.13Å; R207-D210 VanDerWaalsContact CD-OD2 3.27Å; R207-D210 WeakPolarHBondContact CD-OD2 3.08Å; R207-D210 PolarHBondContact O-N 3.4Å
208	R	91.6	Very high	94.3	Very high	93 Å²	93	49.9 Å²	49.9	35%	0.351	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-54.1	-40.2	-176.1	-168	-170.1	-63.8	-143.5	9.6	113.2	Y257 Y259 R260 A262	R208-Y257 HydrophobicContact CB-CE1 4.19Å; R208-Y257 PolarHBondContact N-OH 2.77Å; R208-Y259 HydrophobicContact CG-CD2 4.15Å; R208-Y259 HydrophobicContact CG-CE2 3.65Å; R208-Y259 PolarHBondContact NE-O 2.98Å; R208-Y259 PolarHBondContact NH1-O 2.94Å; R208-Y259 VanDerWaalsContact NH1-O 3.09Å; R208-Y259 PolarHBondContact NH2-O 3.23Å; R208-R260 VanDerWaalsContact NH2-C 3.31Å; R208-R260 PolarHBondContact NH2-O 3.09Å; R208-A262 HydrophobicContact CB-CB 4.22Å; R208-A262 VanDerWaalsContact NH2-N 3.18Å
209	G	91.4	Very high	93.8	Very high	76 Å²	76	53 Å²	53	78%	0.784	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-80.5	-13.5	-178.3	0	0	0	0	0	115.2	R207	R207-G209 VanDerWaalsContact C-N 3.26Å; R207-G209 PolarHBondContact O-N 3.23Å
210	D	93.1	Very high	93.4	Very high	81 Å²	81	54 Å²	54	43%	0.433	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-108.9	9.6	-171.3	-62.3	-47.9	0	0	0	113	G201 K202 R207	G201-D210 WeakPolarHBondContact CA-O 3.45Å; K202-D210 PolarHBondContact N-O 3.23Å; R207-D210 HydrophobicContact CB-CB 4.28Å; R207-D210 WeakPolarHBondContact CB-OD2 3.13Å; R207-D210 VanDerWaalsContact CD-OD2 3.27Å; R207-D210 WeakPolarHBondContact CD-OD2 3.08Å; R207-D210 PolarHBondContact O-N 3.4Å
211	G	95	Very high	92.7	Very high	17 Å²	17	56 Å²	56	18%	0.175	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	178.3	-177.3	0	0	0	0	0	115.4	F199 V200	F199-G211 WeakPolarHBondContact CZ-O 3.46Å; V200-G211 CarbonylContact O-C 3.52Å; V200-G211 WeakPolarHBondContact O-CA 3.29Å
212	V	95.8	Very high	91.9	Very high	49 Å²	49	61.2 Å²	61.2	30%	0.297	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	148.5	-177.7	-63.5	0	0	0	0	111.2	F199 V200 P243	F199-V212 WeakPolarHBondContact CA-O 3.43Å; F199-V212 WeakPolarHBondContact CD2-O 3.12Å; F199-V212 VanDerWaalsContact CE2-CA 3.43Å; V200-V212 HydrophobicContact CG2-CG2 3.69Å; V200-V212 PolarHBondContact N-O 3.48Å; V200-V212 PolarHBondContact O-N 3.32Å; V212-P243 HydrophobicContact CG2-CG 3.93Å
213	K	96.5	Very high	91.3	Very high	70 Å²	70	62.3 Å²	62.3	30%	0.304	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	143.9	175.9	-66.2	179.1	-178	179.7	0	110.3	F197 F198 F199 I225	F197-K213 HydrophobicContact CB-CG 4.29Å; F197-K213 HydrophobicContact CD1-CD 3.87Å; F197-K213 HydrophobicContact CD1-CG 4.43Å; F197-K213 HydrophobicContact CD2-CD 4.48Å; F197-K213 HydrophobicContact CE1-CD 4.1Å; F197-K213 HydrophobicContact CG-CD 4.06Å; F197-K213 HydrophobicContact CG-CG 4.31Å; F198-K213 WeakPolarHBondContact O-CA 3.1Å; F199-K213 HydrophobicContact CD2-CG 4.05Å; F199-K213 HydrophobicContact CE2-CG 4.08Å; K213-I225 HydrophobicContact CB-CD1 3.98Å; K213-I225 HydrophobicContact CB-CG2 4.3Å
214	V	96.7	Very high	90.8	Very high	2 Å²	2	66 Å²	66	1%	0.012	38%	0.375	C	S	.	.			trans	-117.2	136.2	-175.6	-168.9	0	0	0	0	109.3	F198 V200 L240 E241 L242	F198-V214 HydrophobicContact CB-CB 4.08Å; F198-V214 PolarHBondContact O-N 2.83Å; V200-V214 HydrophobicContact CB-CG2 3.97Å; V200-V214 HydrophobicContact CG1-CG2 3.43Å; V200-V214 VanDerWaalsContact CG1-CG2 3.43Å; V200-V214 HydrophobicContact CG2-CG2 3.68Å; V214-L240 HydrophobicContact CG1-CB 3.85Å; V214-L240 HydrophobicContact CG1-CD1 4.44Å; V214-E241 VanDerWaalsContact CG1-O 3.3Å; V214-E241 WeakPolarHBondContact CG1-O 3.23Å; V214-L242 HydrophobicContact CG1-CD1 4.29Å
215	L	95.1	Very high	90.6	Very high	17 Å²	17	64.1 Å²	64.1	9%	0.089	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	136.6	-179.9	177.3	145.2	0	0	0	110.7	D220 P222 I225 L240 E241	L215-D220 HydrophobicContact CD1-CB 4.31Å; L215-D220 HydrophobicContact CG-CB 3.86Å; L215-P222 HydrophobicContact CD1-CG 4.21Å; L215-I225 HydrophobicContact CB-CD1 4.4Å; L215-I225 HydrophobicContact CB-CG1 4.43Å; L215-L240 WeakPolarHBondContact O-CA 3.45Å; L215-E241 HydrophobicContact CB-CB 4.45Å; L215-E241 HydrophobicContact CD2-CB 3.95Å; L215-E241 HydrophobicContact CD2-CG 4.04Å; L215-E241 PolarHBondContact N-O 3.16Å; L215-E241 PolarHBondContact O-N 2.89Å
216	V	95.4	Very high	90.3	Very high	5 Å²	5	62.5 Å²	62.5	3%	0.03	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	117.9	166.7	-175	0	0	0	0	109.4	F198 G218 K219 D220 L238 L240	F198-V216 HydrophobicContact CD2-CG2 3.64Å; F198-V216 HydrophobicContact CE2-CG2 4.06Å; V216-G218 PolarHBondContact O-N 2.89Å; V216-K219 HydrophobicContact CB-CB 4.15Å; V216-K219 HydrophobicContact CB-CD 4.24Å; V216-K219 HydrophobicContact CG1-CB 4.24Å; V216-K219 PolarHBondContact O-N 3.12Å; V216-K219 VanDerWaalsContact O-N 3.1Å; V216-D220 WeakPolarHBondContact CB-OD2 3.42Å; V216-D220 PolarHBondContact N-OD2 2.77Å; V216-D220 VanDerWaalsContact N-OD2 3.12Å; V216-D220 PolarHBondContact O-N 2.92Å; V216-L238 HydrophobicContact CG1-CB 4.4Å; V216-L238 HydrophobicContact CG1-CD2 4.14Å; V216-L240 HydrophobicContact CB-CD2 4.48Å; V216-L240 HydrophobicContact CG2-CD2 3.78Å
217	R	91	Very high	90	Very high	91 Å²	91	62.8 Å²	62.8	34%	0.343	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	131.1	-179.5	-176.9	-178.5	-70.4	170.4	2.2	110.5	K219 I239 E241	R217-K219 VanDerWaalsContact C-N 3.25Å; R217-K219 PolarHBondContact O-N 3.44Å; R217-I239 HydrophobicContact CB-CB 4.08Å; R217-I239 HydrophobicContact CB-CG2 4.24Å; R217-I239 WeakPolarHBondContact CB-O 3.22Å; R217-I239 PolarHBondContact N-O 3.46Å; R217-E241 IonicContact CZ-OE1 3.51Å; R217-E241 IonicContact NE-OE1 2.81Å; R217-E241 PolarHBondContact NE-OE1 3.11Å; R217-E241 IonicContact NH2-OE1 3.97Å; R217-E241 PolarHBondContact NH2-OE1 2.83Å
218	G	86.2	Confident	89.9	Confident	87 Å²	87	56.1 Å²	56.1	90%	0.897	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	-10.3	-179.9	0	0	0	0	0	115	V216	V216-G218 PolarHBondContact O-N 2.89Å
219	K	87.1	Confident	89.5	Confident	67 Å²	67	53.5 Å²	53.5	29%	0.291	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-46.3	174.6	173.8	-172.7	161.6	65	0	111.9	V216 R217 S226 S227	V216-K219 HydrophobicContact CB-CB 4.15Å; V216-K219 HydrophobicContact CB-CD 4.24Å; V216-K219 HydrophobicContact CG1-CB 4.24Å; V216-K219 PolarHBondContact O-N 3.12Å; V216-K219 VanDerWaalsContact O-N 3.1Å; R217-K219 VanDerWaalsContact C-N 3.25Å; R217-K219 PolarHBondContact O-N 3.44Å; K219-S226 WeakPolarHBondContact CE-OG 3.08Å; K219-S226 PolarHBondContact NZ-OG 3.3Å; K219-S227 PolarHBondContact NZ-O 2.93Å
220	D	89.6	Confident	89.2	Confident	22 Å²	22	53.6 Å²	53.6	12%	0.118	31%	0.305	C	S	.	.			trans	-113	166.2	-168.8	-63.3	-51.3	0	0	0	111.8	L215 V216 S226	L215-D220 HydrophobicContact CD1-CB 4.31Å; L215-D220 HydrophobicContact CG-CB 3.86Å; V216-D220 WeakPolarHBondContact CB-OD2 3.42Å; V216-D220 PolarHBondContact N-OD2 2.77Å; V216-D220 VanDerWaalsContact N-OD2 3.12Å; V216-D220 PolarHBondContact O-N 2.92Å; D220-S226 PolarHBondContact OD1-N 2.72Å; D220-S226 PolarHBondContact OD1-OG 3.18Å
221	S	83	Confident	89	Confident	43 Å²	43	54.2 Å²	54.2	30%	0.301	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-122.3	159.4	171	75.1	0	0	0	0	110.6	D223 Q224	S221-D223 PolarHBondContact O-N 3.22Å; S221-Q224 PolarHBondContact N-O 2.83Å; S221-Q224 CarbonylContact O-C 3.01Å; S221-Q224 PolarHBondContact O-N 3.07Å; S221-Q224 VanDerWaalsContact O-O 3.05Å; S221-Q224 PolarHBondContact OG-N 3.09Å
222	P	81.4	Confident	88.9	Confident	110 Å²	110	54.1 Å²	54.1	71%	0.714	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-31.1	-177	-29.2	36.5	0	0	0	114.4	L215	L215-P222 HydrophobicContact CD1-CG 4.21Å
223	D	80.8	Confident	88.9	Confident	143 Å²	143	55.5 Å²	55.5	77%	0.765	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-12.6	-179.9	-52.3	-42.3	0	0	0	113	S221	S221-D223 PolarHBondContact O-N 3.22Å
224	Q	83.4	Confident	88.7	Confident	105 Å²	105	53.5 Å²	53.5	49%	0.491	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-144.7	95.8	-173.3	-172.3	177	-5.8	0	0	110.7	S221	S221-Q224 PolarHBondContact N-O 2.83Å; S221-Q224 CarbonylContact O-C 3.01Å; S221-Q224 PolarHBondContact O-N 3.07Å; S221-Q224 VanDerWaalsContact O-O 3.05Å; S221-Q224 PolarHBondContact OG-N 3.09Å
225	I	89.8	Confident	88.4	Confident	46 Å²	46	61 Å²	61	24%	0.236	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-101.6	118.6	172.2	-56.8	172.9	0	0	0	108.3	F197 K213 L215	F197-I225 HydrophobicContact CD1-CG2 4.14Å; K213-I225 HydrophobicContact CB-CD1 3.98Å; K213-I225 HydrophobicContact CB-CG2 4.3Å; L215-I225 HydrophobicContact CB-CD1 4.4Å; L215-I225 HydrophobicContact CB-CG1 4.43Å
226	S	85.6	Confident	88	Confident	38 Å²	38	66.4 Å²	66.4	27%	0.266	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-100.4	155.3	-174.4	66.3	0	0	0	0	112.5	K219 D220	K219-S226 WeakPolarHBondContact CE-OG 3.08Å; K219-S226 PolarHBondContact NZ-OG 3.3Å; D220-S226 PolarHBondContact OD1-N 2.72Å; D220-S226 PolarHBondContact OD1-OG 3.18Å
227	S	89.3	Confident	87.9	Confident	14 Å²	14	69.5 Å²	69.5	10%	0.098	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-64.8	147.8	175.6	178.2	0	0	0	0	110.9	S196 F197 K219 K229	S196-S227 PolarHBondContact N-OG 2.92Å; S196-S227 CarbonylContact O-C 3.6Å; S196-S227 VanDerWaalsContact O-CA 3.27Å; S196-S227 WeakPolarHBondContact O-CA 3.43Å; S196-S227 PolarHBondContact O-OG 2.99Å; F197-S227 VanDerWaalsContact CE1-N 3.28Å; K219-S227 PolarHBondContact NZ-O 2.93Å; S227-K229 PolarHBondContact O-N 2.92Å; S227-K229 VanDerWaalsContact OG-CE 3.25Å; S227-K229 WeakPolarHBondContact OG-CE 3.47Å; S227-K229 PolarHBondContact OG-NZ 3.06Å
228	L	90.7	Very high	88.2	Confident	2 Å²	2	66 Å²	66	1%	0.01	37%	0.372	C	S	.	.			trans	-74.6	113.3	166.2	-71.7	88.9	0	0	0	108.8	L186 F188 S196 F198 Y232 L238 L256	L186-L228 HydrophobicContact CD2-CD2 4.12Å; F188-L228 HydrophobicContact CD1-CB 4.18Å; F188-L228 HydrophobicContact CD1-CD2 4.38Å; F188-L228 HydrophobicContact CE1-CB 3.8Å; S196-L228 WeakPolarHBondContact O-CD1 3.36Å; S196-L228 PolarHBondContact O-N 3.05Å; F198-L228 HydrophobicContact CD2-CD1 4.04Å; F198-L228 HydrophobicContact CD2-CD2 4.32Å; F198-L228 HydrophobicContact CE2-CD1 4.24Å; F198-L228 HydrophobicContact CE2-CD2 3.67Å; F198-L228 HydrophobicContact CZ-CD2 4.19Å; L228-Y232 HydrophobicContact CB-CE2 4.16Å; L228-Y232 HydrophobicContact CD2-CE2 3.87Å; L228-Y232 HydrophobicContact CG-CE2 4.42Å; L228-L238 HydrophobicContact CD2-CD1 4.45Å; L228-L256 HydrophobicContact CD1-CD1 4.1Å; L228-L256 HydrophobicContact CD2-CD1 4.26Å
229	K	83.3	Confident	88.7	Confident	38 Å²	38	64 Å²	64	17%	0.165	34%	0.34	C	S	.	.			trans	-123.1	-3.2	-177.6	-62.6	-61.5	-171.1	-167.6	0	113.5	G190 N191 D195 S227	G190-K229 CarbonylContact C-O 3.57Å; G190-K229 WeakPolarHBondContact O-CA 3.48Å; N191-K229 WeakPolarHBondContact CA-O 3.38Å; N191-K229 WeakPolarHBondContact CB-O 3.46Å; N191-K229 PolarHBondContact N-O 3.31Å; D195-K229 IonicContact OD1-NZ 2.71Å; D195-K229 PolarHBondContact OD1-NZ 3.42Å; S227-K229 PolarHBondContact O-N 2.92Å; S227-K229 VanDerWaalsContact OG-CE 3.25Å; S227-K229 WeakPolarHBondContact OG-CE 3.47Å; S227-K229 PolarHBondContact OG-NZ 3.06Å
230	E	84.9	Confident	89.2	Confident	78 Å²	78	60.9 Å²	60.9	36%	0.364	33%	0.327	S	S	.	.	S	Bend	trans	-85.8	161.6	-179.9	-70.9	164.3	-140.8	0	0	110.6	G190 Y232	G190-E230 VanDerWaalsContact CA-O 3.25Å; G190-E230 WeakPolarHBondContact CA-O 3.24Å; G190-E230 PolarHBondContact N-O 2.87Å; G190-E230 VanDerWaalsContact N-O 3.15Å; E230-Y232 HydrophobicContact CB-CD2 4.48Å; E230-Y232 HydrophobicContact CB-CE2 3.87Å; E230-Y232 VanDerWaalsContact O-CD2 3.26Å; E230-Y232 WeakPolarHBondContact O-CD2 3.46Å; E230-Y232 WeakPolarHBondContact O-CE2 3.29Å
231	L	87.8	Confident	89.5	Confident	95 Å²	95	61.4 Å²	61.4	50%	0.497	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	124.4	166.5	179.8	64.3	0	0	0	108.7	D189 T233	D189-L231 HydrophobicContact CB-CD1 4.38Å; D189-L231 VanDerWaalsContact OD1-CD1 3.23Å; D189-L231 WeakPolarHBondContact OD1-CD1 3.39Å; L231-T233 HydrophobicContact CD2-CG2 4.2Å; L231-T233 HydrophobicContact CG-CG2 4.08Å
232	Y	94.1	Very high	90.1	Very high	14 Å²	14	59.4 Å²	59.4	6%	0.055	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	121	174.8	-60.6	-96	0	0	0	108.9	L186 T187 F188 L228 E230 L238	L186-Y232 HydrophobicContact CD2-CD1 3.91Å; L186-Y232 HydrophobicContact CD2-CD2 4.14Å; L186-Y232 HydrophobicContact CD2-CE1 4.38Å; L186-Y232 HydrophobicContact CD2-CG 3.79Å; L186-Y232 HydrophobicContact CG-CG 4.49Å; L186-Y232 WeakPolarHBondContact O-CB 3.42Å; T187-Y232 CarbonylContact C-O 2.99Å; T187-Y232 VanDerWaalsContact CA-O 3.29Å; T187-Y232 WeakPolarHBondContact CA-O 3.49Å; F188-Y232 HydrophobicContact CB-CD2 4.13Å; F188-Y232 HydrophobicContact CD1-CD2 4.06Å; F188-Y232 HydrophobicContact CD1-CE2 4.33Å; F188-Y232 PolarHBondContact N-O 3.37Å; F188-Y232 PolarHBondContact O-N 3.21Å; L228-Y232 HydrophobicContact CB-CE2 4.16Å; L228-Y232 HydrophobicContact CD2-CE2 3.87Å; L228-Y232 HydrophobicContact CG-CE2 4.42Å; E230-Y232 HydrophobicContact CB-CD2 4.48Å; E230-Y232 HydrophobicContact CB-CE2 3.87Å; E230-Y232 VanDerWaalsContact O-CD2 3.26Å; E230-Y232 WeakPolarHBondContact O-CD2 3.46Å; E230-Y232 WeakPolarHBondContact O-CE2 3.29Å; Y232-L238 HydrophobicContact CE1-CD1 4.13Å; Y232-L238 HydrophobicContact CE1-CD2 4.29Å
233	T	95.2	Very high	90.6	Very high	78 Å²	78	55.9 Å²	55.9	48%	0.479	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	5.9	-173.1	54	0	0	0	0	113.7	L231 E235	L231-T233 HydrophobicContact CD2-CG2 4.2Å; L231-T233 HydrophobicContact CG-CG2 4.08Å; T233-E235 VanDerWaalsContact OG1-CD 3.29Å; T233-E235 PolarHBondContact OG1-OE1 3.23Å
234	G	92.7	Very high	91	Very high	28 Å²	28	54.3 Å²	54.3	29%	0.289	29%	0.289	S	S	.	.	S	Bend	trans	93.7	-3.2	-175.3	0	0	0	0	0	114.7	G185 L186	G185-G234 WeakPolarHBondContact CA-O 3.43Å; L186-G234 VanDerWaalsContact O-CA 3.25Å; L186-G234 WeakPolarHBondContact O-CA 3.45Å; L186-G234 PolarHBondContact O-N 3.34Å
235	E	90.3	Very high	91.2	Very high	161 Å²	161	53.3 Å²	53.3	75%	0.752	29%	0.294	S	S	*	.			trans	-79.4	-18.8	-177.7	-68.4	166.2	-146.6	0	0	114.2	T233	T233-E235 VanDerWaalsContact OG1-CD 3.29Å; T233-E235 PolarHBondContact OG1-OE1 3.23Å
236	K	86.1	Confident	91.4	Very high	130 Å²	130	53.1 Å²	53.1	57%	0.565	29%	0.292	S	S	*	.			trans	-116.5	133.7	-175.2	-64.3	-178	-176.2	175.1	0	110.9	L186	L186-K236 PolarHBondContact N-O 2.83Å
237	D	94.2	Very high	91.8	Very high	69 Å²	69	52.9 Å²	52.9	37%	0.369	29%	0.288	S	S	.	.			trans	-85	148.2	165.2	-59.9	-21.8	0	0	0	109.8	K182 I183 Y184 G185	K182-D237 VanDerWaalsContact CE-CG 3.47Å; K182-D237 WeakPolarHBondContact CE-OD2 3.48Å; K182-D237 IonicContact NZ-OD2 2.85Å; K182-D237 PolarHBondContact NZ-OD2 2.97Å; I183-D237 CarbonylContact O-C 3.56Å; I183-D237 VanDerWaalsContact O-CA 3.32Å; I183-D237 WeakPolarHBondContact O-CA 3.43Å; Y184-D237 VanDerWaalsContact CA-OD1 3.26Å; Y184-D237 WeakPolarHBondContact CA-OD1 3.15Å; Y184-D237 VanDerWaalsContact CD1-OD2 3.28Å; Y184-D237 WeakPolarHBondContact CD1-OD2 3.18Å; Y184-D237 WeakPolarHBondContact CE1-OD2 3.32Å; G185-D237 PolarHBondContact N-OD1 2.77Å
238	L	97	Very high	92	Very high	19 Å²	19	52.2 Å²	52.2	10%	0.099	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	139.9	175.4	-60.3	-178.9	0	0	0	110.3	K182 I183 L186 F198 V216 L228 Y232	K182-L238 CarbonylContact C-O 3.58Å; K182-L238 WeakPolarHBondContact CA-O 3.34Å; I183-L238 PolarHBondContact N-O 2.93Å; I183-L238 PolarHBondContact O-N 3.19Å; L186-L238 HydrophobicContact CB-CD1 4.38Å; L186-L238 HydrophobicContact CD2-CD1 3.6Å; F198-L238 HydrophobicContact CE2-CD1 3.6Å; F198-L238 HydrophobicContact CZ-CD1 3.86Å; V216-L238 HydrophobicContact CG1-CB 4.4Å; V216-L238 HydrophobicContact CG1-CD2 4.14Å; L228-L238 HydrophobicContact CD2-CD1 4.45Å; Y232-L238 HydrophobicContact CE1-CD1 4.13Å; Y232-L238 HydrophobicContact CE1-CD2 4.29Å
239	I	96.7	Very high	92.3	Very high	44 Å²	44	56.2 Å²	56.2	23%	0.226	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	119.6	174.2	-60	173.4	0	0	0	107.9	T180 V181 K182 R217	T180-I239 HydrophobicContact CG2-CG2 3.49Å; T180-I239 VanDerWaalsContact CG2-CG2 3.49Å; V181-I239 CarbonylContact O-C 3.5Å; V181-I239 WeakPolarHBondContact O-CA 3.46Å; K182-I239 HydrophobicContact CB-CG1 4.4Å; K182-I239 HydrophobicContact CD-CG1 4.41Å; K182-I239 HydrophobicContact CG-CG1 4.18Å; R217-I239 HydrophobicContact CB-CB 4.08Å; R217-I239 HydrophobicContact CB-CG2 4.24Å; R217-I239 WeakPolarHBondContact CB-O 3.22Å; R217-I239 PolarHBondContact N-O 3.46Å
240	L	97.5	Very high	92.7	Very high	1 Å²	1	58 Å²	58	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	139.9	177.4	-54.8	-169	0	0	0	110.5	T180 V181 I183 F198 V214 L215 V216 I254	T180-L240 WeakPolarHBondContact CA-O 3.22Å; V181-L240 HydrophobicContact CB-CB 4.47Å; V181-L240 PolarHBondContact N-O 2.97Å; V181-L240 PolarHBondContact O-N 3.17Å; I183-L240 HydrophobicContact CD1-CD1 3.52Å; I183-L240 HydrophobicContact CD1-CD2 4.43Å; I183-L240 HydrophobicContact CD1-CG 3.94Å; I183-L240 HydrophobicContact CG1-CD1 4.39Å; F198-L240 HydrophobicContact CB-CD1 3.89Å; F198-L240 HydrophobicContact CB-CD2 4.13Å; F198-L240 HydrophobicContact CD1-CD1 3.85Å; F198-L240 HydrophobicContact CD1-CD2 4.44Å; F198-L240 HydrophobicContact CD2-CD1 4.26Å; F198-L240 HydrophobicContact CD2-CD2 3.4Å; F198-L240 HydrophobicContact CD2-CG 4.47Å; F198-L240 HydrophobicContact CE1-CD1 4.46Å; F198-L240 HydrophobicContact CE2-CD2 3.81Å; F198-L240 HydrophobicContact CG-CD1 3.72Å; F198-L240 HydrophobicContact CG-CD2 3.73Å; F198-L240 HydrophobicContact CG-CG 4.4Å; F198-L240 HydrophobicContact CZ-CD2 4.5Å; V214-L240 HydrophobicContact CG1-CB 3.85Å; V214-L240 HydrophobicContact CG1-CD1 4.44Å; L215-L240 WeakPolarHBondContact O-CA 3.45Å; V216-L240 HydrophobicContact CB-CD2 4.48Å; V216-L240 HydrophobicContact CG2-CD2 3.78Å; L240-I254 HydrophobicContact CD1-CG2 3.97Å
241	E	95.3	Very high	93.3	Very high	34 Å²	34	54.5 Å²	54.5	16%	0.159	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	113.9	172.7	-60.1	-167.5	171.2	0	0	110.5	V214 L215 R217	V214-E241 VanDerWaalsContact CG1-O 3.3Å; V214-E241 WeakPolarHBondContact CG1-O 3.23Å; L215-E241 HydrophobicContact CB-CB 4.45Å; L215-E241 HydrophobicContact CD2-CB 3.95Å; L215-E241 HydrophobicContact CD2-CG 4.04Å; L215-E241 PolarHBondContact N-O 3.16Å; L215-E241 PolarHBondContact O-N 2.89Å; R217-E241 IonicContact CZ-OE1 3.51Å; R217-E241 IonicContact NE-OE1 2.81Å; R217-E241 PolarHBondContact NE-OE1 3.11Å; R217-E241 IonicContact NH2-OE1 3.97Å; R217-E241 PolarHBondContact NH2-OE1 2.83Å
242	L	95.2	Very high	93.7	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.005	29%	0.285	C	S	.	.			trans	-66.6	141.8	174.7	-81.6	60.6	0	0	0	109.6	R179 V181 V200 V214 H246 I251	R179-L242 HydrophobicContact CB-CB 4.15Å; R179-L242 HydrophobicContact CG-CB 4.47Å; R179-L242 PolarHBondContact NE-O 3.26Å; R179-L242 PolarHBondContact NH2-O 2.84Å; R179-L242 WeakPolarHBondContact O-CD1 3.4Å; R179-L242 PolarHBondContact O-N 3.08Å; V181-L242 HydrophobicContact CG2-CD1 4.14Å; V200-L242 HydrophobicContact CG1-CD1 4.39Å; V200-L242 HydrophobicContact CG1-CG 4.4Å; V200-L242 HydrophobicContact CG2-CG 4.47Å; V214-L242 HydrophobicContact CG1-CD1 4.29Å; L242-H246 HydrophobicContact CB-CB 4.34Å; L242-H246 HydrophobicContact CD2-CB 4.47Å; L242-I251 HydrophobicContact CD2-CD1 3.81Å
243	P	92.2	Very high	93.9	Very high	35 Å²	35	52.9 Å²	52.9	23%	0.227	28%	0.283	C	S	.	.			trans	-60.3	156.9	178.5	25.4	-33.8	0	0	0	111.4	V212 S245 H246	V212-P243 HydrophobicContact CG2-CG 3.93Å; P243-S245 PolarHBondContact O-N 3.11Å; P243-H246 HydrophobicContact CG-CB 4.02Å; P243-H246 PolarHBondContact O-N 2.75Å
244	P	89	Confident	94.1	Very high	110 Å²	110	49.2 Å²	49.2	71%	0.714	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-26.8	-175.1	-27.5	35.4	0	0	0	115.8	R179 H246	R179-P244 VanDerWaalsContact CZ-CA 3.49Å; P244-H246 VanDerWaalsContact C-N 3.29Å
245	S	89.2	Confident	94.3	Very high	85 Å²	85	47.9 Å²	47.9	59%	0.594	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-9.1	177.6	54	0	0	0	0	114.2	P243	P243-S245 PolarHBondContact O-N 3.11Å
246	H	92.5	Very high	94.7	Very high	41 Å²	41	40.2 Å²	40.2	19%	0.19	21%	0.211	C	C	.	.			trans	-117.2	151.6	-175.1	-69.1	64.6	0	0	0	111.1	R179 L242 P243 P244	R179-H246 VanDerWaalsContact CG-O 3.31Å; R179-H246 WeakPolarHBondContact CG-O 3.2Å; L242-H246 HydrophobicContact CB-CB 4.34Å; L242-H246 HydrophobicContact CD2-CB 4.47Å; P243-H246 HydrophobicContact CG-CB 4.02Å; P243-H246 PolarHBondContact O-N 2.75Å; P244-H246 VanDerWaalsContact C-N 3.29Å
247	N	93.8	Very high	95.2	Very high	34 Å²	34	34.2 Å²	34.2	18%	0.182	19%	0.185	C	C	.	.			trans	-145.7	169.2	166.4	68.7	43.7	0	0	0	109.3	R178 R179 Y249 K250	R178-N247 HydrophobicContact CB-CB 4.28Å; R178-N247 CarbonylContact O-C 3.55Å; R178-N247 WeakPolarHBondContact O-CA 2.96Å; R178-N247 VanDerWaalsContact O-CB 3.29Å; R178-N247 WeakPolarHBondContact O-CB 3.21Å; R179-N247 HydrophobicContact CG-CB 4.28Å; N247-Y249 PolarHBondContact O-N 3.03Å; N247-Y249 WeakPolarHBondContact OD1-CB 3.21Å; N247-Y249 PolarHBondContact OD1-N 3.43Å; N247-K250 PolarHBondContact O-N 2.84Å; N247-K250 WeakPolarHBondContact OD1-CG 3.47Å; N247-K250 PolarHBondContact OD1-N 3.09Å; N247-K250 VanDerWaalsContact OD1-N 3.12Å
248	I	95.5	Very high	95.2	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-60.7	-30.9	-173.5	-161.2	58.5	0	0	0	113.3	I175 R178 V181 K250 I251 I254 I270 I273 I277	I175-I248 HydrophobicContact CD1-CD1 3.96Å; I175-I248 HydrophobicContact CD1-CG1 3.54Å; I175-I248 HydrophobicContact CG1-CD1 3.97Å; I175-I248 HydrophobicContact CG1-CG1 3.86Å; I175-I248 HydrophobicContact CG2-CB 4.33Å; I175-I248 HydrophobicContact CG2-CG1 3.92Å; I175-I248 HydrophobicContact CG2-CG2 4.24Å; R178-I248 PolarHBondContact O-N 2.99Å; V181-I248 HydrophobicContact CG2-CD1 4.28Å; I248-K250 VanDerWaalsContact C-N 3.27Å; I248-K250 PolarHBondContact O-N 2.93Å; I248-I251 HydrophobicContact CD1-CD1 3.92Å; I248-I251 HydrophobicContact CD1-CG1 4.2Å; I248-I254 HydrophobicContact CD1-CD1 4.48Å; I248-I270 HydrophobicContact CD1-CD1 3.76Å; I248-I270 HydrophobicContact CD1-CG1 3.94Å; I248-I270 HydrophobicContact CD1-CG2 3.93Å; I248-I270 HydrophobicContact CG1-CG2 3.95Å; I248-I273 HydrophobicContact CG1-CD1 4.33Å; I248-I273 HydrophobicContact CG2-CD1 4.19Å; I248-I277 HydrophobicContact CG2-CG2 4.43Å
249	Y	95.1	Very high	94.9	Very high	85 Å²	85	34 Å²	34	33%	0.333	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-76.2	-14.6	176.5	-58.6	-72.7	0	0	0	113.5	R178 N247 I273 S274 D275 I277	R178-Y249 HydrophobicContact CG-CD2 4.27Å; R178-Y249 HydrophobicContact CG-CE2 3.79Å; N247-Y249 PolarHBondContact O-N 3.03Å; N247-Y249 WeakPolarHBondContact OD1-CB 3.21Å; N247-Y249 PolarHBondContact OD1-N 3.43Å; Y249-I273 HydrophobicContact CD1-CD1 3.37Å; Y249-I273 HydrophobicContact CD1-CG1 4.09Å; Y249-I273 HydrophobicContact CE1-CD1 3.6Å; Y249-I273 HydrophobicContact CE1-CG1 4.01Å; Y249-I273 HydrophobicContact CG-CD1 4.21Å; Y249-S274 WeakPolarHBondContact CE1-O 3.49Å; Y249-S274 VanDerWaalsContact CZ-O 3.31Å; Y249-S274 PolarHBondContact OH-O 2.82Å; Y249-D275 VanDerWaalsContact OH-C 3.24Å; Y249-D275 WeakPolarHBondContact OH-CA 3.32Å; Y249-D275 PolarHBondContact OH-O 2.72Å; Y249-I277 HydrophobicContact CE2-CB 4.39Å; Y249-I277 VanDerWaalsContact OH-CB 3.25Å; Y249-I277 WeakPolarHBondContact OH-CB 3.45Å; Y249-I277 WeakPolarHBondContact OH-CG1 3.32Å; Y249-I277 PolarHBondContact OH-N 2.74Å; Y249-I277 VanDerWaalsContact OH-N 3.16Å
250	K	93.4	Very high	94.4	Very high	75 Å²	75	32.8 Å²	32.8	33%	0.326	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-100.2	7	-179.6	-70.2	-178.6	178.3	-175.4	0	112.3	E28 K202 N247 I248	E28-K250 IonicContact OE1-NZ 2.72Å; E28-K250 PolarHBondContact OE1-NZ 3.42Å; K202-K250 WeakPolarHBondContact CE-O 3.24Å; K202-K250 WeakPolarHBondContact CG-O 3.46Å; N247-K250 PolarHBondContact O-N 2.84Å; N247-K250 WeakPolarHBondContact OD1-CG 3.47Å; N247-K250 PolarHBondContact OD1-N 3.09Å; N247-K250 VanDerWaalsContact OD1-N 3.12Å; I248-K250 VanDerWaalsContact C-N 3.27Å; I248-K250 PolarHBondContact O-N 2.93Å
251	I	96.4	Very high	93.9	Very high	5 Å²	5	33.3 Å²	33.3	3%	0.026	17%	0.173	C	C	.	.			trans	-130.7	148.9	179.1	59.9	165.5	0	0	0	110.7	V200 G201 L242 I248 I254 I270	V200-I251 HydrophobicContact CB-CD1 3.8Å; V200-I251 HydrophobicContact CB-CG2 4.13Å; V200-I251 HydrophobicContact CG1-CD1 3.72Å; V200-I251 HydrophobicContact CG2-CG2 4.18Å; G201-I251 CarbonylContact O-C 3.51Å; G201-I251 WeakPolarHBondContact O-CA 3.29Å; G201-I251 WeakPolarHBondContact O-CB 3.46Å; L242-I251 HydrophobicContact CD2-CD1 3.81Å; I248-I251 HydrophobicContact CD1-CD1 3.92Å; I248-I251 HydrophobicContact CD1-CG1 4.2Å; I251-I254 HydrophobicContact CD1-CG1 4.07Å; I251-I270 HydrophobicContact CD1-CG1 4.27Å; I251-I270 HydrophobicContact CG1-CG1 4.21Å
252	D	97.3	Very high	93.7	Very high	73 Å²	73	33.9 Å²	33.9	39%	0.39	18%	0.183	S	C	.	.	S	Bend	trans	-102.8	-18.6	-178.9	-63.1	-46.7	0	0	0	112	G201 K202 G203 R269 I270	G201-D252 PolarHBondContact O-N 2.82Å; K202-D252 VanDerWaalsContact CA-OD2 3.26Å; K202-D252 WeakPolarHBondContact CA-OD2 3.36Å; K202-D252 WeakPolarHBondContact CB-OD2 3.49Å; G203-D252 PolarHBondContact N-OD2 3.08Å; D252-R269 CarbonylContact O-C 3.19Å; D252-R269 WeakPolarHBondContact O-CA 3.47Å; D252-I270 PolarHBondContact O-N 2.96Å
253	W	97.8	Very high	93.5	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.008	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	154.4	-177.5	49.5	-97.8	0	0	0	113.2	F199 V200 G201 K202 G203 P206 V268	F199-W253 HydrophobicContact CB-CZ3 4.1Å; F199-W253 AromaticContact CD1-CH2 3.43Å; F199-W253 HydrophobicContact CD1-CH2 3.43Å; F199-W253 VanDerWaalsContact CD1-CH2 3.43Å; F199-W253 AromaticContact CD1-CZ3 3.66Å; F199-W253 HydrophobicContact CD1-CZ3 3.66Å; F199-W253 AromaticContact CE1-CH2 3.89Å; F199-W253 HydrophobicContact CE1-CH2 3.89Å; F199-W253 HydrophobicContact CG-CH2 4.35Å; F199-W253 HydrophobicContact CG-CZ3 4.23Å; F199-W253 WeakPolarHBondContact O-CZ3 3.28Å; V200-W253 VanDerWaalsContact C-CZ3 3.49Å; V200-W253 WeakPolarHBondContact CA-O 3.5Å; G201-W253 PolarHBondContact N-O 2.95Å; G201-W253 PolarHBondContact O-N 3.09Å; K202-W253 PolarHBondContact O-NE1 2.83Å; G203-W253 VanDerWaalsContact O-CD1 3.3Å; P206-W253 HydrophobicContact CB-CD2 3.92Å; P206-W253 HydrophobicContact CB-CE3 3.77Å; P206-W253 HydrophobicContact CB-CH2 3.91Å; P206-W253 HydrophobicContact CB-CZ2 4.06Å; P206-W253 HydrophobicContact CB-CZ3 3.75Å; P206-W253 HydrophobicContact CG-CB 4.44Å; P206-W253 HydrophobicContact CG-CD2 3.62Å; P206-W253 HydrophobicContact CG-CE3 3.68Å; P206-W253 HydrophobicContact CG-CG 3.94Å; P206-W253 HydrophobicContact CG-CZ3 4.2Å; W253-V268 VanDerWaalsContact CA-O 3.28Å; W253-V268 WeakPolarHBondContact CA-O 3.36Å
254	I	98.5	Very high	93.6	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.8	165.2	-55	176.9	0	0	0	106.7	L157 V181 V200 L240 I248 I251 H267 V268 I270	L157-I254 WeakPolarHBondContact CD2-O 3.45Å; V181-I254 HydrophobicContact CB-CD1 4.19Å; V181-I254 HydrophobicContact CG1-CD1 3.75Å; V181-I254 HydrophobicContact CG2-CD1 3.87Å; V200-I254 HydrophobicContact CG1-CB 4.4Å; V200-I254 HydrophobicContact CG1-CG1 3.92Å; V200-I254 HydrophobicContact CG1-CG2 4.3Å; L240-I254 HydrophobicContact CD1-CG2 3.97Å; I248-I254 HydrophobicContact CD1-CD1 4.48Å; I251-I254 HydrophobicContact CD1-CG1 4.07Å; I254-H267 CarbonylContact O-C 3.58Å; I254-H267 WeakPolarHBondContact O-CA 3.41Å; I254-H267 WeakPolarHBondContact O-CB 3.36Å; I254-V268 HydrophobicContact CB-CG1 3.95Å; I254-V268 PolarHBondContact N-O 3.34Å; I254-V268 PolarHBondContact O-N 3.34Å; I254-I270 HydrophobicContact CD1-CD1 3.82Å; I254-I270 HydrophobicContact CG1-CD1 3.85Å; I254-I270 HydrophobicContact CG1-CG1 4.33Å
255	S	98.4	Very high	94	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.9	-172.8	175.4	0	0	0	0	111.7	F198 F199 N264 A266	F198-S255 CarbonylContact C-O 3.56Å; F198-S255 WeakPolarHBondContact CA-O 3.25Å; F199-S255 PolarHBondContact N-O 2.97Å; F199-S255 PolarHBondContact O-N 3.1Å; S255-N264 PolarHBondContact OG-OD1 3.07Å; S255-A266 CarbonylContact C-O 3.59Å; S255-A266 WeakPolarHBondContact CA-O 3.36Å; S255-A266 WeakPolarHBondContact CB-O 2.94Å; S255-A266 PolarHBondContact OG-O 3.31Å
256	L	98.2	Very high	94.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	112.7	153.3	-174.3	66.7	0	0	0	107.2	V168 F188 F198 L228 F265 A266	V168-L256 HydrophobicContact CB-CD2 4.49Å; V168-L256 HydrophobicContact CG1-CB 4.37Å; V168-L256 HydrophobicContact CG1-CD2 3.57Å; V168-L256 HydrophobicContact CG2-CD2 4.06Å; F188-L256 HydrophobicContact CB-CD2 4.4Å; F188-L256 HydrophobicContact CD1-CD2 3.83Å; F188-L256 HydrophobicContact CD2-CD2 3.76Å; F188-L256 HydrophobicContact CE1-CD1 4.49Å; F188-L256 HydrophobicContact CE1-CD2 3.92Å; F188-L256 HydrophobicContact CE2-CD2 3.83Å; F188-L256 HydrophobicContact CG-CD2 3.74Å; F188-L256 HydrophobicContact CZ-CD2 3.9Å; F198-L256 HydrophobicContact CD1-CD1 4.34Å; F198-L256 HydrophobicContact CE1-CB 4.42Å; F198-L256 HydrophobicContact CE1-CD1 4.21Å; F198-L256 HydrophobicContact CZ-CD1 4.47Å; L228-L256 HydrophobicContact CD1-CD1 4.1Å; L228-L256 HydrophobicContact CD2-CD1 4.26Å; L256-F265 WeakPolarHBondContact O-CB 3.44Å; L256-F265 PolarHBondContact O-N 2.96Å; L256-A266 PolarHBondContact N-O 3.11Å; L256-A266 PolarHBondContact O-N 3.3Å
257	Y	97.2	Very high	94.7	Very high	4 Å²	4	24 Å²	24	2%	0.016	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130.7	-167.1	-165.9	-97.8	0	0	0	110.9	S196 F197 F199 P206 R208 Y259 A262 N264	S196-Y257 WeakPolarHBondContact CA-O 3.5Å; F197-Y257 PolarHBondContact N-O 2.81Å; F197-Y257 PolarHBondContact O-N 3.08Å; F199-Y257 HydrophobicContact CB-CG 4.37Å; F199-Y257 HydrophobicContact CD1-CD1 4.14Å; F199-Y257 HydrophobicContact CD1-CD2 4.42Å; F199-Y257 HydrophobicContact CD1-CG 4Å; F199-Y257 HydrophobicContact CE1-CD1 4.44Å; F199-Y257 HydrophobicContact CG-CD1 4.48Å; F199-Y257 HydrophobicContact CG-CG 4.33Å; P206-Y257 HydrophobicContact CB-CD2 4.08Å; P206-Y257 HydrophobicContact CB-CE2 4.27Å; R208-Y257 HydrophobicContact CB-CE1 4.19Å; R208-Y257 PolarHBondContact N-OH 2.77Å; Y257-Y259 PolarHBondContact O-N 3.06Å; Y257-A262 VanDerWaalsContact CZ-C 3.42Å; Y257-A262 WeakPolarHBondContact OH-CA 3.3Å; Y257-A262 WeakPolarHBondContact OH-CB 3.15Å; Y257-A262 PolarHBondContact OH-O 3.05Å; Y257-N264 HydrophobicContact CD2-CB 4.13Å; Y257-N264 HydrophobicContact CE2-CB 4.19Å
258	C	93.4	Very high	94.9	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.007	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	101.6	167	-179.5	0	0	0	0	109.8	P194 D195 R260 A262 V263 F265	P194-C258 VanDerWaalsContact CG-SG 3.53Å; D195-C258 CarbonylContact O-C 3.59Å; D195-C258 WeakPolarHBondContact O-CA 3.29Å; D195-C258 PolarHBondContact O-SG 2.97Å; C258-R260 VanDerWaalsContact C-N 3.31Å; C258-R260 PolarHBondContact O-N 3.38Å; C258-A262 WeakPolarHBondContact O-CA 3.49Å; C258-A262 PolarHBondContact O-N 3.02Å; C258-A262 VanDerWaalsContact O-N 3.09Å; C258-V263 HydrophobicContact CB-CB 4.13Å; C258-V263 PolarHBondContact N-O 3.17Å; C258-V263 PolarHBondContact O-N 3.19Å; C258-V263 VanDerWaalsContact O-N 3.11Å; C258-F265 HydrophobicContact CB-CD1 4.45Å; C258-F265 HydrophobicContact CB-CD2 4.44Å; C258-F265 HydrophobicContact CB-CE1 3.83Å; C258-F265 HydrophobicContact CB-CE2 3.84Å; C258-F265 HydrophobicContact CB-CZ 3.5Å; C258-F265 VanDerWaalsContact CB-CZ 3.5Å
259	Y	90.3	Very high	94.9	Very high	82 Å²	82	27.9 Å²	27.9	32%	0.322	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-33.3	-179.7	-165.5	-92.9	0	0	0	111.5	D195 F199 R208 Y257	D195-Y259 PolarHBondContact O-N 3.17Å; F199-Y259 HydrophobicContact CE2-CD2 4.19Å; F199-Y259 HydrophobicContact CE2-CE2 4.24Å; F199-Y259 HydrophobicContact CZ-CD2 4.42Å; F199-Y259 HydrophobicContact CZ-CE2 4.29Å; R208-Y259 HydrophobicContact CG-CD2 4.15Å; R208-Y259 HydrophobicContact CG-CE2 3.65Å; R208-Y259 PolarHBondContact NE-O 2.98Å; R208-Y259 PolarHBondContact NH1-O 2.94Å; R208-Y259 VanDerWaalsContact NH1-O 3.09Å; R208-Y259 PolarHBondContact NH2-O 3.23Å; Y257-Y259 PolarHBondContact O-N 3.06Å
260	R	86.2	Confident	95	Very high	20 Å²	20	24.5 Å²	24.5	8%	0.075	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-47.8	-179.5	172.4	178.5	177.5	-166.7	-10.1	113.4	D195 R208 C258 D380 Y382 G383 F480	D195-R260 HydrophobicContact CB-CB 3.87Å; R208-R260 VanDerWaalsContact NH2-C 3.31Å; R208-R260 PolarHBondContact NH2-O 3.09Å; C258-R260 VanDerWaalsContact C-N 3.31Å; C258-R260 PolarHBondContact O-N 3.38Å; R260-D380 IonicContact CZ-OD1 2.82Å; R260-D380 IonicContact CZ-OD2 3.49Å; R260-D380 IonicContact NE-OD1 3.7Å; R260-D380 PolarHBondContact NE-OD1 3.47Å; R260-D380 IonicContact NH2-OD1 3.97Å; R260-D380 PolarHBondContact NH2-OD1 2.91Å; R260-D380 IonicContact NH2-OD2 3.9Å; R260-D380 PolarHBondContact NH2-OD2 3.12Å; R260-Y382 HydrophobicContact CB-CE2 4.25Å; R260-Y382 HydrophobicContact CG-CD2 3.88Å; R260-Y382 HydrophobicContact CG-CE2 3.77Å; R260-Y382 VanDerWaalsContact CZ-CB 3.43Å; R260-G383 PolarHBondContact NH1-O 3.21Å; R260-G383 PolarHBondContact NH2-O 2.83Å; R260-F480 VanDerWaalsContact NH1-CE1 3.25Å
261	F	86.7	Confident	94.9	Very high	12 Å²	12	25.7 Å²	25.7	5%	0.053	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	7.9	-176.1	-61	-65.6	0	0	0	114	P194 V263 L388 D392 I396	P194-F261 HydrophobicContact CB-CD2 3.92Å; P194-F261 HydrophobicContact CB-CE2 3.6Å; P194-F261 HydrophobicContact CG-CD2 3.86Å; P194-F261 HydrophobicContact CG-CE2 3.94Å; F261-V263 HydrophobicContact CB-CG2 4.02Å; F261-V263 PolarHBondContact O-N 3.41Å; F261-L388 HydrophobicContact CE1-CD1 4.41Å; F261-L388 HydrophobicContact CE2-CD2 3.43Å; F261-L388 VanDerWaalsContact CE2-CD2 3.43Å; F261-L388 HydrophobicContact CZ-CD1 3.69Å; F261-L388 HydrophobicContact CZ-CD2 3.48Å; F261-L388 VanDerWaalsContact CZ-CD2 3.48Å; F261-L388 HydrophobicContact CZ-CG 4.2Å; F261-D392 HydrophobicContact CD1-CB 3.85Å; F261-D392 HydrophobicContact CD2-CB 4.31Å; F261-D392 HydrophobicContact CE1-CB 3.83Å; F261-D392 HydrophobicContact CE2-CB 4.29Å; F261-D392 HydrophobicContact CG-CB 4.1Å; F261-D392 HydrophobicContact CZ-CB 4.05Å; F261-I396 HydrophobicContact CE1-CD1 4.29Å; F261-I396 HydrophobicContact CZ-CD1 4.44Å
262	A	90.5	Very high	94.8	Very high	46 Å²	46	31 Å²	31	38%	0.38	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	39.2	-174.7	0	0	0	0	0	113.3	R208 Y257 C258	R208-A262 HydrophobicContact CB-CB 4.22Å; R208-A262 VanDerWaalsContact NH2-N 3.18Å; Y257-A262 VanDerWaalsContact CZ-C 3.42Å; Y257-A262 WeakPolarHBondContact OH-CA 3.3Å; Y257-A262 WeakPolarHBondContact OH-CB 3.15Å; Y257-A262 PolarHBondContact OH-O 3.05Å; C258-A262 WeakPolarHBondContact O-CA 3.49Å; C258-A262 PolarHBondContact O-N 3.02Å; C258-A262 VanDerWaalsContact O-N 3.09Å
263	V	91.6	Very high	94.6	Very high	9 Å²	9	29.5 Å²	29.5	6%	0.055	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.8	-175.5	168.2	0	0	0	0	111.2	K162 C258 F261 F265	K162-V263 HydrophobicContact CB-CG1 3.7Å; K162-V263 HydrophobicContact CD-CB 4.33Å; K162-V263 HydrophobicContact CD-CG1 3.37Å; K162-V263 HydrophobicContact CD-CG2 3.95Å; K162-V263 HydrophobicContact CG-CG1 4.17Å; C258-V263 HydrophobicContact CB-CB 4.13Å; C258-V263 PolarHBondContact N-O 3.17Å; C258-V263 PolarHBondContact O-N 3.19Å; C258-V263 VanDerWaalsContact O-N 3.11Å; F261-V263 HydrophobicContact CB-CG2 4.02Å; F261-V263 PolarHBondContact O-N 3.41Å; V263-F265 HydrophobicContact CB-CE1 4.29Å; V263-F265 HydrophobicContact CG1-CD1 3.63Å; V263-F265 HydrophobicContact CG1-CE1 3.64Å; V263-F265 PolarHBondContact O-N 3.18Å
264	N	95.4	Very high	94.4	Very high	20 Å²	20	31.3 Å²	31.3	11%	0.107	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	115.7	168.1	-179.6	14.5	0	0	0	110.4	T160 P206 S255 Y257 A266 H267	T160-N264 HydrophobicContact CG2-CB 4.4Å; T160-N264 WeakPolarHBondContact CG2-O 3.33Å; T160-N264 PolarHBondContact OG1-O 2.96Å; P206-N264 HydrophobicContact CB-CB 4.17Å; P206-N264 WeakPolarHBondContact CD-ND2 3.11Å; P206-N264 HydrophobicContact CG-CB 4.49Å; P206-N264 WeakPolarHBondContact CG-ND2 3.45Å; S255-N264 PolarHBondContact OG-OD1 3.07Å; Y257-N264 HydrophobicContact CD2-CB 4.13Å; Y257-N264 HydrophobicContact CE2-CB 4.19Å; N264-A266 VanDerWaalsContact OD1-C 3.31Å; N264-A266 PolarHBondContact OD1-N 3.45Å; N264-A266 PolarHBondContact OD1-O 2.77Å; N264-A266 VanDerWaalsContact OD1-O 3.05Å; N264-H267 PolarHBondContact ND2-ND1 3.38Å
265	F	96.9	Very high	94	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.018	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-44.7	175.6	-69.5	-21.5	0	0	0	112.3	T160 K162 G163 Y166 V168 F188 A193 P194 S196 L256 C258 V263	T160-F265 PolarHBondContact N-O 3.22Å; T160-F265 PolarHBondContact OG1-O 3.24Å; K162-F265 HydrophobicContact CB-CD1 4.5Å; G163-F265 VanDerWaalsContact CA-O 3.26Å; G163-F265 WeakPolarHBondContact CA-O 3.27Å; Y166-F265 HydrophobicContact CD2-CD1 4.42Å; Y166-F265 HydrophobicContact CD2-CD2 4.41Å; Y166-F265 HydrophobicContact CD2-CE1 4.01Å; Y166-F265 AromaticContact CD2-CE2 3.95Å; Y166-F265 HydrophobicContact CD2-CE2 3.95Å; Y166-F265 AromaticContact CD2-CZ 3.74Å; Y166-F265 HydrophobicContact CD2-CZ 3.74Å; Y166-F265 AromaticContact CE2-CE1 3.79Å; Y166-F265 HydrophobicContact CE2-CE1 3.79Å; Y166-F265 HydrophobicContact CE2-CE2 4.12Å; Y166-F265 AromaticContact CE2-CZ 3.49Å; Y166-F265 HydrophobicContact CE2-CZ 3.49Å; Y166-F265 VanDerWaalsContact CE2-CZ 3.49Å; V168-F265 HydrophobicContact CG2-CB 4.07Å; F188-F265 HydrophobicContact CE2-CD2 4.19Å; F188-F265 HydrophobicContact CE2-CE2 4.4Å; F188-F265 HydrophobicContact CZ-CD2 4.36Å; F188-F265 HydrophobicContact CZ-CE2 4.4Å; A193-F265 HydrophobicContact CB-CE2 4.13Å; P194-F265 HydrophobicContact CG-CZ 3.93Å; S196-F265 VanDerWaalsContact OG-CE2 3.29Å; S196-F265 WeakPolarHBondContact OG-CE2 3.33Å; L256-F265 WeakPolarHBondContact O-CB 3.44Å; L256-F265 PolarHBondContact O-N 2.96Å; C258-F265 HydrophobicContact CB-CD1 4.45Å; C258-F265 HydrophobicContact CB-CD2 4.44Å; C258-F265 HydrophobicContact CB-CE1 3.83Å; C258-F265 HydrophobicContact CB-CE2 3.84Å; C258-F265 HydrophobicContact CB-CZ 3.5Å; C258-F265 VanDerWaalsContact CB-CZ 3.5Å; V263-F265 HydrophobicContact CB-CE1 4.29Å; V263-F265 HydrophobicContact CG1-CD1 3.63Å; V263-F265 HydrophobicContact CG1-CE1 3.64Å; V263-F265 PolarHBondContact O-N 3.18Å
266	A	98.1	Very high	93.7	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	155.3	173.8	0	0	0	0	0	109.7	L157 R158 V168 S255 L256 N264	L157-A266 HydrophobicContact CB-CB 4.15Å; R158-A266 WeakPolarHBondContact O-CA 3.42Å; R158-A266 VanDerWaalsContact O-CB 3.27Å; R158-A266 WeakPolarHBondContact O-CB 3.36Å; V168-A266 HydrophobicContact CB-CB 4.25Å; V168-A266 HydrophobicContact CG1-CB 3.33Å; S255-A266 CarbonylContact C-O 3.59Å; S255-A266 WeakPolarHBondContact CA-O 3.36Å; S255-A266 WeakPolarHBondContact CB-O 2.94Å; S255-A266 PolarHBondContact OG-O 3.31Å; L256-A266 PolarHBondContact N-O 3.11Å; L256-A266 PolarHBondContact O-N 3.3Å; N264-A266 VanDerWaalsContact OD1-C 3.31Å; N264-A266 PolarHBondContact OD1-N 3.45Å; N264-A266 PolarHBondContact OD1-O 2.77Å; N264-A266 VanDerWaalsContact OD1-O 3.05Å
267	H	98.1	Very high	93.6	Very high	30 Å²	30	39 Å²	39	14%	0.139	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	162	171.2	72.4	-78.9	0	0	0	112.5	R158 E205 P206 I254 N264	R158-H267 PolarHBondContact N-O 2.98Å; R158-H267 PolarHBondContact O-N 2.68Å; R158-H267 VanDerWaalsContact O-N 3.1Å; E205-H267 IonicContact OE2-CE1 2.72Å; E205-H267 PolarHBondContact OE2-CE1 2.76Å; E205-H267 IonicContact OE2-NE2 3.56Å; P206-H267 HydrophobicContact CG-CB 3.79Å; I254-H267 CarbonylContact O-C 3.58Å; I254-H267 WeakPolarHBondContact O-CA 3.41Å; I254-H267 WeakPolarHBondContact O-CB 3.36Å; N264-H267 PolarHBondContact ND2-ND1 3.38Å
268	V	97.6	Very high	93.6	Very high	12 Å²	12	38.8 Å²	38.8	7%	0.073	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139.5	165.1	63.5	0	0	0	0	107.5	L153 L157 V173 W253 I254	L153-V268 HydrophobicContact CB-CG2 4.27Å; L153-V268 HydrophobicContact CD1-CG1 3.92Å; L153-V268 HydrophobicContact CD1-CG2 3.76Å; L157-V268 HydrophobicContact CD2-CB 4.38Å; L157-V268 HydrophobicContact CD2-CG1 4.08Å; V173-V268 HydrophobicContact CG2-CG1 4.35Å; W253-V268 VanDerWaalsContact CA-O 3.28Å; W253-V268 WeakPolarHBondContact CA-O 3.36Å; I254-V268 HydrophobicContact CB-CG1 3.95Å; I254-V268 PolarHBondContact N-O 3.34Å; I254-V268 PolarHBondContact O-N 3.34Å
269	R	96.9	Very high	93.6	Very high	105 Å²	105	38.9 Å²	38.9	40%	0.396	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	141.7	176.5	-68.7	-172.4	174.3	-149.2	3.2	110.3	P204 E205 D252 Q271	P204-R269 VanDerWaalsContact O-CZ 3.3Å; P204-R269 PolarHBondContact O-NH2 3.43Å; E205-R269 IonicContact OE1-CZ 3.35Å; E205-R269 IonicContact OE1-NH2 3.68Å; E205-R269 PolarHBondContact OE1-NH2 3.22Å; D252-R269 CarbonylContact O-C 3.19Å; D252-R269 WeakPolarHBondContact O-CA 3.47Å; R269-Q271 HydrophobicContact CB-CG 4.18Å
270	I	95.4	Very high	93.7	Very high	13 Å²	13	37.3 Å²	37.3	7%	0.067	19%	0.189	C	C	.	.			trans	-92.1	99.3	173.9	-53.4	-50.6	0	0	0	107.5	L153 I248 I251 D252 I254 I273	L153-I270 HydrophobicContact CD1-CD1 3.43Å; L153-I270 VanDerWaalsContact CD1-CD1 3.43Å; L153-I270 HydrophobicContact CD2-CD1 4.14Å; L153-I270 HydrophobicContact CG-CD1 4.42Å; I248-I270 HydrophobicContact CD1-CD1 3.76Å; I248-I270 HydrophobicContact CD1-CG1 3.94Å; I248-I270 HydrophobicContact CD1-CG2 3.93Å; I248-I270 HydrophobicContact CG1-CG2 3.95Å; I251-I270 HydrophobicContact CD1-CG1 4.27Å; I251-I270 HydrophobicContact CG1-CG1 4.21Å; D252-I270 PolarHBondContact O-N 2.96Å; I254-I270 HydrophobicContact CD1-CD1 3.82Å; I254-I270 HydrophobicContact CG1-CD1 3.85Å; I254-I270 HydrophobicContact CG1-CG1 4.33Å; I270-I273 HydrophobicContact CG2-CD1 3.82Å; I270-I273 HydrophobicContact CG2-CG1 4.47Å; I270-I273 HydrophobicContact CG2-CG2 3.89Å
271	Q	92.8	Very high	93.7	Very high	100 Å²	100	37.5 Å²	37.5	47%	0.467	19%	0.192	S	C	.	.			trans	-140.7	158.8	-178.1	-65.4	-177.8	-21.3	0	0	109.5	R269 I273	R269-Q271 HydrophobicContact CB-CG 4.18Å; Q271-I273 PolarHBondContact O-N 3.49Å; Q271-I273 VanDerWaalsContact O-N 3.13Å
272	N	93.2	Very high	93.1	Very high	117 Å²	117	39.9 Å²	39.9	63%	0.626	21%	0.209	S	C	*	.	S	Bend	trans	54	34.5	176.4	-56.3	-28.8	0	0	0	113.5	Q151 E154	Q151-N272 PolarHBondContact NE2-O 3.38Å; E154-N272 PolarHBondContact OE1-ND2 3.33Å
273	I	93.7	Very high	92.1	Very high	41 Å²	41	40.3 Å²	40.3	21%	0.21	21%	0.213	C	C	.	.			trans	-84	137.4	178	60.5	170.8	0	0	0	111	L153 I175 I248 Y249 I270 Q271	L153-I273 HydrophobicContact CD2-CG2 4.06Å; I175-I273 HydrophobicContact CD1-CG2 3.58Å; I248-I273 HydrophobicContact CG1-CD1 4.33Å; I248-I273 HydrophobicContact CG2-CD1 4.19Å; Y249-I273 HydrophobicContact CD1-CD1 3.37Å; Y249-I273 HydrophobicContact CD1-CG1 4.09Å; Y249-I273 HydrophobicContact CE1-CD1 3.6Å; Y249-I273 HydrophobicContact CE1-CG1 4.01Å; Y249-I273 HydrophobicContact CG-CD1 4.21Å; I270-I273 HydrophobicContact CG2-CD1 3.82Å; I270-I273 HydrophobicContact CG2-CG1 4.47Å; I270-I273 HydrophobicContact CG2-CG2 3.89Å; Q271-I273 PolarHBondContact O-N 3.49Å; Q271-I273 VanDerWaalsContact O-N 3.13Å
274	S	93.5	Very high	90.9	Very high	41 Å²	41	42.6 Å²	42.6	29%	0.287	23%	0.233	S	C	.	.			trans	-59.9	146.9	174.6	177.4	0	0	0	0	110.9	Y249 R276 I277	Y249-S274 WeakPolarHBondContact CE1-O 3.49Å; Y249-S274 VanDerWaalsContact CZ-O 3.31Å; Y249-S274 PolarHBondContact OH-O 2.82Å; S274-R276 PolarHBondContact O-N 3.3Å; S274-R276 PolarHBondContact OG-N 3.17Å; S274-I277 WeakPolarHBondContact O-CG1 3.5Å
275	D	90.9	Very high	89.1	Confident	127 Å²	127	50.2 Å²	50.2	68%	0.679	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-8.2	169.3	62.7	-22.6	0	0	0	112.8	Y249	Y249-D275 VanDerWaalsContact OH-C 3.24Å; Y249-D275 WeakPolarHBondContact OH-CA 3.32Å; Y249-D275 PolarHBondContact OH-O 2.72Å
276	R	92.3	Very high	87	Confident	34 Å²	34	56.3 Å²	56.3	13%	0.128	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	31.3	-178.3	-62.3	-75.6	-65.9	163	2.1	113.7	D35 A146 P148 T149 S274	D35-R276 IonicContact OD1-CZ 2.67Å; D35-R276 IonicContact OD1-NH1 3.91Å; D35-R276 PolarHBondContact OD1-NH1 2.88Å; D35-R276 IonicContact OD1-NH2 3.4Å; D35-R276 PolarHBondContact OD1-NH2 2.84Å; D35-R276 IonicContact OD2-CZ 3.18Å; D35-R276 IonicContact OD2-NH1 2.8Å; D35-R276 PolarHBondContact OD2-NH1 3.21Å; D35-R276 IonicContact OD2-NH2 2.78Å; D35-R276 PolarHBondContact OD2-NH2 3.22Å; A146-R276 PolarHBondContact O-NH2 2.95Å; P148-R276 CarbonylContact C-O 3.43Å; P148-R276 WeakPolarHBondContact CA-O 3.45Å; P148-R276 VanDerWaalsContact CB-O 3.31Å; P148-R276 WeakPolarHBondContact CB-O 3.13Å; T149-R276 PolarHBondContact N-O 3.14Å; S274-R276 PolarHBondContact O-N 3.3Å; S274-R276 PolarHBondContact OG-N 3.17Å
277	I	95.5	Very high	84.8	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-69.8	132.8	170.7	-61.1	-63.5	0	0	0	109.5	W32 Q151 I175 R178 I248 Y249 S274	W32-I277 WeakPolarHBondContact CZ3-O 3.27Å; Q151-I277 HydrophobicContact CB-CD1 3.54Å; I175-I277 HydrophobicContact CG2-CD1 4.22Å; I175-I277 HydrophobicContact CG2-CG1 4.42Å; I175-I277 HydrophobicContact CG2-CG2 3.64Å; R178-I277 HydrophobicContact CG-CB 4.46Å; R178-I277 HydrophobicContact CG-CG2 4.15Å; R178-I277 PolarHBondContact NE-O 3.21Å; I248-I277 HydrophobicContact CG2-CG2 4.43Å; Y249-I277 HydrophobicContact CE2-CB 4.39Å; Y249-I277 VanDerWaalsContact OH-CB 3.25Å; Y249-I277 WeakPolarHBondContact OH-CB 3.45Å; Y249-I277 WeakPolarHBondContact OH-CG1 3.32Å; Y249-I277 PolarHBondContact OH-N 2.74Å; Y249-I277 VanDerWaalsContact OH-N 3.16Å; S274-I277 WeakPolarHBondContact O-CG1 3.5Å
278	P	95.8	Very high	82.5	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.006	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-51	147.2	-179.7	-30.4	34.5	0	0	0	113.8	V55 N56 P148 T149 D177 R178	V55-P278 HydrophobicContact CG1-CB 4.34Å; N56-P278 HydrophobicContact CB-CB 4.42Å; N56-P278 HydrophobicContact CB-CG 4.02Å; P148-P278 HydrophobicContact CB-CB 4.42Å; P148-P278 HydrophobicContact CB-CG 4.1Å; T149-P278 WeakPolarHBondContact O-CD 3.33Å; D177-P278 CarbonylContact C-O 3.57Å; D177-P278 WeakPolarHBondContact CA-O 3.43Å; D177-P278 HydrophobicContact CB-CB 4.1Å; D177-P278 WeakPolarHBondContact CB-O 3.42Å; R178-P278 WeakPolarHBondContact CG-O 3.39Å; R178-P278 PolarHBondContact N-O 2.9Å
279	P	95.1	Very high	79.8	Confident	2 Å²	2	73.3 Å²	73.3	1%	0.013	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-66.8	154.3	172.4	35.5	-39.1	0	0	0	110.7	W32 V55 D177 V281	W32-P279 HydrophobicContact CE3-CB 3.96Å; W32-P279 HydrophobicContact CE3-CG 4.42Å; W32-P279 HydrophobicContact CZ3-CB 4.29Å; W32-P279 HydrophobicContact CZ3-CG 4.39Å; W32-P279 WeakPolarHBondContact O-CB 3.4Å; V55-P279 HydrophobicContact CB-CG 4.33Å; V55-P279 HydrophobicContact CG1-CG 3.98Å; V55-P279 HydrophobicContact CG2-CG 4.25Å; V55-P279 WeakPolarHBondContact O-CD 3.25Å; D177-P279 WeakPolarHBondContact CB-O 3.4Å; P279-V281 PolarHBondContact O-N 3.04Å
280	Y	92.1	Very high	77.4	Confident	49 Å²	49	73.5 Å²	73.5	19%	0.192	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-68.5	129.4	174.2	172.2	-102.7	0	0	0	110.3	R179 P282	R179-Y280 HydrophobicContact CB-CD2 3.65Å; R179-Y280 HydrophobicContact CB-CE2 4.37Å; R179-Y280 HydrophobicContact CB-CG 3.89Å; R179-Y280 HydrophobicContact CG-CG 4.32Å; R179-Y280 VanDerWaalsContact NH1-CD1 3.32Å; Y280-P282 HydrophobicContact CD1-CG 4.48Å; Y280-P282 HydrophobicContact CE1-CB 4.26Å; Y280-P282 HydrophobicContact CE1-CG 3.99Å
281	V	85.9	Confident	75.2	Confident	24 Å²	24	82.6 Å²	82.6	15%	0.145	45%	0.447	C	S	.	.			trans	-111.7	121.5	172.5	-177.7	0	0	0	0	108.6	V55 V110 P279 A283	V55-V281 HydrophobicContact CB-CG2 4.24Å; V55-V281 HydrophobicContact CG1-CG2 3.53Å; V55-V281 HydrophobicContact CG2-CG2 3.7Å; V110-V281 HydrophobicContact CB-CG1 4.13Å; V110-V281 HydrophobicContact CG1-CG1 3.55Å; V110-V281 HydrophobicContact CG2-CG1 3.41Å; V110-V281 VanDerWaalsContact CG2-CG1 3.41Å; P279-V281 PolarHBondContact O-N 3.04Å; V281-A283 PolarHBondContact O-N 2.78Å
282	P	74.5	Confident	73.2	Confident	62 Å²	62	86.3 Å²	86.3	40%	0.403	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-57.1	134.7	176.6	-22.1	32.1	0	0	0	111.1	Y280 A284	Y280-P282 HydrophobicContact CD1-CG 4.48Å; Y280-P282 HydrophobicContact CE1-CB 4.26Å; Y280-P282 HydrophobicContact CE1-CG 3.99Å; P282-A284 PolarHBondContact O-N 2.94Å
283	A	69.7	Low	71.3	Confident	56 Å²	56	90.1 Å²	90.1	46%	0.463	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-60.3	131.1	172.2	0	0	0	0	0	110	V281 K285	V281-A283 PolarHBondContact O-N 2.78Å; A283-K285 PolarHBondContact O-N 2.89Å
284	A	65	Low	69.5	Low	57 Å²	57	96.8 Å²	96.8	47%	0.471	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-60.6	126.5	175.1	0	0	0	0	0	109.9	F94 P282	F94-A284 HydrophobicContact CB-CB 4.08Å; F94-A284 HydrophobicContact CD1-CB 3.65Å; F94-A284 HydrophobicContact CD2-CB 3.52Å; F94-A284 HydrophobicContact CE1-CB 3.9Å; F94-A284 HydrophobicContact CE2-CB 3.77Å; F94-A284 HydrophobicContact CG-CB 3.45Å; F94-A284 VanDerWaalsContact CG-CB 3.45Å; F94-A284 HydrophobicContact CZ-CB 3.95Å; P282-A284 PolarHBondContact O-N 2.94Å
285	K	59.3	Low	68.3	Low	179 Å²	179	99.5 Å²	99.5	78%	0.778	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-93	120.6	-179.5	-67.4	-178.4	-179.2	177.4	0	109	F94 A283 V287	F94-K285 WeakPolarHBondContact CE1-O 3.27Å; A283-K285 PolarHBondContact O-N 2.89Å; K285-V287 PolarHBondContact O-N 3.12Å
286	H	52.5	Low	67.8	Low	132 Å²	132	101 Å²	101	61%	0.611	51%	0.509	S	S	*	.			trans	-61.4	107.1	160.9	-87.4	-83.1	0	0	0	107.7	F94 L288	F94-H286 AromaticContact CE2-CD2 3.87Å; F94-H286 AromaticContact CE2-NE2 3.75Å; F94-H286 HydrophobicContact CZ-CB 4.38Å; F94-H286 AromaticContact CZ-CD2 3.71Å; F94-H286 AromaticContact CZ-CG 3.8Å; F94-H286 AromaticContact CZ-NE2 3.93Å; H286-L288 PolarHBondContact O-N 2.84Å
287	V	50.6	Low	67.5	Low	135 Å²	135	102.5 Å²	102.5	82%	0.818	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-1.1	175.3	-178.6	0	0	0	0	111.7	K285 T289	K285-V287 PolarHBondContact O-N 3.12Å; V287-T289 PolarHBondContact O-N 3.22Å
288	L	49.7	Very low	67.2	Low	150 Å²	150	102.8 Å²	102.8	79%	0.785	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	0.5	-175.3	-63.2	-178.2	0	0	0	115.8	H286 P290	H286-L288 PolarHBondContact O-N 2.84Å; L288-P290 WeakPolarHBondContact O-CD 3.15Å
289	T	42.5	Very low	66.9	Low	114 Å²	114	106.7 Å²	106.7	70%	0.699	55%	0.552	S	S	*	*	S	Bend	trans	-84	109.4	161.9	31	0	0	0	0	107	V287 K291	V287-T289 PolarHBondContact O-N 3.22Å; T289-K291 PolarHBondContact O-N 3.45Å; T289-K291 VanDerWaalsContact O-N 3.14Å
290	P	46	Very low	66.5	Low	110 Å²	110	109.5 Å²	109.5	71%	0.714	57%	0.566	S	S	*	*			trans	-49.1	130.2	165.1	-18.5	31	0	0	0	105.8	L288 E292	L288-P290 WeakPolarHBondContact O-CD 3.15Å; P290-E292 VanDerWaalsContact C-N 3.3Å; P290-E292 PolarHBondContact O-N 3.43Å
291	K	48	Very low	66.5	Low	203 Å²	203	107.7 Å²	107.7	88%	0.883	56%	0.561	S	S	*	*			trans	-50.9	106.9	170.5	-76.2	-177.2	178.1	178.8	0	105.2	T289 K293	T289-K291 PolarHBondContact O-N 3.45Å; T289-K291 VanDerWaalsContact O-N 3.14Å; K291-K293 PolarHBondContact O-N 2.9Å
292	E	51.5	Low	66.9	Low	178 Å²	178	107.4 Å²	107.4	83%	0.832	56%	0.559	S	S	*	*			trans	-49.2	122.4	171.1	-77	-177.6	160.6	0	0	104.4	P290 K294	P290-E292 VanDerWaalsContact C-N 3.3Å; P290-E292 PolarHBondContact O-N 3.43Å; E292-K294 VanDerWaalsContact C-N 3.28Å; E292-K294 PolarHBondContact O-N 3.27Å
293	K	52.5	Low	67.9	Low	197 Å²	197	104.5 Å²	104.5	86%	0.857	54%	0.54	S	S	*	.			trans	-54.3	105.6	177.4	-73.9	-178.4	177.6	179.8	0	104.3	K291 R295	K291-K293 PolarHBondContact O-N 2.9Å; K293-R295 PolarHBondContact O-N 3Å
294	K	56.5	Low	69.1	Low	182 Å²	182	102.2 Å²	102.2	79%	0.791	52%	0.52	S	S	*	.			trans	-60.2	92.2	177.6	-81.1	-171.9	176	-175.5	0	105.2	E292	E292-K294 VanDerWaalsContact C-N 3.28Å; E292-K294 PolarHBondContact O-N 3.27Å
295	R	68.9	Low	70.6	Confident	98 Å²	98	99.7 Å²	99.7	37%	0.37	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-67.2	138.4	178.6	-68	176.7	78.5	-178	5.8	106.4	K293 R323 D436 S437 D439	K293-R295 PolarHBondContact O-N 3Å; R295-R323 VanDerWaalsContact CB-NE 3.3Å; R295-R323 VanDerWaalsContact NH2-NH1 3.17Å; R295-D436 PolarHBondContact NH1-O 3.02Å; R295-S437 VanDerWaalsContact NH1-C 3.28Å; R295-S437 PolarHBondContact NH1-O 3.22Å; R295-S437 PolarHBondContact NH2-O 3.38Å; R295-S437 VanDerWaalsContact NH2-O 3.17Å; R295-D439 IonicContact CZ-OD1 3.61Å; R295-D439 IonicContact NH2-OD1 3.25Å; R295-D439 PolarHBondContact NH2-OD1 3.06Å
296	E	80.9	Confident	72	Confident	157 Å²	157	96.5 Å²	96.5	73%	0.734	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-61.6	150.9	-176.8	-67.6	178.6	174.8	0	0	111.1	R323	E296-R323 PolarHBondContact O-NE 2.75Å; E296-R323 PolarHBondContact O-NH2 3.01Å
297	P	85.6	Confident	73.5	Confident	66 Å²	66	96.1 Å²	96.1	43%	0.429	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-53.3	148.6	172	-19	30.9	0	0	0	110.8	R323 S327	P297-R323 WeakPolarHBondContact CA-O 3.15Å; P297-S327 VanDerWaalsContact CB-OG 3.27Å; P297-S327 WeakPolarHBondContact CB-OG 3.45Å; P297-S327 WeakPolarHBondContact CG-OG 3.46Å
298	W	89.4	Confident	75.3	Confident	6 Å²	6	95.4 Å²	95.4	2%	0.023	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-60.6	144.4	168.5	-67.9	-13.9	0	0	0	110.1	I300 R323 A324 M344 P435 M438 D439 F441 F444	W298-I300 PolarHBondContact O-N 2.83Å; W298-R323 PolarHBondContact N-O 3.4Å; W298-A324 HydrophobicContact CD2-CB 4.29Å; W298-A324 HydrophobicContact CE3-CB 3.64Å; W298-A324 HydrophobicContact CH2-CB 4.42Å; W298-A324 HydrophobicContact CZ3-CB 3.71Å; W298-M344 HydrophobicContact CE3-CE 4.3Å; W298-M344 HydrophobicContact CZ3-CE 4.49Å; W298-P435 HydrophobicContact CH2-CB 4.05Å; W298-P435 HydrophobicContact CZ2-CB 4.48Å; W298-P435 VanDerWaalsContact CZ2-O 3.32Å; W298-P435 WeakPolarHBondContact CZ2-O 3.38Å; W298-M438 HydrophobicContact CZ2-CB 4.15Å; W298-M438 PolarHBondContact NE1-O 3.4Å; W298-D439 VanDerWaalsContact CD1-O 3.29Å; W298-F441 HydrophobicContact CE3-CB 3.9Å; W298-F441 HydrophobicContact CZ3-CB 4.24Å; W298-F441 HydrophobicContact CZ3-CD2 4.32Å; W298-F444 HydrophobicContact CH2-CB 3.54Å; W298-F444 AromaticContact CH2-CD1 3.9Å; W298-F444 HydrophobicContact CH2-CD1 3.9Å; W298-F444 HydrophobicContact CH2-CD2 4.5Å; W298-F444 AromaticContact CH2-CG 3.74Å; W298-F444 HydrophobicContact CH2-CG 3.74Å; W298-F444 HydrophobicContact CZ2-CB 4.32Å; W298-F444 HydrophobicContact CZ3-CB 4.05Å; W298-F444 AromaticContact CZ3-CD1 3.97Å; W298-F444 HydrophobicContact CZ3-CD1 3.97Å; W298-F444 HydrophobicContact CZ3-CG 4.23Å
299	S	88.9	Confident	77.3	Confident	83 Å²	83	89 Å²	89	58%	0.58	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-61.1	129.9	174.7	54.8	0	0	0	0	110.1
300	I	87.2	Confident	79.8	Confident	61 Å²	61	85.8 Å²	85.8	31%	0.313	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-64.7	139.9	172.1	-170.4	163.6	0	0	0	110.2	W298 L328 E347	W298-I300 PolarHBondContact O-N 2.83Å; I300-L328 HydrophobicContact CB-CD2 4.01Å; I300-E347 HydrophobicContact CD1-CB 3.89Å; I300-E347 HydrophobicContact CG1-CB 4.4Å
301	V	92.1	Very high	82.3	Confident	12 Å²	12	83.4 Å²	83.4	7%	0.073	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-91.4	136.8	173.1	175.9	0	0	0	0	108.9	L303 Y343 P346 E347 T499	V301-L303 HydrophobicContact CG1-CD2 4.23Å; V301-Y343 HydrophobicContact CB-CD1 4.27Å; V301-Y343 HydrophobicContact CG1-CD1 3.76Å; V301-Y343 HydrophobicContact CG1-CD2 4.49Å; V301-Y343 HydrophobicContact CG1-CE1 4.26Å; V301-Y343 HydrophobicContact CG1-CG 3.89Å; V301-Y343 HydrophobicContact CG2-CD1 3.97Å; V301-P346 HydrophobicContact CB-CB 4.2Å; V301-P346 HydrophobicContact CG1-CB 4.31Å; V301-P346 CarbonylContact O-C 3.57Å; V301-P346 WeakPolarHBondContact O-CA 3.16Å; V301-P346 WeakPolarHBondContact O-CB 3.29Å; V301-E347 PolarHBondContact O-N 3.22Å; V301-T499 HydrophobicContact CG1-CG2 3.85Å
302	T	93.5	Very high	84.6	Confident	18 Å²	18	73.8 Å²	73.8	11%	0.11	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	127.5	177	-56.1	0	0	0	0	110.1	L304 E347 W349 T499	T302-L304 HydrophobicContact CG2-CD2 3.81Å; T302-E347 CarbonylContact C-O 3.49Å; T302-E347 WeakPolarHBondContact CA-O 3.41Å; T302-W349 HydrophobicContact CG2-CG 4.23Å; T302-T499 VanDerWaalsContact O-CB 3.29Å; T302-T499 WeakPolarHBondContact O-CB 3.44Å; T302-T499 PolarHBondContact O-OG1 2.92Å
303	L	95.3	Very high	86.9	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	111.6	174.7	-60.3	-176.8	0	0	0	110.3	V301 F312 V340 N341 Y343 P346 E347 L348 W349 T499	V301-L303 HydrophobicContact CG1-CD2 4.23Å; L303-F312 HydrophobicContact CB-CE1 4.19Å; L303-V340 HydrophobicContact CD1-CB 4.37Å; L303-V340 HydrophobicContact CD1-CG1 4.27Å; L303-N341 HydrophobicContact CD1-CB 4.09Å; L303-Y343 HydrophobicContact CD1-CD2 4.43Å; L303-Y343 HydrophobicContact CD2-CD2 3.94Å; L303-Y343 HydrophobicContact CD2-CE2 4.21Å; L303-P346 HydrophobicContact CD1-CB 4.15Å; L303-P346 HydrophobicContact CD1-CG 3.64Å; L303-P346 HydrophobicContact CG-CB 3.93Å; L303-P346 HydrophobicContact CG-CG 4.01Å; L303-E347 PolarHBondContact N-O 2.95Å; L303-L348 HydrophobicContact CB-CD2 3.85Å; L303-L348 HydrophobicContact CD1-CD2 3.98Å; L303-L348 HydrophobicContact CG-CD2 4.29Å; L303-W349 PolarHBondContact O-N 3.24Å; L303-T499 HydrophobicContact CD2-CG2 4.4Å
304	L	96	Very high	89.1	Confident	9 Å²	9	56.7 Å²	56.7	5%	0.047	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	123.3	177.1	-51.1	-174.8	0	0	0	110.2	T302 K306 R309 W349 I492 L496 F498	T302-L304 HydrophobicContact CG2-CD2 3.81Å; L304-K306 PolarHBondContact O-N 2.91Å; L304-R309 WeakPolarHBondContact O-CD 3.1Å; L304-R309 PolarHBondContact O-NH1 2.91Å; L304-R309 VanDerWaalsContact O-NH1 3.13Å; L304-W349 HydrophobicContact CD2-CB 3.75Å; L304-W349 HydrophobicContact CD2-CG 3.95Å; L304-I492 HydrophobicContact CD1-CG2 4.41Å; L304-I492 HydrophobicContact CD2-CG2 4.05Å; L304-L496 HydrophobicContact CD1-CB 4.03Å; L304-L496 HydrophobicContact CD2-CB 4.06Å; L304-L496 HydrophobicContact CD2-CD1 3.97Å; L304-F498 HydrophobicContact CB-CD2 4.33Å; L304-F498 HydrophobicContact CD1-CB 4.39Å; L304-F498 HydrophobicContact CD1-CD2 4.2Å
305	G	94.9	Very high	91.1	Very high	3 Å²	3	48.2 Å²	48.2	3%	0.031	27%	0.265	C	S	.	.			trans	-79	55.6	173.4	0	0	0	0	0	112	R309 W349 Y356	G305-R309 CarbonylContact C-O 3.54Å; G305-R309 VanDerWaalsContact C-O 3.26Å; G305-R309 WeakPolarHBondContact CA-O 3.39Å; G305-W349 WeakPolarHBondContact CA-O 3.49Å; G305-W349 PolarHBondContact N-O 3.1Å; G305-Y356 VanDerWaalsContact O-CE1 3.29Å; G305-Y356 WeakPolarHBondContact O-CE1 3Å; G305-Y356 PolarHBondContact O-OH 3.17Å
306	K	89.7	Confident	92.5	Very high	113 Å²	113	43.5 Å²	43.5	49%	0.491	25%	0.247	S	C	.	.			trans	-113.2	140.6	177.2	-171.4	171	-176.5	169.7	0	108.8	L304 R309	L304-K306 PolarHBondContact O-N 2.91Å; K306-R309 PolarHBondContact N-O 2.81Å; K306-R309 WeakPolarHBondContact O-CA 3.12Å; K306-R309 PolarHBondContact O-N 2.95Å
307	V	84.8	Confident	93.2	Very high	124 Å²	124	36 Å²	36	75%	0.752	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.6	128.9	177.2	178	0	0	0	0	109.6	T310	V307-T310 HydrophobicContact CG2-CG2 4.49Å
308	P	87.6	Confident	93.6	Very high	119 Å²	119	34.5 Å²	34.5	77%	0.773	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	cis	-86.6	-1.3	12.6	34.7	-36	0	0	0	116.4	T310	P308-T310 PolarHBondContact O-N 3.07Å
309	R	92.1	Very high	93.7	Very high	16 Å²	16	35.3 Å²	35.3	6%	0.06	21%	0.208	C	C	.	.			trans	-84.6	96.9	-179	-170.2	-173.3	-65.7	133.2	-5.8	111.9	L304 G305 K306 F312 T499 E501	L304-R309 WeakPolarHBondContact O-CD 3.1Å; L304-R309 PolarHBondContact O-NH1 2.91Å; L304-R309 VanDerWaalsContact O-NH1 3.13Å; G305-R309 CarbonylContact C-O 3.54Å; G305-R309 VanDerWaalsContact C-O 3.26Å; G305-R309 WeakPolarHBondContact CA-O 3.39Å; K306-R309 PolarHBondContact N-O 2.81Å; K306-R309 WeakPolarHBondContact O-CA 3.12Å; K306-R309 PolarHBondContact O-N 2.95Å; R309-F312 HydrophobicContact CG-CE1 4.32Å; R309-T499 PolarHBondContact NH2-O 2.9Å; R309-E501 IonicContact NE-OE2 3.69Å; R309-E501 PolarHBondContact NE-OE2 2.85Å; R309-E501 IonicContact NH2-OE2 2.98Å
310	T	94.6	Very high	93.6	Very high	47 Å²	47	32.1 Å²	32.1	29%	0.288	19%	0.189	S	C	.	.			trans	-118.9	2.4	167.5	54.3	0	0	0	0	113.1	V307 P308 Y356 T357	V307-T310 HydrophobicContact CG2-CG2 4.49Å; P308-T310 PolarHBondContact O-N 3.07Å; T310-Y356 CarbonylContact O-C 3.59Å; T310-Y356 WeakPolarHBondContact O-CA 3.44Å; T310-T357 PolarHBondContact O-N 2.59Å
311	T	97.5	Very high	93.5	Very high	59 Å²	59	29.8 Å²	29.8	36%	0.362	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	130.4	178.9	-59.2	0	0	0	0	110.6	N341 T357	T311-N341 PolarHBondContact O-ND2 2.82Å; T311-T357 WeakPolarHBondContact CA-O 3.39Å; T311-T357 HydrophobicContact CG2-CG2 4.42Å
312	F	98.1	Very high	92.9	Very high	1 Å²	1	32 Å²	32	0%	0.004	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	118.9	174.3	-62.7	-72.7	0	0	0	109.6	L303 R309 F314 V340 N341 L348 V350 Y356 T357 M358 R359	L303-F312 HydrophobicContact CB-CE1 4.19Å; R309-F312 HydrophobicContact CG-CE1 4.32Å; F312-F314 HydrophobicContact CB-CD2 4.44Å; F312-F314 HydrophobicContact CB-CE2 3.62Å; F312-F314 HydrophobicContact CB-CZ 4.15Å; F312-F314 WeakPolarHBondContact O-CD2 3.39Å; F312-V340 HydrophobicContact CB-CG1 3.82Å; F312-V340 HydrophobicContact CD1-CG1 3.97Å; F312-V340 HydrophobicContact CG-CG1 4.32Å; F312-N341 WeakPolarHBondContact CA-OD1 3.28Å; F312-L348 HydrophobicContact CD1-CD1 4.28Å; F312-L348 HydrophobicContact CD1-CD2 4.05Å; F312-L348 HydrophobicContact CE1-CD2 3.96Å; F312-L348 HydrophobicContact CG-CD1 4.32Å; F312-V350 HydrophobicContact CE2-CG1 4.07Å; F312-V350 HydrophobicContact CZ-CG1 4.39Å; F312-Y356 HydrophobicContact CD2-CD1 4.38Å; F312-Y356 AromaticContact CE2-CD1 3.63Å; F312-Y356 HydrophobicContact CE2-CD1 3.63Å; F312-Y356 HydrophobicContact CE2-CE1 4.23Å; F312-Y356 HydrophobicContact CE2-CG 4.19Å; F312-Y356 HydrophobicContact CZ-CD1 4.49Å; F312-T357 PolarHBondContact N-O 3.05Å; F312-M358 HydrophobicContact CB-SD 4.05Å; F312-M358 HydrophobicContact CD2-CE 4.22Å; F312-M358 HydrophobicContact CD2-SD 4.11Å; F312-R359 PolarHBondContact O-N 2.84Å
313	T	98.4	Very high	92.6	Very high	17 Å²	17	32.5 Å²	32.5	10%	0.104	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	118.9	178.8	-63.4	0	0	0	0	110.1	Q315 V340 N341 R359	T313-Q315 HydrophobicContact CG2-CG 4.13Å; T313-V340 CarbonylContact O-C 3.52Å; T313-V340 VanDerWaalsContact O-CA 3.27Å; T313-V340 WeakPolarHBondContact O-CA 3.25Å; T313-N341 PolarHBondContact N-OD1 3.17Å; T313-N341 PolarHBondContact O-N 3.36Å; T313-R359 CarbonylContact C-O 3.55Å; T313-R359 VanDerWaalsContact CA-O 3.28Å; T313-R359 WeakPolarHBondContact CA-O 3.29Å; T313-R359 PolarHBondContact OG1-NE 2.96Å
314	F	98.8	Very high	92.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	121.1	-177.2	-67.3	-98.9	0	0	0	110.8	F312 W338 Y339 V340 L348 M358 R359 V360 E361 L375 Y474	F312-F314 HydrophobicContact CB-CD2 4.44Å; F312-F314 HydrophobicContact CB-CE2 3.62Å; F312-F314 HydrophobicContact CB-CZ 4.15Å; F312-F314 WeakPolarHBondContact O-CD2 3.39Å; F314-W338 HydrophobicContact CB-CD2 4.42Å; F314-W338 HydrophobicContact CB-CE3 3.69Å; F314-W338 HydrophobicContact CB-CH2 4.43Å; F314-W338 HydrophobicContact CB-CZ3 3.71Å; F314-W338 HydrophobicContact CD1-CB 4.46Å; F314-W338 HydrophobicContact CD1-CD2 4.27Å; F314-W338 HydrophobicContact CD1-CE3 4.31Å; F314-W338 HydrophobicContact CD1-CG 4.35Å; F314-Y339 CarbonylContact C-O 3.49Å; F314-Y339 WeakPolarHBondContact CA-O 3.26Å; F314-V340 HydrophobicContact CD1-CG2 3.62Å; F314-V340 HydrophobicContact CE1-CG1 4.29Å; F314-V340 HydrophobicContact CE1-CG2 3.46Å; F314-V340 VanDerWaalsContact CE1-CG2 3.46Å; F314-V340 HydrophobicContact CE2-CG1 4.4Å; F314-V340 HydrophobicContact CG-CG2 4.42Å; F314-V340 HydrophobicContact CZ-CG1 4.18Å; F314-V340 HydrophobicContact CZ-CG2 4.16Å; F314-L348 HydrophobicContact CZ-CD1 4.08Å; F314-M358 HydrophobicContact CE2-CB 4.33Å; F314-M358 HydrophobicContact CE2-CG 4.49Å; F314-M358 HydrophobicContact CE2-SD 3.65Å; F314-M358 HydrophobicContact CZ-SD 4.14Å; F314-R359 PolarHBondContact N-O 2.94Å; F314-V360 HydrophobicContact CB-CG1 4.49Å; F314-E361 WeakPolarHBondContact O-CA 3.49Å; F314-E361 PolarHBondContact O-N 3.05Å; F314-L375 HydrophobicContact CB-CD2 4.48Å; F314-L375 HydrophobicContact CD1-CD1 3.72Å; F314-L375 HydrophobicContact CD1-CD2 3.94Å; F314-L375 HydrophobicContact CD1-CG 4.49Å; F314-L375 HydrophobicContact CD2-CD2 3.46Å; F314-L375 VanDerWaalsContact CD2-CD2 3.46Å; F314-L375 HydrophobicContact CE1-CD1 3.85Å; F314-L375 HydrophobicContact CE1-CD2 3.98Å; F314-L375 HydrophobicContact CE2-CD2 3.5Å; F314-L375 HydrophobicContact CG-CD1 4.19Å; F314-L375 HydrophobicContact CG-CD2 3.7Å; F314-L375 HydrophobicContact CZ-CD1 4.42Å; F314-L375 HydrophobicContact CZ-CD2 3.77Å; F314-Y474 HydrophobicContact CD1-CD2 4.15Å; F314-Y474 AromaticContact CE1-CD2 3.51Å; F314-Y474 HydrophobicContact CE1-CD2 3.51Å; F314-Y474 AromaticContact CE1-CE2 3.98Å; F314-Y474 HydrophobicContact CE1-CE2 3.98Å; F314-Y474 AromaticContact CE1-CG 3.81Å; F314-Y474 HydrophobicContact CE1-CG 3.81Å; F314-Y474 HydrophobicContact CZ-CG 4.46Å
315	Q	98.5	Very high	92	Very high	3 Å²	3	32.2 Å²	32.2	1%	0.014	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	162.6	-178.8	-69.2	158.9	-25.4	0	0	108.9	T313 Y339 E361 C424 F426 Y504	T313-Q315 HydrophobicContact CG2-CG 4.13Å; Q315-Y339 PolarHBondContact N-O 3.42Å; Q315-Y339 PolarHBondContact O-N 2.99Å; Q315-E361 HydrophobicContact CG-CB 4.06Å; Q315-E361 WeakPolarHBondContact CG-OE2 3.48Å; Q315-E361 PolarHBondContact NE2-OE2 3.05Å; Q315-C424 HydrophobicContact CB-CB 4.45Å; Q315-C424 HydrophobicContact CG-CB 3.94Å; Q315-F426 HydrophobicContact CB-CE2 4.29Å; Q315-Y504 VanDerWaalsContact OE1-CE2 3.26Å; Q315-Y504 PolarHBondContact OE1-OH 3.43Å
316	L	98.3	Very high	91.4	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	155	177.2	-61.7	-169.2	0	0	0	111.1	F336 W338 N373 L423 C424 R425 F426 M482	L316-F336 HydrophobicContact CB-CB 4.21Å; L316-F336 HydrophobicContact CB-CG 4.35Å; L316-F336 HydrophobicContact CD1-CB 4.34Å; L316-F336 HydrophobicContact CD1-CD2 3.97Å; L316-F336 HydrophobicContact CD1-CG 4.21Å; L316-F336 HydrophobicContact CD2-CB 4.45Å; L316-W338 HydrophobicContact CD2-CD2 4.35Å; L316-W338 HydrophobicContact CD2-CE3 3.79Å; L316-W338 HydrophobicContact CD2-CH2 4.18Å; L316-W338 HydrophobicContact CD2-CZ3 3.69Å; L316-N373 WeakPolarHBondContact CD1-ND2 3.5Å; L316-N373 HydrophobicContact CD2-CB 4.41Å; L316-L423 HydrophobicContact CD1-CD1 3.75Å; L316-L423 HydrophobicContact CG-CD1 4.41Å; L316-C424 PolarHBondContact N-O 3.13Å; L316-R425 HydrophobicContact CB-CG 3.65Å; L316-R425 HydrophobicContact CD1-CG 4.41Å; L316-R425 CarbonylContact O-C 3.59Å; L316-R425 VanDerWaalsContact O-CA 3.25Å; L316-R425 WeakPolarHBondContact O-CA 3.26Å; L316-F426 PolarHBondContact O-N 2.68Å; L316-M482 HydrophobicContact CD2-CE 3.39Å
317	G	96.3	Very high	91.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168	172.2	170.5	0	0	0	0	0	112.2	F336 V337 Y339	G317-F336 VanDerWaalsContact O-CA 3.29Å; G317-F336 WeakPolarHBondContact O-CA 3.39Å; G317-V337 PolarHBondContact N-O 3.35Å; G317-V337 VanDerWaalsContact N-O 3.08Å; G317-V337 PolarHBondContact O-N 2.81Å; G317-Y339 VanDerWaalsContact CA-CE2 3.43Å
318	P	94.4	Very high	91.1	Very high	34 Å²	34	26.6 Å²	26.6	22%	0.221	17%	0.167	C	C	.	.			trans	-62.8	143.2	178.1	26.1	-34.4	0	0	0	110.9	G320 Y339 F426 F444 L448	P318-G320 PolarHBondContact O-N 3.15Å; P318-Y339 VanDerWaalsContact O-CE2 3.32Å; P318-Y339 WeakPolarHBondContact O-CE2 3.45Å; P318-Y339 PolarHBondContact O-OH 2.91Å; P318-F426 WeakPolarHBondContact CD-O 3.36Å; P318-F444 HydrophobicContact CB-CZ 4.3Å; P318-F444 HydrophobicContact CG-CE1 3.91Å; P318-F444 HydrophobicContact CG-CZ 3.7Å; P318-L448 HydrophobicContact CG-CD2 3.94Å
319	P	91.6	Very high	90.8	Very high	22 Å²	22	22 Å²	22	14%	0.143	14%	0.139	C	C	.	.			trans	-65.4	-4.9	179.2	24.2	-33	0	0	0	115.4	A324 Y325 P333 E335 V337 M344	P319-A324 WeakPolarHBondContact O-CB 3.41Å; P319-Y325 VanDerWaalsContact O-CB 3.23Å; P319-Y325 WeakPolarHBondContact O-CB 3.13Å; P319-Y325 PolarHBondContact O-N 2.86Å; P319-Y325 VanDerWaalsContact O-N 3.08Å; P319-P333 HydrophobicContact CB-CB 3.64Å; P319-P333 HydrophobicContact CB-CG 3.36Å; P319-P333 HydrophobicContact CG-CB 4.11Å; P319-P333 HydrophobicContact CG-CG 3.72Å; P319-E335 WeakPolarHBondContact CD-O 3.32Å; P319-V337 HydrophobicContact CB-CG1 3.72Å; P319-V337 HydrophobicContact CB-CG2 4.38Å; P319-M344 VanDerWaalsContact C-SD 3.56Å
320	G	86.4	Confident	89.9	Confident	17 Å²	17	28.5 Å²	28.5	18%	0.175	17%	0.168	C	C	.	.			trans	72.7	-170.6	-162.8	0	0	0	0	0	111.6	P318	P318-G320 PolarHBondContact O-N 3.15Å
321	G	84	Confident	88.8	Confident	12 Å²	12	27 Å²	27	12%	0.124	16%	0.159	C	C	.	.	S	Bend	trans	-87.2	-166.1	179.4	0	0	0	0	0	112.5	R323 A324 D436	G321-R323 PolarHBondContact O-N 2.98Å; G321-A324 WeakPolarHBondContact O-CB 3.26Å; G321-A324 PolarHBondContact O-N 2.93Å; G321-D436 VanDerWaalsContact C-OD1 3.26Å; G321-D436 WeakPolarHBondContact CA-OD1 3.22Å; G321-D436 WeakPolarHBondContact CA-OD2 3.37Å
322	A	81	Confident	87.5	Confident	58 Å²	58	29.2 Å²	29.2	48%	0.479	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-25.2	178.3	0	0	0	0	0	113.7	S327 D436	A322-S327 WeakPolarHBondContact O-CB 3.41Å; A322-D436 VanDerWaalsContact N-CG 3.31Å; A322-D436 PolarHBondContact N-OD1 2.98Å; A322-D436 PolarHBondContact N-OD2 2.75Å
323	R	85.5	Confident	86.7	Confident	28 Å²	28	30.4 Å²	30.4	11%	0.106	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-8	179.8	-60	179.1	66.6	-161.8	-0.6	115	R295 E296 P297 W298 G321 D436 M438 D439	R295-R323 VanDerWaalsContact CB-NE 3.3Å; R295-R323 VanDerWaalsContact NH2-NH1 3.17Å; E296-R323 PolarHBondContact O-NE 2.75Å; E296-R323 PolarHBondContact O-NH2 3.01Å; P297-R323 WeakPolarHBondContact CA-O 3.15Å; W298-R323 PolarHBondContact N-O 3.4Å; G321-R323 PolarHBondContact O-N 2.98Å; R323-D436 PolarHBondContact N-OD1 3.47Å; R323-M438 PolarHBondContact NH1-O 3.46Å; R323-D439 IonicContact NH1-OD1 2.68Å
324	A	90.2	Very high	85.8	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	-120.8	-170.1	0	0	0	0	0	110.8	W298 P319 G321 E326 S327 L328 M344	W298-A324 HydrophobicContact CD2-CB 4.29Å; W298-A324 HydrophobicContact CE3-CB 3.64Å; W298-A324 HydrophobicContact CH2-CB 4.42Å; W298-A324 HydrophobicContact CZ3-CB 3.71Å; P319-A324 WeakPolarHBondContact O-CB 3.41Å; G321-A324 WeakPolarHBondContact O-CB 3.26Å; G321-A324 PolarHBondContact O-N 2.93Å; A324-E326 VanDerWaalsContact C-N 3.31Å; A324-E326 PolarHBondContact O-N 3.05Å; A324-S327 PolarHBondContact O-N 2.86Å; A324-S327 VanDerWaalsContact O-N 3.11Å; A324-L328 WeakPolarHBondContact O-CG 3.47Å; A324-L328 PolarHBondContact O-N 3.07Å; A324-L328 VanDerWaalsContact O-N 3.11Å; A324-M344 HydrophobicContact CB-CE 3.64Å; A324-M344 HydrophobicContact CB-SD 4.11Å
325	Y	90.1	Very high	85.1	Confident	3 Å²	3	37 Å²	37	1%	0.012	21%	0.213	C	C	.	.	H	α-helix	trans	-54.4	-44.4	-175.8	-175.5	-89.8	0	0	0	113.1	P319 S327 L328 A329 P333 V337 T345 N481 M482 G483	P319-Y325 VanDerWaalsContact O-CB 3.23Å; P319-Y325 WeakPolarHBondContact O-CB 3.13Å; P319-Y325 PolarHBondContact O-N 2.86Å; P319-Y325 VanDerWaalsContact O-N 3.08Å; Y325-S327 PolarHBondContact O-N 2.67Å; Y325-L328 PolarHBondContact O-N 3.36Å; Y325-L328 VanDerWaalsContact O-N 3.16Å; Y325-A329 HydrophobicContact CD1-CB 4.08Å; Y325-A329 HydrophobicContact CE1-CB 3.6Å; Y325-A329 HydrophobicContact CE2-CB 4.11Å; Y325-A329 WeakPolarHBondContact O-CB 3.47Å; Y325-A329 PolarHBondContact O-N 3.49Å; Y325-P333 HydrophobicContact CD1-CB 3.49Å; Y325-P333 VanDerWaalsContact CD1-CB 3.49Å; Y325-P333 HydrophobicContact CD1-CG 3.76Å; Y325-P333 HydrophobicContact CE1-CB 3.86Å; Y325-P333 HydrophobicContact CG-CB 4.25Å; Y325-P333 HydrophobicContact CG-CG 4.47Å; Y325-V337 HydrophobicContact CD1-CG1 4.06Å; Y325-V337 HydrophobicContact CD2-CB 4.15Å; Y325-V337 HydrophobicContact CD2-CG1 3.6Å; Y325-V337 HydrophobicContact CE1-CG1 4.35Å; Y325-V337 HydrophobicContact CE2-CB 4.46Å; Y325-V337 HydrophobicContact CE2-CG1 3.95Å; Y325-V337 HydrophobicContact CG-CG1 3.65Å; Y325-T345 HydrophobicContact CD2-CG2 3.98Å; Y325-T345 WeakPolarHBondContact CD2-OG1 3.28Å; Y325-T345 HydrophobicContact CE2-CG2 3.74Å; Y325-N481 HydrophobicContact CE1-CB 4.05Å; Y325-N481 VanDerWaalsContact CE1-O 3.24Å; Y325-N481 WeakPolarHBondContact CE1-O 3.47Å; Y325-N481 WeakPolarHBondContact OH-CA 3.36Å; Y325-N481 PolarHBondContact OH-O 2.97Å; Y325-N481 VanDerWaalsContact OH-O 3.14Å; Y325-M482 PolarHBondContact OH-N 3.21Å; Y325-G483 WeakPolarHBondContact CE2-O 3.48Å; Y325-G483 PolarHBondContact OH-O 2.97Å
326	E	82.6	Confident	84.9	Confident	64 Å²	64	37.5 Å²	37.5	30%	0.299	22%	0.216	S	C	.	.	H	α-helix	trans	-59.4	-38.6	-178.5	-176.6	171.6	168.9	0	0	112	A324 K330 A331	A324-E326 VanDerWaalsContact C-N 3.31Å; A324-E326 PolarHBondContact O-N 3.05Å; E326-K330 WeakPolarHBondContact O-CA 3.35Å; E326-K330 PolarHBondContact O-N 2.82Å; E326-A331 WeakPolarHBondContact CA-O 2.8Å
327	S	82.8	Confident	84.8	Confident	21 Å²	21	37.5 Å²	37.5	15%	0.147	22%	0.216	C	C	.	.	H	α-helix	trans	-73.6	-36.7	178.4	-163.9	0	0	0	0	113.1	P297 A322 A324 Y325 K330	P297-S327 VanDerWaalsContact CB-OG 3.27Å; P297-S327 WeakPolarHBondContact CB-OG 3.45Å; P297-S327 WeakPolarHBondContact CG-OG 3.46Å; A322-S327 WeakPolarHBondContact O-CB 3.41Å; A324-S327 PolarHBondContact O-N 2.86Å; A324-S327 VanDerWaalsContact O-N 3.11Å; Y325-S327 PolarHBondContact O-N 2.67Å; S327-K330 WeakPolarHBondContact O-CD 3.44Å; S327-K330 WeakPolarHBondContact O-CE 3.3Å; S327-K330 PolarHBondContact O-NZ 2.81Å
328	L	84.4	Confident	84.9	Confident	38 Å²	38	37.5 Å²	37.5	20%	0.199	22%	0.216	C	C	.	.	H	α-helix	trans	-70.6	-54.4	178.9	-66.9	173	0	0	0	111.1	I300 A324 Y325 K330 W484	I300-L328 HydrophobicContact CB-CD2 4.01Å; A324-L328 WeakPolarHBondContact O-CG 3.47Å; A324-L328 PolarHBondContact O-N 3.07Å; A324-L328 VanDerWaalsContact O-N 3.11Å; Y325-L328 PolarHBondContact O-N 3.36Å; Y325-L328 VanDerWaalsContact O-N 3.16Å; L328-K330 VanDerWaalsContact C-N 3.34Å; L328-W484 WeakPolarHBondContact O-CH2 3.19Å
329	A	82.2	Confident	85.1	Confident	21 Å²	21	35.9 Å²	35.9	17%	0.174	21%	0.205	C	C	.	.	H	α-helix	trans	-81.9	-12.7	-174.9	0	0	0	0	0	114.4	Y325 A331 W484	Y325-A329 HydrophobicContact CD1-CB 4.08Å; Y325-A329 HydrophobicContact CE1-CB 3.6Å; Y325-A329 HydrophobicContact CE2-CB 4.11Å; Y325-A329 WeakPolarHBondContact O-CB 3.47Å; Y325-A329 PolarHBondContact O-N 3.49Å; A329-A331 HydrophobicContact CB-CB 4.08Å; A329-A331 PolarHBondContact O-N 3.08Å; A329-A331 VanDerWaalsContact O-N 3.09Å; A329-W484 HydrophobicContact CB-CE3 3.97Å; A329-W484 HydrophobicContact CB-CH2 4.26Å; A329-W484 HydrophobicContact CB-CZ3 3.49Å; A329-W484 VanDerWaalsContact CB-CZ3 3.49Å
330	K	72.9	Confident	85.4	Confident	154 Å²	154	34.9 Å²	34.9	67%	0.67	20%	0.198	S	C	*	.	S	Bend	trans	50.2	31.3	-170	-56.6	-56.7	-175.2	-156.5	0	111.7	E326 S327 L328	E326-K330 WeakPolarHBondContact O-CA 3.35Å; E326-K330 PolarHBondContact O-N 2.82Å; S327-K330 WeakPolarHBondContact O-CD 3.44Å; S327-K330 WeakPolarHBondContact O-CE 3.3Å; S327-K330 PolarHBondContact O-NZ 2.81Å; L328-K330 VanDerWaalsContact C-N 3.34Å
331	A	70.4	Confident	85.8	Confident	14 Å²	14	34.2 Å²	34.2	12%	0.116	19%	0.191	C	C	.	.	S	Bend	trans	-137.4	140.2	-174.5	0	0	0	0	0	108.7	E326 A329 P333 N481	E326-A331 WeakPolarHBondContact CA-O 2.8Å; A329-A331 HydrophobicContact CB-CB 4.08Å; A329-A331 PolarHBondContact O-N 3.08Å; A329-A331 VanDerWaalsContact O-N 3.09Å; A331-P333 WeakPolarHBondContact O-CD 3.35Å; A331-N481 HydrophobicContact CB-CB 4.39Å
332	K	71.4	Confident	86.3	Confident	106 Å²	106	33.6 Å²	33.6	46%	0.461	19%	0.185	S	C	.	.			trans	-73.5	118.5	175.6	-166.9	172.6	-176.3	177.9	0	108.6	N481	K332-N481 PolarHBondContact O-ND2 3.36Å
333	P	81.2	Confident	87	Confident	26 Å²	26	31 Å²	31	17%	0.169	16%	0.163	C	C	.	.			trans	-70.8	163.5	176.8	25.9	-28.1	0	0	0	111.3	P319 Y325 A331 V337	P319-P333 HydrophobicContact CB-CB 3.64Å; P319-P333 HydrophobicContact CB-CG 3.36Å; P319-P333 HydrophobicContact CG-CB 4.11Å; P319-P333 HydrophobicContact CG-CG 3.72Å; Y325-P333 HydrophobicContact CD1-CB 3.49Å; Y325-P333 VanDerWaalsContact CD1-CB 3.49Å; Y325-P333 HydrophobicContact CD1-CG 3.76Å; Y325-P333 HydrophobicContact CE1-CB 3.86Å; Y325-P333 HydrophobicContact CG-CB 4.25Å; Y325-P333 HydrophobicContact CG-CG 4.47Å; A331-P333 WeakPolarHBondContact O-CD 3.35Å; P333-V337 HydrophobicContact CB-CG1 3.84Å
334	G	78.8	Confident	87.5	Confident	43 Å²	43	30.2 Å²	30.2	44%	0.443	16%	0.16	S	C	.	.			trans	-75.4	-159.4	162.2	0	0	0	0	0	112.2	F336	G334-F336 PolarHBondContact O-N 3.34Å
335	E	84.7	Confident	87.7	Confident	113 Å²	113	30.3 Å²	30.3	53%	0.528	16%	0.161	S	C	.	.	S	Bend	trans	-61.7	-32.1	175.3	-165.5	-174.4	166	0	0	112.2	P319 R370	P319-E335 WeakPolarHBondContact CD-O 3.32Å; E335-R370 WeakPolarHBondContact OE2-CD 3.47Å
336	F	93.9	Very high	87.9	Confident	14 Å²	14	30.2 Å²	30.2	6%	0.061	16%	0.16	C	C	.	.			trans	-131.2	154.8	-177.2	-48.6	-57.7	0	0	0	112.6	L316 G317 G334 F371 M482	L316-F336 HydrophobicContact CB-CB 4.21Å; L316-F336 HydrophobicContact CB-CG 4.35Å; L316-F336 HydrophobicContact CD1-CB 4.34Å; L316-F336 HydrophobicContact CD1-CD2 3.97Å; L316-F336 HydrophobicContact CD1-CG 4.21Å; L316-F336 HydrophobicContact CD2-CB 4.45Å; G317-F336 VanDerWaalsContact O-CA 3.29Å; G317-F336 WeakPolarHBondContact O-CA 3.39Å; G334-F336 PolarHBondContact O-N 3.34Å; F336-F371 HydrophobicContact CE2-CD1 4.01Å; F336-F371 AromaticContact CE2-CE1 3.55Å; F336-F371 HydrophobicContact CE2-CE1 3.55Å; F336-F371 AromaticContact CZ-CE1 3.81Å; F336-F371 HydrophobicContact CZ-CE1 3.81Å; F336-M482 HydrophobicContact CB-CE 4.09Å; F336-M482 WeakPolarHBondContact O-CG 3.48Å
337	V	96.3	Very high	88.6	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	164.9	165.4	-62.3	0	0	0	0	109.6	G317 P319 Y325 P333 Y339 M344 T345 M482	G317-V337 PolarHBondContact N-O 3.35Å; G317-V337 VanDerWaalsContact N-O 3.08Å; G317-V337 PolarHBondContact O-N 2.81Å; P319-V337 HydrophobicContact CB-CG1 3.72Å; P319-V337 HydrophobicContact CB-CG2 4.38Å; Y325-V337 HydrophobicContact CD1-CG1 4.06Å; Y325-V337 HydrophobicContact CD2-CB 4.15Å; Y325-V337 HydrophobicContact CD2-CG1 3.6Å; Y325-V337 HydrophobicContact CE1-CG1 4.35Å; Y325-V337 HydrophobicContact CE2-CB 4.46Å; Y325-V337 HydrophobicContact CE2-CG1 3.95Å; Y325-V337 HydrophobicContact CG-CG1 3.65Å; P333-V337 HydrophobicContact CB-CG1 3.84Å; V337-Y339 HydrophobicContact CG2-CD2 4.17Å; V337-Y339 HydrophobicContact CG2-CE2 3.8Å; V337-M344 HydrophobicContact CG2-CG 3.87Å; V337-T345 HydrophobicContact CB-CG2 4.47Å; V337-M482 CarbonylContact C-O 3.54Å; V337-M482 WeakPolarHBondContact CA-O 3.44Å; V337-M482 VanDerWaalsContact CB-O 3.28Å; V337-M482 WeakPolarHBondContact CB-O 3.31Å
338	W	98.2	Very high	89.3	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	127.6	172.7	-74.3	123.8	0	0	0	110.9	F314 L316 T345 V360 N373 L375 Y474 M482	F314-W338 HydrophobicContact CB-CD2 4.42Å; F314-W338 HydrophobicContact CB-CE3 3.69Å; F314-W338 HydrophobicContact CB-CH2 4.43Å; F314-W338 HydrophobicContact CB-CZ3 3.71Å; F314-W338 HydrophobicContact CD1-CB 4.46Å; F314-W338 HydrophobicContact CD1-CD2 4.27Å; F314-W338 HydrophobicContact CD1-CE3 4.31Å; F314-W338 HydrophobicContact CD1-CG 4.35Å; L316-W338 HydrophobicContact CD2-CD2 4.35Å; L316-W338 HydrophobicContact CD2-CE3 3.79Å; L316-W338 HydrophobicContact CD2-CH2 4.18Å; L316-W338 HydrophobicContact CD2-CZ3 3.69Å; W338-T345 HydrophobicContact CB-CG2 4.43Å; W338-T345 WeakPolarHBondContact O-CA 3.42Å; W338-T345 WeakPolarHBondContact O-CG2 3.34Å; W338-T345 PolarHBondContact O-N 2.67Å; W338-V360 HydrophobicContact CH2-CG1 3.78Å; W338-V360 HydrophobicContact CZ3-CG1 4.3Å; W338-N373 HydrophobicContact CH2-CB 3.85Å; W338-N373 WeakPolarHBondContact CH2-O 3.29Å; W338-N373 HydrophobicContact CZ2-CB 3.81Å; W338-N373 WeakPolarHBondContact CZ2-O 3.39Å; W338-L375 HydrophobicContact CZ2-CB 4.37Å; W338-L375 HydrophobicContact CZ2-CD1 4.18Å; W338-Y474 HydrophobicContact CB-CD2 4.31Å; W338-Y474 HydrophobicContact CB-CE2 3.83Å; W338-Y474 HydrophobicContact CG-CD2 4.34Å; W338-Y474 HydrophobicContact CG-CE2 4.33Å; W338-M482 HydrophobicContact CG-CB 4.43Å; W338-M482 PolarHBondContact N-O 3.35Å
339	Y	97.9	Very high	89.9	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	131.1	162.1	-78.6	-125.5	0	0	0	107.3	F314 Q315 G317 P318 V337 Y343 M344 F426 F441 L448	F314-Y339 CarbonylContact C-O 3.49Å; F314-Y339 WeakPolarHBondContact CA-O 3.26Å; Q315-Y339 PolarHBondContact N-O 3.42Å; Q315-Y339 PolarHBondContact O-N 2.99Å; G317-Y339 VanDerWaalsContact CA-CE2 3.43Å; P318-Y339 VanDerWaalsContact O-CE2 3.32Å; P318-Y339 WeakPolarHBondContact O-CE2 3.45Å; P318-Y339 PolarHBondContact O-OH 2.91Å; V337-Y339 HydrophobicContact CG2-CD2 4.17Å; V337-Y339 HydrophobicContact CG2-CE2 3.8Å; Y339-Y343 CarbonylContact C-O 3.55Å; Y339-Y343 WeakPolarHBondContact CA-O 3.42Å; Y339-M344 HydrophobicContact CD1-CB 4.17Å; Y339-M344 HydrophobicContact CD2-CB 4.31Å; Y339-M344 HydrophobicContact CD2-CG 4.32Å; Y339-M344 HydrophobicContact CE1-CB 3.73Å; Y339-M344 HydrophobicContact CE1-CG 4.4Å; Y339-M344 HydrophobicContact CE2-CB 3.83Å; Y339-M344 HydrophobicContact CE2-CG 3.64Å; Y339-M344 HydrophobicContact CG-CB 4.45Å; Y339-F426 AromaticContact CD1-CD2 3.49Å; Y339-F426 HydrophobicContact CD1-CD2 3.49Å; Y339-F426 VanDerWaalsContact CD1-CD2 3.49Å; Y339-F426 AromaticContact CD1-CE2 3.79Å; Y339-F426 HydrophobicContact CD1-CE2 3.79Å; Y339-F426 HydrophobicContact CD1-CG 4.02Å; Y339-F426 HydrophobicContact CE1-CB 4.37Å; Y339-F426 HydrophobicContact CE1-CD2 4.12Å; Y339-F426 HydrophobicContact CE1-CG 4.19Å; Y339-F426 AromaticContact CG-CD2 3.73Å; Y339-F426 HydrophobicContact CG-CD2 3.73Å; Y339-F426 HydrophobicContact CG-CE2 4.09Å; Y339-F441 HydrophobicContact CD1-CE2 4.45Å; Y339-F441 HydrophobicContact CD1-CZ 4.19Å; Y339-F441 AromaticContact CE1-CE2 3.59Å; Y339-F441 HydrophobicContact CE1-CE2 3.59Å; Y339-F441 AromaticContact CE1-CZ 3.72Å; Y339-F441 HydrophobicContact CE1-CZ 3.72Å; Y339-L448 HydrophobicContact CE1-CD1 3.86Å
340	V	97.9	Very high	90.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	121.2	179.2	-168.2	0	0	0	0	108.6	L303 F312 T313 F314 G342 Y343 P346 L348 Y474	L303-V340 HydrophobicContact CD1-CB 4.37Å; L303-V340 HydrophobicContact CD1-CG1 4.27Å; F312-V340 HydrophobicContact CB-CG1 3.82Å; F312-V340 HydrophobicContact CD1-CG1 3.97Å; F312-V340 HydrophobicContact CG-CG1 4.32Å; T313-V340 CarbonylContact O-C 3.52Å; T313-V340 VanDerWaalsContact O-CA 3.27Å; T313-V340 WeakPolarHBondContact O-CA 3.25Å; F314-V340 HydrophobicContact CD1-CG2 3.62Å; F314-V340 HydrophobicContact CE1-CG1 4.29Å; F314-V340 HydrophobicContact CE1-CG2 3.46Å; F314-V340 VanDerWaalsContact CE1-CG2 3.46Å; F314-V340 HydrophobicContact CE2-CG1 4.4Å; F314-V340 HydrophobicContact CG-CG2 4.42Å; F314-V340 HydrophobicContact CZ-CG1 4.18Å; F314-V340 HydrophobicContact CZ-CG2 4.16Å; V340-G342 PolarHBondContact O-N 3.16Å; V340-G342 VanDerWaalsContact O-N 3.16Å; V340-Y343 PolarHBondContact N-O 3Å; V340-Y343 PolarHBondContact O-N 2.71Å; V340-P346 HydrophobicContact CB-CG 3.7Å; V340-P346 HydrophobicContact CG2-CG 4.15Å; V340-L348 HydrophobicContact CB-CD2 4.42Å; V340-L348 HydrophobicContact CG1-CD1 4.41Å; V340-L348 HydrophobicContact CG1-CD2 4.09Å; V340-Y474 HydrophobicContact CG2-CE2 4.01Å
341	N	96	Very high	91.8	Very high	3 Å²	3	22.8 Å²	22.8	2%	0.016	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	39.7	-175.3	-64.1	20.7	0	0	0	112.1	L303 T311 F312 T313 Y343 E501 Y504	L303-N341 HydrophobicContact CD1-CB 4.09Å; T311-N341 PolarHBondContact O-ND2 2.82Å; F312-N341 WeakPolarHBondContact CA-OD1 3.28Å; T313-N341 PolarHBondContact N-OD1 3.17Å; T313-N341 PolarHBondContact O-N 3.36Å; N341-Y343 VanDerWaalsContact C-N 3.29Å; N341-Y343 VanDerWaalsContact O-CD2 3.27Å; N341-Y343 WeakPolarHBondContact O-CD2 3.18Å; N341-Y343 PolarHBondContact O-N 2.92Å; N341-E501 HydrophobicContact CB-CG 4.29Å; N341-E501 WeakPolarHBondContact CB-OE1 3.41Å; N341-E501 PolarHBondContact ND2-OE1 2.61Å; N341-E501 PolarHBondContact ND2-OE2 3.21Å; N341-Y504 VanDerWaalsContact C-CE1 3.43Å
342	G	95.1	Very high	93.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	4.2	179.6	0	0	0	0	0	115.8	V340 F441 K445 Y504	V340-G342 PolarHBondContact O-N 3.16Å; V340-G342 VanDerWaalsContact O-N 3.16Å; G342-F441 WeakPolarHBondContact O-CZ 3.3Å; G342-K445 VanDerWaalsContact O-CE 3.28Å; G342-K445 WeakPolarHBondContact O-CE 3.5Å; G342-Y504 PolarHBondContact N-OH 3.06Å
343	Y	95	Very high	94.4	Very high	4 Å²	4	21.4 Å²	21.4	2%	0.016	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	137.6	173	-63.1	-84.4	0	0	0	111.3	V301 L303 Y339 V340 N341 T345 P346 F441 T499 E500 E502	V301-Y343 HydrophobicContact CB-CD1 4.27Å; V301-Y343 HydrophobicContact CG1-CD1 3.76Å; V301-Y343 HydrophobicContact CG1-CD2 4.49Å; V301-Y343 HydrophobicContact CG1-CE1 4.26Å; V301-Y343 HydrophobicContact CG1-CG 3.89Å; V301-Y343 HydrophobicContact CG2-CD1 3.97Å; L303-Y343 HydrophobicContact CD1-CD2 4.43Å; L303-Y343 HydrophobicContact CD2-CD2 3.94Å; L303-Y343 HydrophobicContact CD2-CE2 4.21Å; Y339-Y343 CarbonylContact C-O 3.55Å; Y339-Y343 WeakPolarHBondContact CA-O 3.42Å; V340-Y343 PolarHBondContact N-O 3Å; V340-Y343 PolarHBondContact O-N 2.71Å; N341-Y343 VanDerWaalsContact C-N 3.29Å; N341-Y343 VanDerWaalsContact O-CD2 3.27Å; N341-Y343 WeakPolarHBondContact O-CD2 3.18Å; N341-Y343 PolarHBondContact O-N 2.92Å; Y343-T345 PolarHBondContact O-N 2.87Å; Y343-P346 VanDerWaalsContact O-CD 3.29Å; Y343-P346 WeakPolarHBondContact O-CD 3.23Å; Y343-F441 HydrophobicContact CD1-CD1 4.05Å; Y343-F441 AromaticContact CD1-CE1 3.69Å; Y343-F441 HydrophobicContact CD1-CE1 3.69Å; Y343-F441 HydrophobicContact CG-CE1 4.31Å; Y343-T499 HydrophobicContact CE1-CG2 4.29Å; Y343-T499 HydrophobicContact CE2-CG2 4.43Å; Y343-E500 PolarHBondContact OH-O 3.05Å; Y343-E502 PolarHBondContact OH-N 2.96Å
344	M	94.9	Very high	95.1	Very high	11 Å²	11	22.3 Å²	22.3	5%	0.054	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	113.8	177.9	-177.4	-166.6	80.8	0	0	110.1	W298 P319 A324 V337 Y339 P346 F441	W298-M344 HydrophobicContact CE3-CE 4.3Å; W298-M344 HydrophobicContact CZ3-CE 4.49Å; P319-M344 VanDerWaalsContact C-SD 3.56Å; A324-M344 HydrophobicContact CB-CE 3.64Å; A324-M344 HydrophobicContact CB-SD 4.11Å; V337-M344 HydrophobicContact CG2-CG 3.87Å; Y339-M344 HydrophobicContact CD1-CB 4.17Å; Y339-M344 HydrophobicContact CD2-CB 4.31Å; Y339-M344 HydrophobicContact CD2-CG 4.32Å; Y339-M344 HydrophobicContact CE1-CB 3.73Å; Y339-M344 HydrophobicContact CE1-CG 4.4Å; Y339-M344 HydrophobicContact CE2-CB 3.83Å; Y339-M344 HydrophobicContact CE2-CG 3.64Å; Y339-M344 HydrophobicContact CG-CB 4.45Å; M344-P346 VanDerWaalsContact C-CD 3.5Å; M344-F441 HydrophobicContact CB-CD2 3.62Å; M344-F441 HydrophobicContact CB-CE2 3.33Å; M344-F441 HydrophobicContact CB-CG 4.39Å; M344-F441 HydrophobicContact CB-CZ 3.89Å; M344-F441 HydrophobicContact CG-CE2 4.49Å; M344-F441 VanDerWaalsContact N-CZ 3.28Å; M344-F441 HydrophobicContact SD-CD2 4.36Å
345	T	95	Very high	96.1	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.012	13%	0.129	C	C	.	.	S	Bend	trans	44.1	52.5	171.2	2.9	0	0	0	0	115.5	Y325 V337 W338 Y343 Y474 M482 W484	Y325-T345 HydrophobicContact CD2-CG2 3.98Å; Y325-T345 WeakPolarHBondContact CD2-OG1 3.28Å; Y325-T345 HydrophobicContact CE2-CG2 3.74Å; V337-T345 HydrophobicContact CB-CG2 4.47Å; W338-T345 HydrophobicContact CB-CG2 4.43Å; W338-T345 WeakPolarHBondContact O-CA 3.42Å; W338-T345 WeakPolarHBondContact O-CG2 3.34Å; W338-T345 PolarHBondContact O-N 2.67Å; Y343-T345 PolarHBondContact O-N 2.87Å; T345-Y474 VanDerWaalsContact C-OH 3.27Å; T345-Y474 WeakPolarHBondContact CA-OH 3.42Å; T345-Y474 HydrophobicContact CG2-CE2 4.28Å; T345-M482 VanDerWaalsContact CG2-O 3.22Å; T345-M482 WeakPolarHBondContact CG2-O 3.13Å; T345-W484 HydrophobicContact CG2-CB 4Å
346	P	95.6	Very high	96.7	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.104	C	C	.	.	P	Polyproline II helix	trans	-69.6	157	-178.7	31.7	-37	0	0	0	112	V301 L303 V340 Y343 M344 L348 Y474	V301-P346 HydrophobicContact CB-CB 4.2Å; V301-P346 HydrophobicContact CG1-CB 4.31Å; V301-P346 CarbonylContact O-C 3.57Å; V301-P346 WeakPolarHBondContact O-CA 3.16Å; V301-P346 WeakPolarHBondContact O-CB 3.29Å; L303-P346 HydrophobicContact CD1-CB 4.15Å; L303-P346 HydrophobicContact CD1-CG 3.64Å; L303-P346 HydrophobicContact CG-CB 3.93Å; L303-P346 HydrophobicContact CG-CG 4.01Å; V340-P346 HydrophobicContact CB-CG 3.7Å; V340-P346 HydrophobicContact CG2-CG 4.15Å; Y343-P346 VanDerWaalsContact O-CD 3.29Å; Y343-P346 WeakPolarHBondContact O-CD 3.23Å; M344-P346 VanDerWaalsContact C-CD 3.5Å; P346-L348 HydrophobicContact CG-CD2 3.95Å; P346-Y474 PolarHBondContact O-OH 3.37Å
347	E	95.6	Very high	96.9	Very high	35 Å²	35	18.6 Å²	18.6	16%	0.164	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	126.3	165.7	-172.6	171.8	89	0	0	109.8	I300 V301 T302 L303 W349 K485 V487	I300-E347 HydrophobicContact CD1-CB 3.89Å; I300-E347 HydrophobicContact CG1-CB 4.4Å; V301-E347 PolarHBondContact O-N 3.22Å; T302-E347 CarbonylContact C-O 3.49Å; T302-E347 WeakPolarHBondContact CA-O 3.41Å; L303-E347 PolarHBondContact N-O 2.95Å; E347-W349 PolarHBondContact OE1-NE1 3.21Å; E347-K485 HydrophobicContact CG-CB 4.24Å; E347-V487 HydrophobicContact CG-CG2 3.93Å
348	L	97.5	Very high	97	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	134.4	178.6	-51.5	-174.4	0	0	0	109.5	L303 F312 F314 V340 P346 Y474 K485 I486 V487	L303-L348 HydrophobicContact CB-CD2 3.85Å; L303-L348 HydrophobicContact CD1-CD2 3.98Å; L303-L348 HydrophobicContact CG-CD2 4.29Å; F312-L348 HydrophobicContact CD1-CD1 4.28Å; F312-L348 HydrophobicContact CD1-CD2 4.05Å; F312-L348 HydrophobicContact CE1-CD2 3.96Å; F312-L348 HydrophobicContact CG-CD1 4.32Å; F314-L348 HydrophobicContact CZ-CD1 4.08Å; V340-L348 HydrophobicContact CB-CD2 4.42Å; V340-L348 HydrophobicContact CG1-CD1 4.41Å; V340-L348 HydrophobicContact CG1-CD2 4.09Å; P346-L348 HydrophobicContact CG-CD2 3.95Å; L348-Y474 HydrophobicContact CD1-CD1 3.99Å; L348-Y474 HydrophobicContact CD1-CE1 4Å; L348-Y474 HydrophobicContact CG-CD1 4.35Å; L348-Y474 HydrophobicContact CG-CE1 3.94Å; L348-K485 PolarHBondContact N-O 2.69Å; L348-I486 HydrophobicContact CB-CB 4.5Å; L348-I486 HydrophobicContact CB-CG1 4.27Å; L348-I486 HydrophobicContact CB-CG2 4.26Å; L348-I486 HydrophobicContact CD1-CD1 4.48Å; L348-I486 HydrophobicContact CD1-CG1 4.28Å; L348-I486 CarbonylContact O-C 3.55Å; L348-I486 VanDerWaalsContact O-CA 3.31Å; L348-I486 WeakPolarHBondContact O-CA 3.27Å; L348-V487 PolarHBondContact O-N 3.45Å
349	W	97.7	Very high	97.1	Very high	39 Å²	39	22 Å²	22	15%	0.148	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	125.5	172	-76.8	61.3	0	0	0	109.6	T302 L303 L304 G305 E347 V487 T489 I492 P493 L496	T302-W349 HydrophobicContact CG2-CG 4.23Å; L303-W349 PolarHBondContact O-N 3.24Å; L304-W349 HydrophobicContact CD2-CB 3.75Å; L304-W349 HydrophobicContact CD2-CG 3.95Å; G305-W349 WeakPolarHBondContact CA-O 3.49Å; G305-W349 PolarHBondContact N-O 3.1Å; E347-W349 PolarHBondContact OE1-NE1 3.21Å; W349-V487 WeakPolarHBondContact CA-O 3.41Å; W349-V487 HydrophobicContact CD2-CB 3.79Å; W349-V487 HydrophobicContact CD2-CG1 3.91Å; W349-V487 HydrophobicContact CD2-CG2 4.4Å; W349-V487 HydrophobicContact CE3-CB 4.16Å; W349-V487 HydrophobicContact CE3-CG1 3.79Å; W349-V487 HydrophobicContact CG-CB 4.11Å; W349-V487 HydrophobicContact CH2-CG1 3.81Å; W349-V487 HydrophobicContact CZ2-CB 4.21Å; W349-V487 HydrophobicContact CZ2-CG1 3.9Å; W349-V487 HydrophobicContact CZ2-CG2 4.16Å; W349-V487 HydrophobicContact CZ3-CG1 3.74Å; W349-T489 HydrophobicContact CE3-CG2 3.66Å; W349-T489 HydrophobicContact CZ3-CG2 3.61Å; W349-I492 HydrophobicContact CB-CD1 4.45Å; W349-I492 HydrophobicContact CB-CG2 4.43Å; W349-P493 HydrophobicContact CZ3-CG 3.99Å; W349-L496 HydrophobicContact CD2-CD1 3.5Å; W349-L496 HydrophobicContact CE3-CD1 3.38Å; W349-L496 HydrophobicContact CG-CD1 4.2Å; W349-L496 HydrophobicContact CH2-CD1 3.83Å; W349-L496 HydrophobicContact CH2-CD2 4.33Å; W349-L496 HydrophobicContact CZ2-CD1 3.95Å; W349-L496 HydrophobicContact CZ2-CD2 4.12Å; W349-L496 HydrophobicContact CZ3-CD1 3.55Å
350	V	98.3	Very high	97.1	Very high	1 Å²	1	22 Å²	22	1%	0.006	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	157.5	-175.9	-61.3	0	0	0	0	110.7	F312 Y356 W462 P464 I486 V487 V488 T489	F312-V350 HydrophobicContact CE2-CG1 4.07Å; F312-V350 HydrophobicContact CZ-CG1 4.39Å; V350-Y356 HydrophobicContact CB-CD2 4.08Å; V350-Y356 HydrophobicContact CB-CE1 4.45Å; V350-Y356 HydrophobicContact CB-CE2 3.5Å; V350-Y356 VanDerWaalsContact CB-CE2 3.5Å; V350-Y356 HydrophobicContact CG1-CD1 4.37Å; V350-Y356 HydrophobicContact CG1-CD2 4.07Å; V350-Y356 HydrophobicContact CG1-CE1 4.19Å; V350-Y356 HydrophobicContact CG1-CE2 3.88Å; V350-Y356 HydrophobicContact CG1-CG 4.31Å; V350-W462 HydrophobicContact CG2-CH2 4.19Å; V350-W462 HydrophobicContact CG2-CZ3 4.03Å; V350-P464 HydrophobicContact CG2-CG 4.01Å; V350-I486 HydrophobicContact CB-CG2 4.34Å; V350-I486 HydrophobicContact CG1-CG2 3.96Å; V350-I486 HydrophobicContact CG2-CG2 3.48Å; V350-I486 VanDerWaalsContact CG2-CG2 3.48Å; V350-V487 PolarHBondContact N-O 2.94Å; V350-V488 HydrophobicContact CG2-CB 4.25Å; V350-V488 HydrophobicContact CG2-CG1 4.39Å; V350-V488 HydrophobicContact CG2-CG2 3.77Å; V350-T489 PolarHBondContact O-N 3.03Å; V350-T489 PolarHBondContact O-OG1 3.06Å; V350-T489 VanDerWaalsContact O-OG1 3.06Å
351	Q	97.5	Very high	97.1	Very high	67 Å²	67	22 Å²	22	31%	0.313	12%	0.122	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	134.7	-177.8	-170.3	174.8	-22.2	0	0	111.2	V354 Y356 P464 T489 D490 I492	Q351-V354 HydrophobicContact CB-CB 4.32Å; Q351-V354 HydrophobicContact CB-CG2 3.86Å; Q351-V354 HydrophobicContact CG-CG2 4.13Å; Q351-V354 WeakPolarHBondContact O-CB 3.28Å; Q351-V354 PolarHBondContact O-N 3.02Å; Q351-Y356 PolarHBondContact N-OH 3.21Å; Q351-P464 WeakPolarHBondContact O-CG 3.4Å; Q351-T489 CarbonylContact C-O 3.48Å; Q351-T489 VanDerWaalsContact CA-O 3.26Å; Q351-T489 WeakPolarHBondContact CA-O 3.37Å; Q351-D490 WeakPolarHBondContact CG-O 3.46Å; Q351-D490 PolarHBondContact NE2-O 2.91Å; Q351-I492 HydrophobicContact CB-CG1 4.4Å
352	R	97.7	Very high	97.2	Very high	31 Å²	31	21.9 Å²	21.9	12%	0.117	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	137.8	173.9	-67.7	-167.3	179.1	84.4	5.2	110.8	V354 P464 D465 T468 D470 V488 T489 D490	R352-V354 PolarHBondContact O-N 3.17Å; R352-P464 CarbonylContact C-O 3.5Å; R352-P464 WeakPolarHBondContact CA-O 3.31Å; R352-D465 VanDerWaalsContact CD-O 3.32Å; R352-D465 WeakPolarHBondContact CD-O 3.38Å; R352-D465 PolarHBondContact NE-O 3.43Å; R352-T468 PolarHBondContact NE-O 3.41Å; R352-T468 PolarHBondContact NH2-O 2.85Å; R352-D470 IonicContact CZ-OD1 2.76Å; R352-D470 IonicContact NH1-OD1 3.31Å; R352-D470 IonicContact NH2-OD1 2.92Å; R352-D470 PolarHBondContact NH2-OD1 3.47Å; R352-V488 HydrophobicContact CG-CG1 3.61Å; R352-T489 PolarHBondContact N-O 2.84Å; R352-D490 VanDerWaalsContact CD-OD1 3.3Å; R352-D490 WeakPolarHBondContact CD-OD1 3.28Å; R352-D490 IonicContact CZ-OD1 2.83Å; R352-D490 IonicContact NE-OD1 3.6Å; R352-D490 IonicContact NH1-OD1 3.67Å; R352-D490 PolarHBondContact NH1-OD1 3.39Å
353	G	97.1	Very high	97.3	Very high	59 Å²	59	21.9 Å²	21.9	61%	0.608	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.9	-4.5	-178.1	0	0	0	0	0	115	P464	G353-P464 PolarHBondContact N-O 3.27Å
354	V	97.7	Very high	97.3	Very high	46 Å²	46	25.5 Å²	25.5	28%	0.279	14%	0.142	S	C	.	.			trans	-94.9	131.3	174.3	179.5	0	0	0	0	109.8	Q351 R352 Y356 P464	Q351-V354 HydrophobicContact CB-CB 4.32Å; Q351-V354 HydrophobicContact CB-CG2 3.86Å; Q351-V354 HydrophobicContact CG-CG2 4.13Å; Q351-V354 WeakPolarHBondContact O-CB 3.28Å; Q351-V354 PolarHBondContact O-N 3.02Å; R352-V354 PolarHBondContact O-N 3.17Å; V354-Y356 HydrophobicContact CB-CE2 3.78Å; V354-Y356 HydrophobicContact CG1-CE1 4.1Å; V354-Y356 HydrophobicContact CG1-CE2 3.86Å; V354-Y356 WeakPolarHBondContact O-CD2 3.45Å; V354-Y356 VanDerWaalsContact O-CE2 3.23Å; V354-Y356 WeakPolarHBondContact O-CE2 3.11Å; V354-P464 WeakPolarHBondContact O-CD 3.3Å
355	T	97.7	Very high	97.1	Very high	62 Å²	62	26.6 Å²	26.6	38%	0.38	15%	0.148	S	C	.	.			trans	-84.4	126.2	177.5	-53.6	0	0	0	0	111	Q461 T463	T355-Q461 HydrophobicContact CG2-CB 3.87Å; T355-Q461 HydrophobicContact CG2-CG 4.18Å; T355-T463 WeakPolarHBondContact CA-OG1 3.34Å; T355-T463 WeakPolarHBondContact CB-OG1 3.43Å; T355-T463 PolarHBondContact OG1-OG1 2.72Å
356	Y	98.5	Very high	96.8	Very high	1 Å²	1	31.3 Å²	31.3	0%	0.004	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142.2	176.4	-62.5	-80.8	0	0	0	110.7	G305 T310 F312 V350 Q351 V354 Q461 W462 P464	G305-Y356 VanDerWaalsContact O-CE1 3.29Å; G305-Y356 WeakPolarHBondContact O-CE1 3Å; G305-Y356 PolarHBondContact O-OH 3.17Å; T310-Y356 CarbonylContact O-C 3.59Å; T310-Y356 WeakPolarHBondContact O-CA 3.44Å; F312-Y356 HydrophobicContact CD2-CD1 4.38Å; F312-Y356 AromaticContact CE2-CD1 3.63Å; F312-Y356 HydrophobicContact CE2-CD1 3.63Å; F312-Y356 HydrophobicContact CE2-CE1 4.23Å; F312-Y356 HydrophobicContact CE2-CG 4.19Å; F312-Y356 HydrophobicContact CZ-CD1 4.49Å; V350-Y356 HydrophobicContact CB-CD2 4.08Å; V350-Y356 HydrophobicContact CB-CE1 4.45Å; V350-Y356 HydrophobicContact CB-CE2 3.5Å; V350-Y356 VanDerWaalsContact CB-CE2 3.5Å; V350-Y356 HydrophobicContact CG1-CD1 4.37Å; V350-Y356 HydrophobicContact CG1-CD2 4.07Å; V350-Y356 HydrophobicContact CG1-CE1 4.19Å; V350-Y356 HydrophobicContact CG1-CE2 3.88Å; V350-Y356 HydrophobicContact CG1-CG 4.31Å; Q351-Y356 PolarHBondContact N-OH 3.21Å; V354-Y356 HydrophobicContact CB-CE2 3.78Å; V354-Y356 HydrophobicContact CG1-CE1 4.1Å; V354-Y356 HydrophobicContact CG1-CE2 3.86Å; V354-Y356 WeakPolarHBondContact O-CD2 3.45Å; V354-Y356 VanDerWaalsContact O-CE2 3.23Å; V354-Y356 WeakPolarHBondContact O-CE2 3.11Å; Y356-Q461 CarbonylContact O-C 3.4Å; Y356-Q461 WeakPolarHBondContact O-CA 3.39Å; Y356-W462 PolarHBondContact N-O 3.37Å; Y356-W462 PolarHBondContact O-N 3.5Å; Y356-P464 HydrophobicContact CE2-CG 4.36Å
357	T	98.5	Very high	96.4	Very high	29 Å²	29	38.4 Å²	38.4	18%	0.178	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	122.9	176.3	-58.5	0	0	0	0	110.1	T310 T311 F312 V459	T310-T357 PolarHBondContact O-N 2.59Å; T311-T357 WeakPolarHBondContact CA-O 3.39Å; T311-T357 HydrophobicContact CG2-CG2 4.42Å; F312-T357 PolarHBondContact N-O 3.05Å; T357-V459 HydrophobicContact CG2-CG1 3.61Å
358	M	98.4	Very high	95.8	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	116.4	175.2	-54	-53.6	171.2	0	0	108.8	F312 F314 L375 I377 V459 F460 W462	F312-M358 HydrophobicContact CB-SD 4.05Å; F312-M358 HydrophobicContact CD2-CE 4.22Å; F312-M358 HydrophobicContact CD2-SD 4.11Å; F314-M358 HydrophobicContact CE2-CB 4.33Å; F314-M358 HydrophobicContact CE2-CG 4.49Å; F314-M358 HydrophobicContact CE2-SD 3.65Å; F314-M358 HydrophobicContact CZ-SD 4.14Å; M358-L375 HydrophobicContact CB-CD2 4.05Å; M358-L375 HydrophobicContact CG-CD2 4.41Å; M358-I377 HydrophobicContact CE-CD1 3.9Å; M358-V459 WeakPolarHBondContact O-CA 3.45Å; M358-F460 HydrophobicContact CB-CD1 4.01Å; M358-F460 HydrophobicContact CB-CD2 4.25Å; M358-F460 HydrophobicContact CB-CE1 3.66Å; M358-F460 HydrophobicContact CB-CE2 3.9Å; M358-F460 HydrophobicContact CB-CG 4.3Å; M358-F460 HydrophobicContact CB-CZ 3.6Å; M358-F460 HydrophobicContact CG-CD2 4.22Å; M358-F460 HydrophobicContact CG-CE1 4.24Å; M358-F460 HydrophobicContact CG-CE2 3.61Å; M358-F460 HydrophobicContact CG-CZ 3.64Å; M358-F460 PolarHBondContact N-O 2.91Å; M358-F460 PolarHBondContact O-N 2.81Å; M358-F460 VanDerWaalsContact O-N 3.13Å; M358-W462 HydrophobicContact CE-CB 4.41Å; M358-W462 HydrophobicContact CE-CE3 3.66Å; M358-W462 HydrophobicContact CE-CZ3 4.37Å
359	R	98.6	Very high	95.3	Very high	70 Å²	70	43.1 Å²	43.1	26%	0.264	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	111	178.6	-170.2	177.6	99.2	80.2	4.3	109.4	F312 T313 F314 E361 A457 G458 V459	F312-R359 PolarHBondContact O-N 2.84Å; T313-R359 CarbonylContact C-O 3.55Å; T313-R359 VanDerWaalsContact CA-O 3.28Å; T313-R359 WeakPolarHBondContact CA-O 3.29Å; T313-R359 PolarHBondContact OG1-NE 2.96Å; F314-R359 PolarHBondContact N-O 2.94Å; R359-E361 VanDerWaalsContact CZ-CD 3.5Å; R359-E361 IonicContact CZ-OE1 3.73Å; R359-E361 IonicContact CZ-OE2 3.86Å; R359-E361 IonicContact NH1-OE1 3.88Å; R359-E361 PolarHBondContact NH1-OE1 3.41Å; R359-E361 IonicContact NH2-OE1 2.85Å; R359-E361 PolarHBondContact NH2-OE1 3.07Å; R359-E361 IonicContact NH2-OE2 3.78Å; R359-E361 PolarHBondContact NH2-OE2 2.9Å; R359-A457 HydrophobicContact CG-CB 3.5Å; R359-G458 CarbonylContact C-O 3.26Å; R359-G458 WeakPolarHBondContact CA-O 3.47Å; R359-V459 HydrophobicContact CG-CG2 4.29Å
360	V	98.8	Very high	94.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	121.3	-166.5	-166.2	0	0	0	0	111.9	F314 W338 L375 A419 A457 G458 F460	F314-V360 HydrophobicContact CB-CG1 4.49Å; W338-V360 HydrophobicContact CH2-CG1 3.78Å; W338-V360 HydrophobicContact CZ3-CG1 4.3Å; V360-L375 HydrophobicContact CB-CB 4.48Å; V360-L375 HydrophobicContact CG1-CB 3.92Å; V360-L375 HydrophobicContact CG2-CB 3.69Å; V360-L375 HydrophobicContact CG2-CD2 3.79Å; V360-L375 HydrophobicContact CG2-CG 4.41Å; V360-A419 WeakPolarHBondContact CG1-O 3.18Å; V360-A457 WeakPolarHBondContact O-CA 3.27Å; V360-G458 PolarHBondContact N-O 2.93Å; V360-G458 PolarHBondContact O-N 2.85Å; V360-F460 HydrophobicContact CG2-CD1 4.43Å; V360-F460 HydrophobicContact CG2-CE1 4.03Å
361	E	98.6	Very high	94.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	40.6	178.1	-60.9	179.5	138.1	0	0	111.4	F314 Q315 R359 G363 R422 C424 A457	F314-E361 WeakPolarHBondContact O-CA 3.49Å; F314-E361 PolarHBondContact O-N 3.05Å; Q315-E361 HydrophobicContact CG-CB 4.06Å; Q315-E361 WeakPolarHBondContact CG-OE2 3.48Å; Q315-E361 PolarHBondContact NE2-OE2 3.05Å; R359-E361 VanDerWaalsContact CZ-CD 3.5Å; R359-E361 IonicContact CZ-OE1 3.73Å; R359-E361 IonicContact CZ-OE2 3.86Å; R359-E361 IonicContact NH1-OE1 3.88Å; R359-E361 PolarHBondContact NH1-OE1 3.41Å; R359-E361 IonicContact NH2-OE1 2.85Å; R359-E361 PolarHBondContact NH2-OE1 3.07Å; R359-E361 IonicContact NH2-OE2 3.78Å; R359-E361 PolarHBondContact NH2-OE2 2.9Å; E361-G363 VanDerWaalsContact C-N 3.32Å; E361-R422 CarbonylContact C-O 3.19Å; E361-R422 WeakPolarHBondContact CA-O 3.25Å; E361-R422 HydrophobicContact CB-CG 4.45Å; E361-R422 WeakPolarHBondContact CB-O 3.37Å; E361-R422 HydrophobicContact CG-CG 4.11Å; E361-R422 IonicContact OE1-CZ 2.83Å; E361-R422 IonicContact OE1-NE 3.56Å; E361-R422 PolarHBondContact OE1-NE 2.71Å; E361-R422 IonicContact OE1-NH2 3.63Å; E361-R422 PolarHBondContact OE1-NH2 2.86Å; E361-C424 HydrophobicContact CB-CB 3.69Å; E361-C424 PolarHBondContact O-N 3.08Å; E361-C424 PolarHBondContact OE2-SG 3.12Å; E361-A457 HydrophobicContact CG-CB 3.57Å
362	G	97.8	Very high	94.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-83	-0.8	-178.9	0	0	0	0	0	115.8	N373	G362-N373 PolarHBondContact O-ND2 3Å
363	G	97.2	Very high	94.3	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.01	23%	0.228	C	C	.	.			trans	88.7	157.5	-173.9	0	0	0	0	0	114.5	E361 F371 G421 R422	E361-G363 VanDerWaalsContact C-N 3.32Å; G363-F371 CarbonylContact C-O 3.39Å; G363-F371 WeakPolarHBondContact CA-O 3.13Å; G363-G421 CarbonylContact C-O 3.58Å; G363-G421 WeakPolarHBondContact CA-O 3.28Å; G363-G421 PolarHBondContact N-O 3.04Å; G363-R422 PolarHBondContact N-O 3.39Å
364	D	95	Very high	94.4	Very high	80 Å²	80	38.7 Å²	38.7	43%	0.428	20%	0.199	S	C	.	.	B	Isolated β-bridge	trans	-127.7	15.1	-171.9	60.3	-9.8	0	0	0	113.4	T366 F371 Y420 G421	D364-T366 PolarHBondContact O-N 2.78Å; D364-F371 PolarHBondContact N-O 3.43Å; D364-Y420 HydrophobicContact CB-CD2 3.74Å; D364-Y420 HydrophobicContact CB-CE2 4.22Å; D364-G421 PolarHBondContact N-O 3.31Å
365	D	90.9	Very high	94.5	Very high	33 Å²	33	36.5 Å²	36.5	18%	0.176	19%	0.186	C	C	.	.			trans	-84.3	90.5	-176.1	-169.9	-31.4	0	0	0	112.4	I367 L368 F371 F372	D365-I367 PolarHBondContact O-N 2.85Å; D365-I367 VanDerWaalsContact O-N 3.07Å; D365-I367 WeakPolarHBondContact OD1-CB 3.47Å; D365-I367 PolarHBondContact OD1-N 2.81Å; D365-L368 CarbonylContact O-C 3.57Å; D365-L368 PolarHBondContact O-N 3.27Å; D365-L368 PolarHBondContact OD1-N 3.47Å; D365-F371 HydrophobicContact CB-CB 4.16Å; D365-F371 PolarHBondContact N-O 2.81Å; D365-F372 WeakPolarHBondContact O-CB 3.45Å
366	T	87.8	Confident	94.5	Very high	102 Å²	102	33.5 Å²	33.5	63%	0.626	17%	0.168	S	C	*	.	S	Bend	trans	-64.5	-12.3	-177	60.6	0	0	0	0	114.7	D364 F372	D364-T366 PolarHBondContact O-N 2.78Å; T366-F372 HydrophobicContact CG2-CD1 4.45Å; T366-F372 HydrophobicContact CG2-CD2 4.19Å; T366-F372 HydrophobicContact CG2-CE1 4.35Å; T366-F372 HydrophobicContact CG2-CE2 4.05Å; T366-F372 HydrophobicContact CG2-CG 4.4Å; T366-F372 HydrophobicContact CG2-CZ 4.14Å
367	I	86.5	Confident	94.5	Very high	149 Å²	149	33.5 Å²	33.5	76%	0.764	17%	0.167	S	C	*	.	S	Bend	trans	-86.3	-44.8	176.7	-59.2	173.3	0	0	0	109.7	D365	D365-I367 PolarHBondContact O-N 2.85Å; D365-I367 VanDerWaalsContact O-N 3.07Å; D365-I367 WeakPolarHBondContact OD1-CB 3.47Å; D365-I367 PolarHBondContact OD1-N 2.81Å
368	L	84.9	Confident	94.5	Very high	36 Å²	36	32.1 Å²	32.1	19%	0.188	16%	0.159	C	C	.	.	S	Bend	trans	-97.7	86.7	177.3	-65.8	177.3	0	0	0	110.1	D365 R370 F371 F372	D365-L368 CarbonylContact O-C 3.57Å; D365-L368 PolarHBondContact O-N 3.27Å; D365-L368 PolarHBondContact OD1-N 3.47Å; L368-R370 PolarHBondContact O-N 2.9Å; L368-F371 HydrophobicContact CB-CD2 4.32Å; L368-F371 HydrophobicContact CD1-CD2 4.18Å; L368-F371 HydrophobicContact CD1-CE2 4.44Å; L368-F371 WeakPolarHBondContact O-CA 3.48Å; L368-F371 PolarHBondContact O-N 2.88Å; L368-F372 PolarHBondContact O-N 2.83Å
369	E	86.4	Confident	94.4	Very high	98 Å²	98	34.7 Å²	34.7	46%	0.458	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-48.3	-32.3	-177	-72.5	-170.8	-179.6	0	0	114.7	F371 F372 K387 N479	E369-F371 PolarHBondContact O-N 2.96Å; E369-F372 PolarHBondContact O-N 2.93Å; E369-F372 VanDerWaalsContact O-N 3.12Å; E369-K387 WeakPolarHBondContact OE2-CE 3.26Å; E369-K387 IonicContact OE2-NZ 2.73Å; E369-K387 PolarHBondContact OE2-NZ 2.87Å; E369-N479 PolarHBondContact O-ND2 3.02Å
370	R	84.3	Confident	94.1	Very high	65 Å²	65	31.8 Å²	31.8	25%	0.245	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-61	-22.5	176.2	66.4	171.3	-168.3	-106	1.9	113.6	E335 L368 N373 G521	E335-R370 WeakPolarHBondContact OE2-CD 3.47Å; L368-R370 PolarHBondContact O-N 2.9Å; R370-N373 PolarHBondContact O-ND2 3.22Å; R370-G521 VanDerWaalsContact NH1-CA 3.31Å; R370-G521 VanDerWaalsContact NH2-N 3.2Å
371	F	92.8	Very high	93.7	Very high	9 Å²	9	33.8 Å²	33.8	4%	0.039	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-113.7	15.6	177.3	-58.1	-29.7	0	0	0	112.7	F336 G363 D364 D365 L368 E369 L423	F336-F371 HydrophobicContact CE2-CD1 4.01Å; F336-F371 AromaticContact CE2-CE1 3.55Å; F336-F371 HydrophobicContact CE2-CE1 3.55Å; F336-F371 AromaticContact CZ-CE1 3.81Å; F336-F371 HydrophobicContact CZ-CE1 3.81Å; G363-F371 CarbonylContact C-O 3.39Å; G363-F371 WeakPolarHBondContact CA-O 3.13Å; D364-F371 PolarHBondContact N-O 3.43Å; D365-F371 HydrophobicContact CB-CB 4.16Å; D365-F371 PolarHBondContact N-O 2.81Å; L368-F371 HydrophobicContact CB-CD2 4.32Å; L368-F371 HydrophobicContact CD1-CD2 4.18Å; L368-F371 HydrophobicContact CD1-CE2 4.44Å; L368-F371 WeakPolarHBondContact O-CA 3.48Å; L368-F371 PolarHBondContact O-N 2.88Å; E369-F371 PolarHBondContact O-N 2.96Å; F371-L423 HydrophobicContact CB-CD2 4.26Å; F371-L423 HydrophobicContact CD1-CD1 4.36Å; F371-L423 HydrophobicContact CD1-CD2 3.99Å; F371-L423 HydrophobicContact CD2-CD2 4.33Å; F371-L423 HydrophobicContact CE1-CD2 4.46Å; F371-L423 HydrophobicContact CG-CD2 3.95Å
372	F	95.7	Very high	93.3	Very high	29 Å²	29	36.6 Å²	36.6	13%	0.127	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-120.3	93.6	167.4	177.7	-123.7	0	0	0	108.3	D365 T366 L368 E369 P374 Y420 T478	D365-F372 WeakPolarHBondContact O-CB 3.45Å; T366-F372 HydrophobicContact CG2-CD1 4.45Å; T366-F372 HydrophobicContact CG2-CD2 4.19Å; T366-F372 HydrophobicContact CG2-CE1 4.35Å; T366-F372 HydrophobicContact CG2-CE2 4.05Å; T366-F372 HydrophobicContact CG2-CG 4.4Å; T366-F372 HydrophobicContact CG2-CZ 4.14Å; L368-F372 PolarHBondContact O-N 2.83Å; E369-F372 PolarHBondContact O-N 2.93Å; E369-F372 VanDerWaalsContact O-N 3.12Å; F372-P374 VanDerWaalsContact C-CD 3.43Å; F372-P374 HydrophobicContact CD1-CG 4.34Å; F372-P374 HydrophobicContact CD2-CG 4.11Å; F372-P374 HydrophobicContact CE1-CG 3.83Å; F372-P374 HydrophobicContact CE2-CG 3.61Å; F372-P374 HydrophobicContact CG-CG 4.45Å; F372-P374 HydrophobicContact CZ-CG 3.44Å; F372-P374 VanDerWaalsContact CZ-CG 3.44Å; F372-P374 WeakPolarHBondContact O-CD 3.42Å; F372-Y420 HydrophobicContact CD2-CD2 4.41Å; F372-Y420 HydrophobicContact CE2-CD1 4.06Å; F372-Y420 AromaticContact CE2-CD2 3.8Å; F372-Y420 HydrophobicContact CE2-CD2 3.8Å; F372-Y420 HydrophobicContact CE2-CE1 4.24Å; F372-Y420 AromaticContact CE2-CE2 3.98Å; F372-Y420 HydrophobicContact CE2-CE2 3.98Å; F372-Y420 AromaticContact CE2-CG 3.84Å; F372-Y420 HydrophobicContact CE2-CG 3.84Å; F372-T478 HydrophobicContact CD1-CG2 3.68Å; F372-T478 HydrophobicContact CE1-CG2 4.01Å; F372-T478 PolarHBondContact O-OG1 3.1Å
373	N	97.5	Very high	93	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.186	C	C	.	.			trans	-121.9	74.6	-175.3	-62.9	-79.8	0	0	0	111.2	L316 W338 G362 R370 L375 S476 N479 M482	L316-N373 WeakPolarHBondContact CD1-ND2 3.5Å; L316-N373 HydrophobicContact CD2-CB 4.41Å; W338-N373 HydrophobicContact CH2-CB 3.85Å; W338-N373 WeakPolarHBondContact CH2-O 3.29Å; W338-N373 HydrophobicContact CZ2-CB 3.81Å; W338-N373 WeakPolarHBondContact CZ2-O 3.39Å; G362-N373 PolarHBondContact O-ND2 3Å; R370-N373 PolarHBondContact O-ND2 3.22Å; N373-L375 PolarHBondContact O-N 2.9Å; N373-S476 PolarHBondContact OD1-OG 3.24Å; N373-N479 PolarHBondContact OD1-ND2 3.4Å; N373-M482 HydrophobicContact CB-CE 4.46Å; N373-M482 WeakPolarHBondContact OD1-CE 3.38Å; N373-M482 PolarHBondContact OD1-SD 3.28Å
374	P	98.7	Very high	92.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.186	C	C	.	.			trans	-61	130.9	169.7	-18.9	30.4	0	0	0	111.2	F372 P408 A419 Y420 S476 Y477	F372-P374 VanDerWaalsContact C-CD 3.43Å; F372-P374 HydrophobicContact CD1-CG 4.34Å; F372-P374 HydrophobicContact CD2-CG 4.11Å; F372-P374 HydrophobicContact CE1-CG 3.83Å; F372-P374 HydrophobicContact CE2-CG 3.61Å; F372-P374 HydrophobicContact CG-CG 4.45Å; F372-P374 HydrophobicContact CZ-CG 3.44Å; F372-P374 VanDerWaalsContact CZ-CG 3.44Å; F372-P374 WeakPolarHBondContact O-CD 3.42Å; P374-P408 HydrophobicContact CB-CB 3.52Å; P374-P408 HydrophobicContact CB-CG 3.69Å; P374-P408 HydrophobicContact CG-CB 3.93Å; P374-P408 HydrophobicContact CG-CG 3.73Å; P374-A419 CarbonylContact C-O 3.23Å; P374-A419 VanDerWaalsContact CA-O 3.28Å; P374-A419 WeakPolarHBondContact CA-O 3.35Å; P374-A419 HydrophobicContact CB-CB 4.2Å; P374-Y420 HydrophobicContact CB-CD1 4.04Å; P374-Y420 HydrophobicContact CG-CD1 3.94Å; P374-Y420 HydrophobicContact CG-CG 4.25Å; P374-S476 WeakPolarHBondContact O-CA 3.3Å; P374-Y477 HydrophobicContact CG-CD1 4.38Å; P374-Y477 WeakPolarHBondContact O-CB 3.44Å; P374-Y477 PolarHBondContact O-N 2.9Å
375	L	98.8	Very high	92.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	133.9	176	-176.8	72.1	0	0	0	109.6	F314 W338 M358 V360 N373 A419 F460 Y474	F314-L375 HydrophobicContact CB-CD2 4.48Å; F314-L375 HydrophobicContact CD1-CD1 3.72Å; F314-L375 HydrophobicContact CD1-CD2 3.94Å; F314-L375 HydrophobicContact CD1-CG 4.49Å; F314-L375 HydrophobicContact CD2-CD2 3.46Å; F314-L375 VanDerWaalsContact CD2-CD2 3.46Å; F314-L375 HydrophobicContact CE1-CD1 3.85Å; F314-L375 HydrophobicContact CE1-CD2 3.98Å; F314-L375 HydrophobicContact CE2-CD2 3.5Å; F314-L375 HydrophobicContact CG-CD1 4.19Å; F314-L375 HydrophobicContact CG-CD2 3.7Å; F314-L375 HydrophobicContact CZ-CD1 4.42Å; F314-L375 HydrophobicContact CZ-CD2 3.77Å; W338-L375 HydrophobicContact CZ2-CB 4.37Å; W338-L375 HydrophobicContact CZ2-CD1 4.18Å; M358-L375 HydrophobicContact CB-CD2 4.05Å; M358-L375 HydrophobicContact CG-CD2 4.41Å; V360-L375 HydrophobicContact CB-CB 4.48Å; V360-L375 HydrophobicContact CG1-CB 3.92Å; V360-L375 HydrophobicContact CG2-CB 3.69Å; V360-L375 HydrophobicContact CG2-CD2 3.79Å; V360-L375 HydrophobicContact CG2-CG 4.41Å; N373-L375 PolarHBondContact O-N 2.9Å; L375-A419 PolarHBondContact N-O 3.44Å; L375-F460 HydrophobicContact CB-CE1 4.27Å; L375-F460 HydrophobicContact CD2-CE1 4.03Å; L375-F460 HydrophobicContact CD2-CZ 4Å; L375-F460 HydrophobicContact CG-CE1 4.42Å; L375-F460 HydrophobicContact CG-CZ 4.36Å; L375-Y474 HydrophobicContact CD1-CD2 4.49Å
376	Y	98.7	Very high	92.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	158.8	167.6	81.6	-67.9	0	0	0	110.7	S378 G383 Y385 V398 A400 L402 Y474 Q475 S476	Y376-S378 VanDerWaalsContact CE2-CB 3.48Å; Y376-S378 WeakPolarHBondContact CE2-OG 3.09Å; Y376-G383 VanDerWaalsContact OH-CA 3.29Å; Y376-G383 WeakPolarHBondContact OH-CA 3.39Å; Y376-Y385 HydrophobicContact CE2-CD2 4.21Å; Y376-V398 HydrophobicContact CD2-CG1 4.19Å; Y376-V398 HydrophobicContact CD2-CG2 4.18Å; Y376-V398 HydrophobicContact CE2-CG2 4.32Å; Y376-A400 WeakPolarHBondContact CA-O 3.45Å; Y376-A400 WeakPolarHBondContact CB-O 3.33Å; Y376-L402 HydrophobicContact CD2-CD1 4.09Å; Y376-L402 HydrophobicContact CD2-CG 4.35Å; Y376-L402 HydrophobicContact CG-CD1 4.37Å; Y376-L402 HydrophobicContact CG-CD2 4.42Å; Y376-L402 HydrophobicContact CG-CG 4.31Å; Y376-Y474 WeakPolarHBondContact O-CA 3.31Å; Y376-Q475 HydrophobicContact CD1-CB 4.36Å; Y376-Q475 WeakPolarHBondContact CD1-O 3.35Å; Y376-Q475 HydrophobicContact CE1-CB 3.68Å; Y376-Q475 PolarHBondContact N-O 2.73Å; Y376-Q475 VanDerWaalsContact N-O 3.11Å; Y376-Q475 PolarHBondContact O-N 2.98Å; Y376-S476 WeakPolarHBondContact CE1-O 3.5Å
377	I	98.8	Very high	92.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	126.9	179.5	-59.5	173.9	0	0	0	108.3	M358 F399 A400 W462 V472 Y473 I486	M358-I377 HydrophobicContact CE-CD1 3.9Å; I377-F399 HydrophobicContact CG2-CB 4.29Å; I377-F399 PolarHBondContact O-N 2.99Å; I377-A400 HydrophobicContact CB-CB 4.34Å; I377-A400 HydrophobicContact CD1-CB 4.35Å; I377-A400 PolarHBondContact N-O 3.04Å; I377-A400 PolarHBondContact O-N 2.83Å; I377-W462 HydrophobicContact CD1-CD2 3.75Å; I377-W462 HydrophobicContact CD1-CE3 3.54Å; I377-W462 HydrophobicContact CD1-CG 4.22Å; I377-W462 HydrophobicContact CD1-CH2 4.47Å; I377-W462 HydrophobicContact CD1-CZ3 3.93Å; I377-W462 HydrophobicContact CG2-CH2 4.19Å; I377-W462 HydrophobicContact CG2-CZ2 4.07Å; I377-V472 HydrophobicContact CG2-CB 4.09Å; I377-V472 HydrophobicContact CG2-CG2 3.58Å; I377-Y473 VanDerWaalsContact CA-O 3.31Å; I377-Y473 WeakPolarHBondContact CA-O 3.4Å; I377-I486 HydrophobicContact CD1-CD1 3.84Å; I377-I486 HydrophobicContact CG1-CD1 4.13Å; I377-I486 HydrophobicContact CG2-CD1 4.1Å
378	S	98.4	Very high	92	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	174.7	-177.9	65.9	0	0	0	0	112.4	Y376 D380 T397 V472 Y473	Y376-S378 VanDerWaalsContact CE2-CB 3.48Å; Y376-S378 WeakPolarHBondContact CE2-OG 3.09Å; S378-D380 PolarHBondContact O-N 3.4Å; S378-D380 PolarHBondContact OG-N 3.1Å; S378-T397 CarbonylContact C-O 3.51Å; S378-T397 WeakPolarHBondContact CA-O 3.38Å; S378-T397 WeakPolarHBondContact CB-O 3.5Å; S378-V472 CarbonylContact O-C 3.56Å; S378-V472 WeakPolarHBondContact O-CA 3.49Å; S378-V472 WeakPolarHBondContact O-CB 3.46Å; S378-Y473 PolarHBondContact N-O 2.81Å; S378-Y473 PolarHBondContact O-N 2.97Å
379	D	96	Very high	91.6	Very high	55 Å²	55	24 Å²	24	29%	0.294	12%	0.122	S	C	.	.	S	Bend	trans	-75.3	-3.7	168.9	56.8	6.3	0	0	0	113.2	T397 F399	D379-T397 VanDerWaalsContact CG-N 3.34Å; D379-T397 PolarHBondContact N-O 2.72Å; D379-T397 VanDerWaalsContact N-O 3.09Å; D379-T397 PolarHBondContact OD1-N 2.9Å; D379-T397 WeakPolarHBondContact OD2-CB 3.01Å; D379-T397 PolarHBondContact OD2-N 3.22Å; D379-T397 PolarHBondContact OD2-OG1 2.73Å; D379-F399 HydrophobicContact CB-CE2 4.12Å
380	D	93.1	Very high	91.5	Very high	10 Å²	10	24.9 Å²	24.9	5%	0.053	13%	0.13	C	C	.	.			trans	-91.6	121.3	-178.7	176.1	77.9	0	0	0	113.1	R260 S378 Y382 G383 I396 Y473	R260-D380 IonicContact CZ-OD1 2.82Å; R260-D380 IonicContact CZ-OD2 3.49Å; R260-D380 IonicContact NE-OD1 3.7Å; R260-D380 PolarHBondContact NE-OD1 3.47Å; R260-D380 IonicContact NH2-OD1 3.97Å; R260-D380 PolarHBondContact NH2-OD1 2.91Å; R260-D380 IonicContact NH2-OD2 3.9Å; R260-D380 PolarHBondContact NH2-OD2 3.12Å; S378-D380 PolarHBondContact O-N 3.4Å; S378-D380 PolarHBondContact OG-N 3.1Å; D380-Y382 VanDerWaalsContact C-N 3.26Å; D380-Y382 PolarHBondContact O-N 2.81Å; D380-Y382 PolarHBondContact OD2-N 3.22Å; D380-Y382 VanDerWaalsContact OD2-N 3.08Å; D380-G383 PolarHBondContact OD2-N 3.07Å; D380-I396 HydrophobicContact CB-CD1 3.97Å; D380-I396 HydrophobicContact CB-CG1 4.11Å; D380-I396 HydrophobicContact CB-CG2 3.88Å; D380-Y473 WeakPolarHBondContact O-CB 3.48Å
381	P	90.3	Very high	91.3	Very high	42 Å²	42	27.2 Å²	27.2	27%	0.273	14%	0.144	S	C	.	.	S	Bend	trans	-77.7	-3	-175.9	28.5	-32.6	0	0	0	115.2	Y473 Q475	P381-Y473 VanDerWaalsContact CA-CG 3.43Å; P381-Y473 HydrophobicContact CB-CD1 3.66Å; P381-Y473 HydrophobicContact CB-CD2 3.97Å; P381-Y473 HydrophobicContact CB-CE1 3.5Å; P381-Y473 VanDerWaalsContact CB-CE1 3.5Å; P381-Y473 HydrophobicContact CB-CE2 3.85Å; P381-Y473 HydrophobicContact CB-CG 3.9Å; P381-Y473 HydrophobicContact CG-CE2 4.41Å; P381-Q475 PolarHBondContact O-NE2 2.78Å
382	Y	88.7	Confident	90.8	Very high	58 Å²	58	27.1 Å²	27.1	23%	0.227	14%	0.143	C	C	.	.	S	Bend	trans	-114.5	-25.8	-163.2	-60.8	-75.6	0	0	0	114	D195 R260 D380 F480 N481	D195-Y382 WeakPolarHBondContact OD2-CE1 3.49Å; R260-Y382 HydrophobicContact CB-CE2 4.25Å; R260-Y382 HydrophobicContact CG-CD2 3.88Å; R260-Y382 HydrophobicContact CG-CE2 3.77Å; R260-Y382 VanDerWaalsContact CZ-CB 3.43Å; D380-Y382 VanDerWaalsContact C-N 3.26Å; D380-Y382 PolarHBondContact O-N 2.81Å; D380-Y382 PolarHBondContact OD2-N 3.22Å; D380-Y382 VanDerWaalsContact OD2-N 3.08Å; Y382-F480 CarbonylContact O-C 3.54Å; Y382-F480 WeakPolarHBondContact O-CA 3.34Å; Y382-N481 PolarHBondContact O-N 2.97Å
383	G	91.6	Very high	90.6	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	79.2	-157.1	-178.4	0	0	0	0	0	113.5	R260 Y376 D380 Y385 Q475 F480	R260-G383 PolarHBondContact NH1-O 3.21Å; R260-G383 PolarHBondContact NH2-O 2.83Å; Y376-G383 VanDerWaalsContact OH-CA 3.29Å; Y376-G383 WeakPolarHBondContact OH-CA 3.39Å; D380-G383 PolarHBondContact OD2-N 3.07Å; G383-Y385 PolarHBondContact O-N 2.94Å; G383-Q475 VanDerWaalsContact CA-CB 3.47Å; G383-F480 WeakPolarHBondContact O-CD1 3.42Å; G383-F480 WeakPolarHBondContact O-CE1 3.32Å
384	G	88.5	Confident	90.2	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.177	C	C	.	.			trans	61	30.6	177.4	0	0	0	0	0	113.8	A386 K387 S476 Y477 N479	G384-A386 PolarHBondContact O-N 3.4Å; G384-A386 VanDerWaalsContact O-N 3.13Å; G384-K387 WeakPolarHBondContact O-CB 3.46Å; G384-K387 PolarHBondContact O-N 2.88Å; G384-S476 PolarHBondContact N-O 3.21Å; G384-Y477 CarbonylContact C-O 3.48Å; G384-Y477 WeakPolarHBondContact CA-O 3.18Å; G384-N479 PolarHBondContact N-O 2.94Å
385	Y	91.9	Very high	89.8	Confident	10 Å²	10	37.5 Å²	37.5	4%	0.039	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-49	-38.1	-177.6	-170.4	-82.7	0	0	0	113.8	Y376 G383 K387 L388 K393 I396 V398 L402 S406 Y477	Y376-Y385 HydrophobicContact CE2-CD2 4.21Å; G383-Y385 PolarHBondContact O-N 2.94Å; Y385-K387 PolarHBondContact O-N 3.44Å; Y385-L388 WeakPolarHBondContact O-CB 3.16Å; Y385-L388 PolarHBondContact O-N 3.47Å; Y385-L388 VanDerWaalsContact O-N 3.17Å; Y385-K393 HydrophobicContact CD1-CD 4.2Å; Y385-K393 HydrophobicContact CD1-CG 4.21Å; Y385-K393 HydrophobicContact CE1-CB 4.3Å; Y385-K393 HydrophobicContact CE1-CD 3.55Å; Y385-K393 HydrophobicContact CE1-CG 3.7Å; Y385-K393 HydrophobicContact CE2-CB 4.14Å; Y385-K393 HydrophobicContact CE2-CG 4.03Å; Y385-K393 VanDerWaalsContact O-CE 3.22Å; Y385-K393 WeakPolarHBondContact O-CE 3.49Å; Y385-I396 HydrophobicContact CD2-CD1 4.17Å; Y385-I396 HydrophobicContact CD2-CG2 4.22Å; Y385-I396 HydrophobicContact CE2-CB 4.16Å; Y385-I396 HydrophobicContact CE2-CD1 4.42Å; Y385-I396 HydrophobicContact CE2-CG2 4.06Å; Y385-V398 HydrophobicContact CD2-CG2 4.47Å; Y385-V398 HydrophobicContact CE2-CG2 3.97Å; Y385-L402 HydrophobicContact CD1-CD1 4.13Å; Y385-L402 HydrophobicContact CE1-CD1 4.19Å; Y385-L402 HydrophobicContact CG-CD1 4.34Å; Y385-S406 PolarHBondContact OH-OG 2.86Å; Y385-S406 VanDerWaalsContact OH-OG 3.13Å; Y385-Y477 HydrophobicContact CD1-CD2 4Å; Y385-Y477 AromaticContact CD1-CE2 3.49Å; Y385-Y477 HydrophobicContact CD1-CE2 3.49Å; Y385-Y477 VanDerWaalsContact CD1-CE2 3.49Å; Y385-Y477 HydrophobicContact CE1-CE2 4.29Å; Y385-Y477 HydrophobicContact CG-CD2 4.28Å; Y385-Y477 HydrophobicContact CG-CE2 4.22Å; Y385-Y477 PolarHBondContact N-O 3.22Å
386	A	90.2	Very high	89.5	Confident	40 Å²	40	38.3 Å²	38.3	33%	0.331	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-58.7	-29	178	0	0	0	0	0	113.6	G384 Y477 T478	G384-A386 PolarHBondContact O-N 3.4Å; G384-A386 VanDerWaalsContact O-N 3.13Å; A386-Y477 HydrophobicContact CB-CD1 3.86Å; A386-Y477 HydrophobicContact CB-CE1 3.48Å; A386-Y477 VanDerWaalsContact CB-CE1 3.48Å; A386-Y477 HydrophobicContact CB-CE2 4.42Å; A386-Y477 HydrophobicContact CB-CG 4.47Å; A386-Y477 WeakPolarHBondContact CB-O 3.44Å; A386-Y477 PolarHBondContact N-O 3.49Å; A386-T478 HydrophobicContact CB-CG2 4.37Å
387	K	84.5	Confident	89.5	Confident	59 Å²	59	41.8 Å²	41.8	26%	0.257	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-88.4	-5.3	-175.8	-65.2	174.4	172.3	157.9	0	112.9	E369 G384 Y385 T478 N479 F480	E369-K387 WeakPolarHBondContact OE2-CE 3.26Å; E369-K387 IonicContact OE2-NZ 2.73Å; E369-K387 PolarHBondContact OE2-NZ 2.87Å; G384-K387 WeakPolarHBondContact O-CB 3.46Å; G384-K387 PolarHBondContact O-N 2.88Å; Y385-K387 PolarHBondContact O-N 3.44Å; K387-T478 VanDerWaalsContact CD-O 3.29Å; K387-T478 WeakPolarHBondContact CD-O 3.37Å; K387-T478 WeakPolarHBondContact CE-O 3.45Å; K387-T478 PolarHBondContact NZ-O 2.8Å; K387-N479 PolarHBondContact NZ-OD1 3.03Å; K387-F480 HydrophobicContact CB-CE2 4.14Å; K387-F480 HydrophobicContact CB-CZ 3.88Å; K387-F480 HydrophobicContact CD-CD2 4.46Å; K387-F480 HydrophobicContact CD-CE2 3.84Å; K387-F480 HydrophobicContact CD-CZ 4.37Å
388	L	81.2	Confident	89.4	Confident	7 Å²	7	43.9 Å²	43.9	4%	0.037	24%	0.241	C	C	.	.	S	Bend	trans	-84.3	150.2	-179.8	-57.1	-177.5	0	0	0	111	F261 Y385 D392 K393 I396 F480	F261-L388 HydrophobicContact CE1-CD1 4.41Å; F261-L388 HydrophobicContact CE2-CD2 3.43Å; F261-L388 VanDerWaalsContact CE2-CD2 3.43Å; F261-L388 HydrophobicContact CZ-CD1 3.69Å; F261-L388 HydrophobicContact CZ-CD2 3.48Å; F261-L388 VanDerWaalsContact CZ-CD2 3.48Å; F261-L388 HydrophobicContact CZ-CG 4.2Å; Y385-L388 WeakPolarHBondContact O-CB 3.16Å; Y385-L388 PolarHBondContact O-N 3.47Å; Y385-L388 VanDerWaalsContact O-N 3.17Å; L388-D392 HydrophobicContact CB-CB 4.19Å; L388-K393 HydrophobicContact CB-CG 3.83Å; L388-K393 WeakPolarHBondContact O-CE 3.19Å; L388-K393 PolarHBondContact O-NZ 3.42Å; L388-I396 HydrophobicContact CD1-CD1 3.34Å; L388-F480 HydrophobicContact CD2-CE1 4.24Å; L388-F480 HydrophobicContact CD2-CZ 4.3Å
389	A	77.7	Confident	89.4	Confident	21 Å²	21	46.2 Å²	46.2	17%	0.174	25%	0.251	C	S	.	.			trans	-77.5	161.8	168.7	0	0	0	0	0	110.4	E391 D392 K393	A389-E391 WeakPolarHBondContact CB-OE2 3.42Å; A389-E391 PolarHBondContact O-N 2.98Å; A389-D392 WeakPolarHBondContact O-CB 3.27Å; A389-D392 PolarHBondContact O-N 3.04Å; A389-K393 WeakPolarHBondContact O-CG 3.45Å; A389-K393 PolarHBondContact O-N 3.13Å
390	D	84.7	Confident	89.5	Confident	116 Å²	116	43.7 Å²	43.7	62%	0.62	24%	0.238	S	C	*	.	H	α-helix	trans	-63.9	-31.1	-174.1	-61.6	-27.2	0	0	0	112.3	D392 K393 S394	D390-D392 VanDerWaalsContact C-N 3.32Å; D390-D392 PolarHBondContact O-N 2.69Å; D390-K393 PolarHBondContact O-N 2.89Å; D390-K393 IonicContact OD1-NZ 3.67Å; D390-K393 PolarHBondContact OD1-NZ 2.79Å; D390-S394 WeakPolarHBondContact O-CB 2.97Å; D390-S394 PolarHBondContact O-N 3.27Å; D390-S394 PolarHBondContact O-OG 3.14Å
391	E	80.6	Confident	89.7	Confident	115 Å²	115	43.2 Å²	43.2	54%	0.537	24%	0.235	S	C	.	.	H	α-helix	trans	-67.1	-33.4	173.5	-54.5	82.7	-172.6	0	0	112.5	A389 S394 Q395	A389-E391 WeakPolarHBondContact CB-OE2 3.42Å; A389-E391 PolarHBondContact O-N 2.98Å; E391-S394 PolarHBondContact O-OG 2.73Å; E391-Q395 PolarHBondContact O-NE2 2.73Å; E391-Q395 VanDerWaalsContact O-NE2 3.13Å
392	D	82.3	Confident	90.1	Very high	6 Å²	6	41.8 Å²	41.8	3%	0.032	23%	0.225	C	C	.	.	H	α-helix	trans	-78	-39.7	177.5	-60.9	-34.6	0	0	0	110.2	R165 F261 L388 A389 D390 S394 Q395	R165-D392 IonicContact NH1-OD2 3.51Å; R165-D392 IonicContact NH2-OD2 2.76Å; F261-D392 HydrophobicContact CD1-CB 3.85Å; F261-D392 HydrophobicContact CD2-CB 4.31Å; F261-D392 HydrophobicContact CE1-CB 3.83Å; F261-D392 HydrophobicContact CE2-CB 4.29Å; F261-D392 HydrophobicContact CG-CB 4.1Å; F261-D392 HydrophobicContact CZ-CB 4.05Å; L388-D392 HydrophobicContact CB-CB 4.19Å; A389-D392 WeakPolarHBondContact O-CB 3.27Å; A389-D392 PolarHBondContact O-N 3.04Å; D390-D392 VanDerWaalsContact C-N 3.32Å; D390-D392 PolarHBondContact O-N 2.69Å; D392-S394 VanDerWaalsContact C-N 3.3Å; D392-S394 PolarHBondContact O-N 2.81Å; D392-Q395 PolarHBondContact O-N 2.91Å
393	K	89.7	Confident	90.4	Very high	36 Å²	36	40.9 Å²	40.9	16%	0.157	22%	0.224	C	C	.	.	H	α-helix	trans	-59.3	-39.4	173.3	-71.4	176.2	-176.1	157.4	0	112.2	Y385 L388 A389 D390 Q395 I396	Y385-K393 HydrophobicContact CD1-CD 4.2Å; Y385-K393 HydrophobicContact CD1-CG 4.21Å; Y385-K393 HydrophobicContact CE1-CB 4.3Å; Y385-K393 HydrophobicContact CE1-CD 3.55Å; Y385-K393 HydrophobicContact CE1-CG 3.7Å; Y385-K393 HydrophobicContact CE2-CB 4.14Å; Y385-K393 HydrophobicContact CE2-CG 4.03Å; Y385-K393 VanDerWaalsContact O-CE 3.22Å; Y385-K393 WeakPolarHBondContact O-CE 3.49Å; L388-K393 HydrophobicContact CB-CG 3.83Å; L388-K393 WeakPolarHBondContact O-CE 3.19Å; L388-K393 PolarHBondContact O-NZ 3.42Å; A389-K393 WeakPolarHBondContact O-CG 3.45Å; A389-K393 PolarHBondContact O-N 3.13Å; D390-K393 PolarHBondContact O-N 2.89Å; D390-K393 IonicContact OD1-NZ 3.67Å; D390-K393 PolarHBondContact OD1-NZ 2.79Å; K393-Q395 PolarHBondContact O-N 3.38Å; K393-Q395 VanDerWaalsContact O-N 3.12Å; K393-I396 PolarHBondContact O-N 2.73Å
394	S	90.2	Very high	90.3	Very high	97 Å²	97	50.6 Å²	50.6	68%	0.678	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-12.2	179.4	66.7	0	0	0	0	114.6	D390 E391 D392	D390-S394 WeakPolarHBondContact O-CB 2.97Å; D390-S394 PolarHBondContact O-N 3.27Å; D390-S394 PolarHBondContact O-OG 3.14Å; E391-S394 PolarHBondContact O-OG 2.73Å; D392-S394 VanDerWaalsContact C-N 3.3Å; D392-S394 PolarHBondContact O-N 2.81Å
395	Q	89.4	Confident	90.5	Very high	115 Å²	115	57.1 Å²	57.1	54%	0.537	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-1.4	173.4	-64.8	169.5	56.8	0	0	113	E391 D392 K393	E391-Q395 PolarHBondContact O-NE2 2.73Å; E391-Q395 VanDerWaalsContact O-NE2 3.13Å; D392-Q395 PolarHBondContact O-N 2.91Å; K393-Q395 PolarHBondContact O-N 3.38Å; K393-Q395 VanDerWaalsContact O-N 3.12Å
396	I	93.7	Very high	90.7	Very high	18 Å²	18	58.5 Å²	58.5	9%	0.092	31%	0.308	C	S	.	.			trans	-110.8	129.3	-177	-62.9	175.1	0	0	0	109.2	F261 D380 Y385 L388 K393 V398	F261-I396 HydrophobicContact CE1-CD1 4.29Å; F261-I396 HydrophobicContact CZ-CD1 4.44Å; D380-I396 HydrophobicContact CB-CD1 3.97Å; D380-I396 HydrophobicContact CB-CG1 4.11Å; D380-I396 HydrophobicContact CB-CG2 3.88Å; Y385-I396 HydrophobicContact CD2-CD1 4.17Å; Y385-I396 HydrophobicContact CD2-CG2 4.22Å; Y385-I396 HydrophobicContact CE2-CB 4.16Å; Y385-I396 HydrophobicContact CE2-CD1 4.42Å; Y385-I396 HydrophobicContact CE2-CG2 4.06Å; L388-I396 HydrophobicContact CD1-CD1 3.34Å; K393-I396 PolarHBondContact O-N 2.73Å; I396-V398 HydrophobicContact CG2-CG2 4.3Å
397	T	97.1	Very high	90.9	Very high	72 Å²	72	61.1 Å²	61.1	44%	0.442	31%	0.313	S	S	.	.			trans	-95.6	119.6	173.2	-46.3	0	0	0	0	109.5	S378 D379 F399	S378-T397 CarbonylContact C-O 3.51Å; S378-T397 WeakPolarHBondContact CA-O 3.38Å; S378-T397 WeakPolarHBondContact CB-O 3.5Å; D379-T397 VanDerWaalsContact CG-N 3.34Å; D379-T397 PolarHBondContact N-O 2.72Å; D379-T397 VanDerWaalsContact N-O 3.09Å; D379-T397 PolarHBondContact OD1-N 2.9Å; D379-T397 WeakPolarHBondContact OD2-CB 3.01Å; D379-T397 PolarHBondContact OD2-N 3.22Å; D379-T397 PolarHBondContact OD2-OG1 2.73Å; T397-F399 HydrophobicContact CG2-CD1 4.49Å; T397-F399 HydrophobicContact CG2-CE1 3.81Å; T397-F399 HydrophobicContact CG2-CE2 4.36Å; T397-F399 HydrophobicContact CG2-CZ 3.72Å
398	V	97.9	Very high	91.6	Very high	45 Å²	45	58.8 Å²	58.8	27%	0.273	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	128.5	176.7	178.9	0	0	0	0	109.7	Y376 Y385 I396 L402	Y376-V398 HydrophobicContact CD2-CG1 4.19Å; Y376-V398 HydrophobicContact CD2-CG2 4.18Å; Y376-V398 HydrophobicContact CE2-CG2 4.32Å; Y385-V398 HydrophobicContact CD2-CG2 4.47Å; Y385-V398 HydrophobicContact CE2-CG2 3.97Å; I396-V398 HydrophobicContact CG2-CG2 4.3Å; V398-L402 HydrophobicContact CG1-CB 4Å; V398-L402 HydrophobicContact CG1-CD1 4.05Å; V398-L402 HydrophobicContact CG1-CG 3.93Å; V398-L402 HydrophobicContact CG2-CD1 4Å
399	F	98.1	Very high	92.4	Very high	48 Å²	48	60.2 Å²	60.2	21%	0.211	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-27.4	-177.5	-59.3	-75.1	0	0	0	113.2	I377 D379 T397 W462 T468 P469 V472	I377-F399 HydrophobicContact CG2-CB 4.29Å; I377-F399 PolarHBondContact O-N 2.99Å; D379-F399 HydrophobicContact CB-CE2 4.12Å; T397-F399 HydrophobicContact CG2-CD1 4.49Å; T397-F399 HydrophobicContact CG2-CE1 3.81Å; T397-F399 HydrophobicContact CG2-CE2 4.36Å; T397-F399 HydrophobicContact CG2-CZ 3.72Å; F399-W462 HydrophobicContact CB-CZ2 4.49Å; F399-T468 HydrophobicContact CD1-CG2 4.41Å; F399-P469 HydrophobicContact CE2-CG 4.42Å; F399-P469 HydrophobicContact CZ-CG 3.79Å; F399-V472 HydrophobicContact CD2-CB 4.23Å; F399-V472 HydrophobicContact CD2-CG1 3.68Å; F399-V472 HydrophobicContact CE2-CB 4.35Å; F399-V472 HydrophobicContact CE2-CG1 3.49Å; F399-V472 VanDerWaalsContact CE2-CG1 3.49Å; F399-V472 HydrophobicContact CZ-CG1 4.22Å
400	A	98.2	Very high	93.2	Very high	3 Å²	3	62.5 Å²	62.5	3%	0.025	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	164.3	174.7	0	0	0	0	0	112.8	Y376 I377 L402 F460 W462	Y376-A400 WeakPolarHBondContact CA-O 3.45Å; Y376-A400 WeakPolarHBondContact CB-O 3.33Å; I377-A400 HydrophobicContact CB-CB 4.34Å; I377-A400 HydrophobicContact CD1-CB 4.35Å; I377-A400 PolarHBondContact N-O 3.04Å; I377-A400 PolarHBondContact O-N 2.83Å; A400-L402 VanDerWaalsContact C-N 3.33Å; A400-L402 PolarHBondContact O-N 3.26Å; A400-F460 HydrophobicContact CB-CD2 4.34Å; A400-F460 HydrophobicContact CB-CE2 3.71Å; A400-W462 HydrophobicContact CB-CB 3.92Å; A400-W462 HydrophobicContact CB-CG 3.78Å
401	G	98.1	Very high	93.7	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.305	C	S	.	.	S	Bend	trans	91.5	-18	173.3	0	0	0	0	0	114.3	P408 Y409 A419	G401-P408 WeakPolarHBondContact O-CA 3.42Å; G401-Y409 PolarHBondContact N-OH 2.83Å; G401-Y409 PolarHBondContact O-N 2.95Å; G401-A419 VanDerWaalsContact O-CB 3.3Å; G401-A419 WeakPolarHBondContact O-CB 3.41Å
402	L	97.6	Very high	94.2	Very high	12 Å²	12	58.5 Å²	58.5	6%	0.063	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-120.5	146.6	175.4	-45.5	-176.5	0	0	0	111.5	Y376 Y385 V398 A400 Q407 P408 Y409 Y477	Y376-L402 HydrophobicContact CD2-CD1 4.09Å; Y376-L402 HydrophobicContact CD2-CG 4.35Å; Y376-L402 HydrophobicContact CG-CD1 4.37Å; Y376-L402 HydrophobicContact CG-CD2 4.42Å; Y376-L402 HydrophobicContact CG-CG 4.31Å; Y385-L402 HydrophobicContact CD1-CD1 4.13Å; Y385-L402 HydrophobicContact CE1-CD1 4.19Å; Y385-L402 HydrophobicContact CG-CD1 4.34Å; V398-L402 HydrophobicContact CG1-CB 4Å; V398-L402 HydrophobicContact CG1-CD1 4.05Å; V398-L402 HydrophobicContact CG1-CG 3.93Å; V398-L402 HydrophobicContact CG2-CD1 4Å; A400-L402 VanDerWaalsContact C-N 3.33Å; A400-L402 PolarHBondContact O-N 3.26Å; L402-Q407 CarbonylContact C-O 3.51Å; L402-Q407 WeakPolarHBondContact CA-O 3.39Å; L402-P408 HydrophobicContact CD2-CB 4.11Å; L402-P408 HydrophobicContact CD2-CG 4.01Å; L402-Y409 WeakPolarHBondContact O-CE1 3.33Å; L402-Y409 PolarHBondContact O-OH 3.22Å; L402-Y477 HydrophobicContact CD1-CD2 3.89Å; L402-Y477 HydrophobicContact CD1-CE2 3.97Å; L402-Y477 HydrophobicContact CD2-CD2 3.53Å; L402-Y477 HydrophobicContact CD2-CE2 3.98Å; L402-Y477 HydrophobicContact CD2-CG 4.22Å; L402-Y477 HydrophobicContact CG-CD2 4.41Å
403	N	95	Very high	94.3	Very high	39 Å²	39	59.8 Å²	59.8	21%	0.209	32%	0.319	C	S	.	.			trans	-82.9	-179.3	176.1	67	26.4	0	0	0	112.2	Q405 S406 Q407 Y409	N403-Q405 PolarHBondContact O-N 3.48Å; N403-Q405 VanDerWaalsContact O-N 3.15Å; N403-Q405 WeakPolarHBondContact OD1-CA 3.47Å; N403-Q405 WeakPolarHBondContact OD1-CB 3.25Å; N403-Q405 PolarHBondContact OD1-N 3Å; N403-Q405 PolarHBondContact OD1-OE1 2.73Å; N403-S406 WeakPolarHBondContact O-CA 3.47Å; N403-S406 PolarHBondContact O-N 2.76Å; N403-S406 PolarHBondContact OD1-N 3.01Å; N403-Q407 VanDerWaalsContact CG-O 3.28Å; N403-Q407 PolarHBondContact N-O 2.91Å; N403-Q407 PolarHBondContact OD1-N 2.75Å; N403-Q407 PolarHBondContact OD1-O 2.8Å; N403-Y409 HydrophobicContact CB-CD1 4.17Å; N403-Y409 HydrophobicContact CB-CE1 4.14Å
404	K	90.8	Very high	93.8	Very high	203 Å²	203	63.9 Å²	63.9	88%	0.883	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-20.6	-177.8	-65.6	-176.5	-179.4	178	0	113.5
405	Q	92.2	Very high	93.5	Very high	138 Å²	138	67.2 Å²	67.2	65%	0.645	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	11.1	175	-65.1	73.1	22.9	0	0	112	N403 Q407	N403-Q405 PolarHBondContact O-N 3.48Å; N403-Q405 VanDerWaalsContact O-N 3.15Å; N403-Q405 WeakPolarHBondContact OD1-CA 3.47Å; N403-Q405 WeakPolarHBondContact OD1-CB 3.25Å; N403-Q405 PolarHBondContact OD1-N 3Å; N403-Q405 PolarHBondContact OD1-OE1 2.73Å; Q405-Q407 HydrophobicContact CB-CG 4.44Å; Q405-Q407 PolarHBondContact O-N 2.8Å
406	S	94.8	Very high	93.5	Very high	39 Å²	39	63.9 Å²	63.9	27%	0.273	35%	0.353	S	S	.	.	S	Bend	trans	56.6	26.4	-175.3	-56.1	0	0	0	0	114.1	Y385 N403 Y477	Y385-S406 PolarHBondContact OH-OG 2.86Å; Y385-S406 VanDerWaalsContact OH-OG 3.13Å; N403-S406 WeakPolarHBondContact O-CA 3.47Å; N403-S406 PolarHBondContact O-N 2.76Å; N403-S406 PolarHBondContact OD1-N 3.01Å; S406-Y477 WeakPolarHBondContact O-CE2 3.45Å; S406-Y477 PolarHBondContact O-OH 2.72Å
407	Q	95.9	Very high	93.7	Very high	94 Å²	94	64.9 Å²	64.9	44%	0.439	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-98	148.4	172.3	-61.1	-54.4	-52.6	0	0	109.9	L402 N403 Q405 Y477	L402-Q407 CarbonylContact C-O 3.51Å; L402-Q407 WeakPolarHBondContact CA-O 3.39Å; N403-Q407 VanDerWaalsContact CG-O 3.28Å; N403-Q407 PolarHBondContact N-O 2.91Å; N403-Q407 PolarHBondContact OD1-N 2.75Å; N403-Q407 PolarHBondContact OD1-O 2.8Å; Q405-Q407 HydrophobicContact CB-CG 4.44Å; Q405-Q407 PolarHBondContact O-N 2.8Å; Q407-Y477 PolarHBondContact OE1-OH 2.85Å
408	P	98.2	Very high	93.7	Very high	11 Å²	11	64.4 Å²	64.4	7%	0.071	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-59.1	145.7	175.1	-20.8	32.2	0	0	0	112.2	P374 G401 L402 D410 A419 Y420 Y477	P374-P408 HydrophobicContact CB-CB 3.52Å; P374-P408 HydrophobicContact CB-CG 3.69Å; P374-P408 HydrophobicContact CG-CB 3.93Å; P374-P408 HydrophobicContact CG-CG 3.73Å; G401-P408 WeakPolarHBondContact O-CA 3.42Å; L402-P408 HydrophobicContact CD2-CB 4.11Å; L402-P408 HydrophobicContact CD2-CG 4.01Å; P408-D410 PolarHBondContact O-N 2.83Å; P408-A419 HydrophobicContact CB-CB 4.1Å; P408-Y420 HydrophobicContact CB-CD1 4.23Å; P408-Y420 HydrophobicContact CB-CE1 4.27Å; P408-Y477 HydrophobicContact CG-CD1 3.44Å; P408-Y477 VanDerWaalsContact CG-CD1 3.44Å; P408-Y477 HydrophobicContact CG-CD2 4.12Å; P408-Y477 HydrophobicContact CG-CE1 3.65Å; P408-Y477 HydrophobicContact CG-CE2 4.29Å; P408-Y477 HydrophobicContact CG-CG 3.7Å
409	Y	97.9	Very high	93.7	Very high	36 Å²	36	62.2 Å²	62.2	14%	0.141	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-57.3	126.2	172	-55.8	-34.2	0	0	0	110.1	G401 L402 N403 E413 E417 K418 A419 Y420 F460	G401-Y409 PolarHBondContact N-OH 2.83Å; G401-Y409 PolarHBondContact O-N 2.95Å; L402-Y409 WeakPolarHBondContact O-CE1 3.33Å; L402-Y409 PolarHBondContact O-OH 3.22Å; N403-Y409 HydrophobicContact CB-CD1 4.17Å; N403-Y409 HydrophobicContact CB-CE1 4.14Å; Y409-E413 WeakPolarHBondContact CA-OE1 3.27Å; Y409-E413 HydrophobicContact CD1-CG 3.67Å; Y409-E413 WeakPolarHBondContact CD1-OE1 3.48Å; Y409-E413 HydrophobicContact CE1-CG 4.27Å; Y409-E413 HydrophobicContact CG-CG 4.14Å; Y409-E417 WeakPolarHBondContact CB-O 3.33Å; Y409-E417 HydrophobicContact CD2-CB 4.11Å; Y409-E417 HydrophobicContact CG-CB 4.44Å; Y409-K418 WeakPolarHBondContact O-CA 3.44Å; Y409-A419 PolarHBondContact O-N 3.49Å; Y409-Y420 VanDerWaalsContact O-CE1 3.25Å; Y409-Y420 WeakPolarHBondContact O-CE1 3.29Å; Y409-F460 HydrophobicContact CD2-CB 3.96Å; Y409-F460 HydrophobicContact CD2-CD2 4.49Å; Y409-F460 HydrophobicContact CD2-CG 4.12Å; Y409-F460 HydrophobicContact CE2-CB 4.34Å; Y409-F460 HydrophobicContact CE2-CD2 4.27Å; Y409-F460 HydrophobicContact CE2-CG 4.34Å
410	D	95.6	Very high	93.7	Very high	70 Å²	70	61.8 Å²	61.8	37%	0.374	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-112.4	-2.1	-172.2	68.1	-0.3	0	0	0	113	P408 T412 E413 Y420	P408-D410 PolarHBondContact O-N 2.83Å; D410-T412 VanDerWaalsContact OD1-CB 3.26Å; D410-T412 WeakPolarHBondContact OD1-CB 3.28Å; D410-T412 VanDerWaalsContact OD1-CG2 3.28Å; D410-T412 WeakPolarHBondContact OD1-CG2 3.29Å; D410-T412 PolarHBondContact OD1-N 3.1Å; D410-T412 PolarHBondContact OD1-OG1 2.99Å; D410-E413 PolarHBondContact N-OE2 2.91Å; D410-E413 VanDerWaalsContact N-OE2 3.14Å; D410-Y420 HydrophobicContact CB-CE1 4.3Å; D410-Y420 WeakPolarHBondContact CB-OH 3.34Å
411	G	94.1	Very high	93.7	Very high	31 Å²	31	61.7 Å²	61.7	32%	0.32	33%	0.333	S	S	.	.	S	Bend	trans	101.2	-1.1	-177.5	0	0	0	0	0	113.3	E413 E417	G411-E413 PolarHBondContact N-OE2 2.77Å; G411-E413 VanDerWaalsContact N-OE2 3.08Å; G411-E417 WeakPolarHBondContact CA-O 2.95Å; G411-E417 PolarHBondContact N-O 2.73Å
412	T	91.8	Very high	93.7	Very high	115 Å²	115	62.8 Å²	62.8	71%	0.706	34%	0.337	S	S	*	.			trans	-88.4	-7.7	176	65.6	0	0	0	0	113.2	D410	D410-T412 VanDerWaalsContact OD1-CB 3.26Å; D410-T412 WeakPolarHBondContact OD1-CB 3.28Å; D410-T412 VanDerWaalsContact OD1-CG2 3.28Å; D410-T412 WeakPolarHBondContact OD1-CG2 3.29Å; D410-T412 PolarHBondContact OD1-N 3.1Å; D410-T412 PolarHBondContact OD1-OG1 2.99Å
413	E	84.8	Confident	93.6	Very high	33 Å²	33	62.6 Å²	62.6	15%	0.154	34%	0.336	C	S	.	.	S	Bend	trans	-60.1	155.7	172.7	-70.2	69.1	-158.1	0	0	111.8	Y409 D410 G411 H415 G416 E417	Y409-E413 WeakPolarHBondContact CA-OE1 3.27Å; Y409-E413 HydrophobicContact CD1-CG 3.67Å; Y409-E413 WeakPolarHBondContact CD1-OE1 3.48Å; Y409-E413 HydrophobicContact CE1-CG 4.27Å; Y409-E413 HydrophobicContact CG-CG 4.14Å; D410-E413 PolarHBondContact N-OE2 2.91Å; D410-E413 VanDerWaalsContact N-OE2 3.14Å; G411-E413 PolarHBondContact N-OE2 2.77Å; G411-E413 VanDerWaalsContact N-OE2 3.08Å; E413-H415 PolarHBondContact O-N 2.94Å; E413-G416 PolarHBondContact O-N 3.13Å; E413-E417 HydrophobicContact CB-CB 4.29Å; E413-E417 VanDerWaalsContact OE2-O 3.09Å
414	S	79.3	Confident	93.8	Very high	123 Å²	123	60.7 Å²	60.7	86%	0.86	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-21.1	-171.9	-56.9	0	0	0	0	115.4
415	H	82.3	Confident	94	Very high	166 Å²	166	52.6 Å²	52.6	77%	0.769	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	11.6	178.4	-61.5	-65.3	0	0	0	113.6	E413 E417	E413-H415 PolarHBondContact O-N 2.94Å; H415-E417 HydrophobicContact CB-CG 4.08Å; H415-E417 PolarHBondContact O-N 3.32Å
416	G	90.8	Very high	94.2	Very high	46 Å²	46	46.5 Å²	46.5	47%	0.474	26%	0.261	S	S	.	.			trans	67	26.3	-177.6	0	0	0	0	0	113.4	E413	E413-G416 PolarHBondContact O-N 3.13Å
417	E	96.3	Very high	94	Very high	39 Å²	39	46.7 Å²	46.7	18%	0.182	26%	0.258	C	S	.	.			trans	-67.4	140.4	-176.7	-68.3	-174.4	111.2	0	0	111.3	Y409 G411 E413 H415 V459 F460 Q461	Y409-E417 WeakPolarHBondContact CB-O 3.33Å; Y409-E417 HydrophobicContact CD2-CB 4.11Å; Y409-E417 HydrophobicContact CG-CB 4.44Å; G411-E417 WeakPolarHBondContact CA-O 2.95Å; G411-E417 PolarHBondContact N-O 2.73Å; E413-E417 HydrophobicContact CB-CB 4.29Å; E413-E417 VanDerWaalsContact OE2-O 3.09Å; H415-E417 HydrophobicContact CB-CG 4.08Å; H415-E417 PolarHBondContact O-N 3.32Å; E417-V459 CarbonylContact C-O 3.57Å; E417-V459 VanDerWaalsContact CA-O 3.31Å; E417-V459 WeakPolarHBondContact CA-O 3.3Å; E417-F460 HydrophobicContact CB-CB 3.77Å; E417-F460 HydrophobicContact CG-CB 4.02Å; E417-Q461 PolarHBondContact OE1-N 2.79Å
418	K	98.2	Very high	93.7	Very high	61 Å²	61	43.6 Å²	43.6	27%	0.265	25%	0.247	S	C	.	.	B	Isolated β-bridge	trans	-140.2	126.6	-179.1	-160.8	180	177.8	-178.7	0	111.4	Y409 Y420 G458 V459	Y409-K418 WeakPolarHBondContact O-CA 3.44Å; K418-Y420 VanDerWaalsContact C-N 3.32Å; K418-Y420 WeakPolarHBondContact CD-O 3.5Å; K418-Y420 VanDerWaalsContact CE-O 3.27Å; K418-Y420 WeakPolarHBondContact CE-O 3.42Å; K418-Y420 HydrophobicContact CG-CD1 4.44Å; K418-Y420 HydrophobicContact CG-CE1 4.39Å; K418-Y420 VanDerWaalsContact CG-O 3.23Å; K418-Y420 WeakPolarHBondContact CG-O 3.2Å; K418-Y420 PolarHBondContact O-N 3.49Å; K418-G458 CarbonylContact O-C 3.5Å; K418-G458 VanDerWaalsContact O-C 3.23Å; K418-G458 WeakPolarHBondContact O-CA 2.88Å; K418-V459 PolarHBondContact N-O 2.92Å; K418-V459 CarbonylContact O-C 3.47Å; K418-V459 PolarHBondContact O-N 3.33Å
419	A	98.4	Very high	93.2	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.273	C	S	.	.	S	Bend	trans	-85.3	-3.6	-175.8	0	0	0	0	0	113.6	V360 P374 L375 G401 P408 Y409 F460	V360-A419 WeakPolarHBondContact CG1-O 3.18Å; P374-A419 CarbonylContact C-O 3.23Å; P374-A419 VanDerWaalsContact CA-O 3.28Å; P374-A419 WeakPolarHBondContact CA-O 3.35Å; P374-A419 HydrophobicContact CB-CB 4.2Å; L375-A419 PolarHBondContact N-O 3.44Å; G401-A419 VanDerWaalsContact O-CB 3.3Å; G401-A419 WeakPolarHBondContact O-CB 3.41Å; P408-A419 HydrophobicContact CB-CB 4.1Å; Y409-A419 PolarHBondContact O-N 3.49Å; A419-F460 HydrophobicContact CB-CD1 4.49Å; A419-F460 HydrophobicContact CB-CE1 4.46Å
420	Y	98.5	Very high	92.6	Very high	39 Å²	39	50.6 Å²	50.6	15%	0.153	28%	0.28	C	S	.	.			trans	-146.8	161.3	-179	56.9	-84.3	0	0	0	110.9	D364 F372 P374 P408 Y409 D410 K418 G458	D364-Y420 HydrophobicContact CB-CD2 3.74Å; D364-Y420 HydrophobicContact CB-CE2 4.22Å; F372-Y420 HydrophobicContact CD2-CD2 4.41Å; F372-Y420 HydrophobicContact CE2-CD1 4.06Å; F372-Y420 AromaticContact CE2-CD2 3.8Å; F372-Y420 HydrophobicContact CE2-CD2 3.8Å; F372-Y420 HydrophobicContact CE2-CE1 4.24Å; F372-Y420 AromaticContact CE2-CE2 3.98Å; F372-Y420 HydrophobicContact CE2-CE2 3.98Å; F372-Y420 AromaticContact CE2-CG 3.84Å; F372-Y420 HydrophobicContact CE2-CG 3.84Å; P374-Y420 HydrophobicContact CB-CD1 4.04Å; P374-Y420 HydrophobicContact CG-CD1 3.94Å; P374-Y420 HydrophobicContact CG-CG 4.25Å; P408-Y420 HydrophobicContact CB-CD1 4.23Å; P408-Y420 HydrophobicContact CB-CE1 4.27Å; Y409-Y420 VanDerWaalsContact O-CE1 3.25Å; Y409-Y420 WeakPolarHBondContact O-CE1 3.29Å; D410-Y420 HydrophobicContact CB-CE1 4.3Å; D410-Y420 WeakPolarHBondContact CB-OH 3.34Å; K418-Y420 VanDerWaalsContact C-N 3.32Å; K418-Y420 WeakPolarHBondContact CD-O 3.5Å; K418-Y420 VanDerWaalsContact CE-O 3.27Å; K418-Y420 WeakPolarHBondContact CE-O 3.42Å; K418-Y420 HydrophobicContact CG-CD1 4.44Å; K418-Y420 HydrophobicContact CG-CE1 4.39Å; K418-Y420 VanDerWaalsContact CG-O 3.23Å; K418-Y420 WeakPolarHBondContact CG-O 3.2Å; K418-Y420 PolarHBondContact O-N 3.49Å; Y420-G458 WeakPolarHBondContact O-CA 3.02Å; Y420-G458 PolarHBondContact O-N 2.9Å
421	G	97.9	Very high	91.9	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.01	30%	0.298	C	S	.	.			trans	-165.7	-156.5	-177.8	0	0	0	0	0	112.1	G363 D364	G363-G421 CarbonylContact C-O 3.58Å; G363-G421 WeakPolarHBondContact CA-O 3.28Å; G363-G421 PolarHBondContact N-O 3.04Å; D364-G421 PolarHBondContact N-O 3.31Å
422	R	96.6	Very high	91.3	Very high	23 Å²	23	56.2 Å²	56.2	9%	0.087	32%	0.317	C	S	.	.	S	Bend	trans	-50.1	150.2	179	68.6	165.5	175.7	-169.3	14.6	111.9	E361 G363 L453 G455 N456	E361-R422 CarbonylContact C-O 3.19Å; E361-R422 WeakPolarHBondContact CA-O 3.25Å; E361-R422 HydrophobicContact CB-CG 4.45Å; E361-R422 WeakPolarHBondContact CB-O 3.37Å; E361-R422 HydrophobicContact CG-CG 4.11Å; E361-R422 IonicContact OE1-CZ 2.83Å; E361-R422 IonicContact OE1-NE 3.56Å; E361-R422 PolarHBondContact OE1-NE 2.71Å; E361-R422 IonicContact OE1-NH2 3.63Å; E361-R422 PolarHBondContact OE1-NH2 2.86Å; G363-R422 PolarHBondContact N-O 3.39Å; R422-L453 VanDerWaalsContact CD-O 3.31Å; R422-L453 WeakPolarHBondContact CD-O 3.19Å; R422-G455 WeakPolarHBondContact CD-O 3.32Å; R422-G455 PolarHBondContact NH1-O 2.8Å; R422-N456 PolarHBondContact N-O 3.34Å
423	L	96.6	Very high	90.9	Very high	7 Å²	7	54.3 Å²	54.3	4%	0.037	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-82	121.5	175.4	-178	65.3	0	0	0	110.4	L316 F371 R425 C452 L453 Y517	L316-L423 HydrophobicContact CD1-CD1 3.75Å; L316-L423 HydrophobicContact CG-CD1 4.41Å; F371-L423 HydrophobicContact CB-CD2 4.26Å; F371-L423 HydrophobicContact CD1-CD1 4.36Å; F371-L423 HydrophobicContact CD1-CD2 3.99Å; F371-L423 HydrophobicContact CD2-CD2 4.33Å; F371-L423 HydrophobicContact CE1-CD2 4.46Å; F371-L423 HydrophobicContact CG-CD2 3.95Å; L423-R425 HydrophobicContact CD1-CG 4.02Å; L423-R425 HydrophobicContact CG-CG 4.26Å; L423-C452 CarbonylContact O-C 3.6Å; L423-C452 WeakPolarHBondContact O-CA 3.3Å; L423-L453 HydrophobicContact CB-CD1 3.75Å; L423-L453 HydrophobicContact CB-CG 4.04Å; L423-L453 HydrophobicContact CD2-CD1 4.27Å; L423-L453 PolarHBondContact O-N 2.8Å; L423-Y517 HydrophobicContact CD2-CD1 4.28Å; L423-Y517 HydrophobicContact CD2-CE1 4.31Å
424	C	98.2	Very high	91	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	131.1	167.1	-71.5	0	0	0	0	110.1	Q315 L316 E361 L450 R451 C452	Q315-C424 HydrophobicContact CB-CB 4.45Å; Q315-C424 HydrophobicContact CG-CB 3.94Å; L316-C424 PolarHBondContact N-O 3.13Å; E361-C424 HydrophobicContact CB-CB 3.69Å; E361-C424 PolarHBondContact O-N 3.08Å; E361-C424 PolarHBondContact OE2-SG 3.12Å; C424-L450 HydrophobicContact CB-CD1 4.06Å; C424-R451 CarbonylContact C-O 3.58Å; C424-R451 WeakPolarHBondContact CA-O 3.34Å; C424-C452 HydrophobicContact CB-CB 4.15Å; C424-C452 WeakPolarHBondContact CB-SG 3.41Å; C424-C452 WeakPolarHBondContact SG-CB 3.21Å; C424-C452 CovalentContact SG-SG 2.04Å; C424-C452 PolarHBondContact SG-SG 2.84Å
425	R	95.7	Very high	91.4	Very high	33 Å²	33	51 Å²	51	13%	0.125	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	130.6	-174.5	-81.7	173.5	62.4	-176.1	-1.3	112.6	L316 L423 I427 L450 R451	L316-R425 HydrophobicContact CB-CG 3.65Å; L316-R425 HydrophobicContact CD1-CG 4.41Å; L316-R425 CarbonylContact O-C 3.59Å; L316-R425 VanDerWaalsContact O-CA 3.25Å; L316-R425 WeakPolarHBondContact O-CA 3.26Å; L423-R425 HydrophobicContact CD1-CG 4.02Å; L423-R425 HydrophobicContact CG-CG 4.26Å; R425-I427 HydrophobicContact CB-CG1 4.31Å; R425-L450 VanDerWaalsContact C-CD1 3.49Å; R425-L450 WeakPolarHBondContact O-CA 3.08Å; R425-R451 PolarHBondContact N-O 2.88Å; R425-R451 PolarHBondContact O-N 3.41Å
426	F	95.6	Very high	91.6	Very high	10 Å²	10	45.8 Å²	45.8	4%	0.044	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	130.2	159.5	-71.8	-84.5	0	0	0	109.3	Q315 L316 P318 Y339 L448 V449 L450 Y504	Q315-F426 HydrophobicContact CB-CE2 4.29Å; L316-F426 PolarHBondContact O-N 2.68Å; P318-F426 WeakPolarHBondContact CD-O 3.36Å; Y339-F426 AromaticContact CD1-CD2 3.49Å; Y339-F426 HydrophobicContact CD1-CD2 3.49Å; Y339-F426 VanDerWaalsContact CD1-CD2 3.49Å; Y339-F426 AromaticContact CD1-CE2 3.79Å; Y339-F426 HydrophobicContact CD1-CE2 3.79Å; Y339-F426 HydrophobicContact CD1-CG 4.02Å; Y339-F426 HydrophobicContact CE1-CB 4.37Å; Y339-F426 HydrophobicContact CE1-CD2 4.12Å; Y339-F426 HydrophobicContact CE1-CG 4.19Å; Y339-F426 AromaticContact CG-CD2 3.73Å; Y339-F426 HydrophobicContact CG-CD2 3.73Å; Y339-F426 HydrophobicContact CG-CE2 4.09Å; F426-L448 HydrophobicContact CB-CB 4.3Å; F426-L448 HydrophobicContact CB-CD1 4.09Å; F426-L448 HydrophobicContact CD1-CB 3.98Å; F426-L448 HydrophobicContact CD1-CD1 4.43Å; F426-L448 HydrophobicContact CG-CD1 4.49Å; F426-V449 CarbonylContact C-O 3.47Å; F426-V449 WeakPolarHBondContact CA-O 3.31Å; F426-L450 HydrophobicContact CD1-CB 4.08Å; F426-L450 HydrophobicContact CD1-CD1 4.48Å; F426-L450 HydrophobicContact CD2-CD1 3.98Å; F426-L450 HydrophobicContact CE1-CB 3.86Å; F426-L450 HydrophobicContact CE1-CD1 4.47Å; F426-L450 HydrophobicContact CE2-CD1 3.94Å; F426-L450 HydrophobicContact CG-CD1 4.25Å; F426-L450 HydrophobicContact CZ-CB 4.21Å; F426-L450 HydrophobicContact CZ-CD1 4.19Å; F426-L450 HydrophobicContact CZ-CD2 4.15Å; F426-L450 HydrophobicContact CZ-CG 4.44Å; F426-Y504 HydrophobicContact CE1-CD2 4.47Å; F426-Y504 AromaticContact CZ-CD2 3.95Å; F426-Y504 HydrophobicContact CZ-CD2 3.95Å; F426-Y504 AromaticContact CZ-CE2 3.94Å; F426-Y504 HydrophobicContact CZ-CE2 3.94Å
427	I	92.3	Very high	91.4	Very high	42 Å²	42	46.8 Å²	46.8	22%	0.215	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	139.9	-177	-50.9	165.1	0	0	0	108	R425 K429 L448 V449 R451 Y517	R425-I427 HydrophobicContact CB-CG1 4.31Å; I427-K429 PolarHBondContact O-N 3.25Å; I427-L448 CarbonylContact O-C 3.59Å; I427-L448 VanDerWaalsContact O-CA 3.29Å; I427-L448 WeakPolarHBondContact O-CA 3.5Å; I427-V449 HydrophobicContact CB-CG1 4.38Å; I427-V449 PolarHBondContact N-O 3.39Å; I427-V449 PolarHBondContact O-N 2.95Å; I427-R451 HydrophobicContact CD1-CB 3.89Å; I427-R451 HydrophobicContact CD1-CG 3.79Å; I427-Y517 HydrophobicContact CD1-CE2 4.4Å; I427-Y517 WeakPolarHBondContact CD1-OH 3.21Å
428	S	89.4	Confident	91.1	Very high	29 Å²	29	45.4 Å²	45.4	20%	0.203	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	129.4	171.7	-171.9	0	0	0	0	110.6	D430	S428-D430 PolarHBondContact O-N 2.9Å; S428-D430 PolarHBondContact OG-N 3.06Å; S428-D430 PolarHBondContact OG-O 3.2Å
429	K	87.8	Confident	90.6	Very high	141 Å²	141	47 Å²	47	61%	0.613	26%	0.263	S	S	*	.	S	Bend	trans	-66.5	-26.5	170.1	-65.9	173.8	-177.2	169.6	0	111.7	I427 H447 L448 V449	I427-K429 PolarHBondContact O-N 3.25Å; K429-H447 WeakPolarHBondContact CB-O 3.28Å; K429-H447 WeakPolarHBondContact CG-O 3.5Å; K429-H447 PolarHBondContact N-O 3.38Å; K429-L448 WeakPolarHBondContact CE-O 3.42Å; K429-V449 HydrophobicContact CG-CB 4.2Å; K429-V449 HydrophobicContact CG-CG1 4.11Å
430	D	85.5	Confident	90.2	Very high	54 Å²	54	48.2 Å²	48.2	29%	0.289	27%	0.271	S	S	.	.			trans	-138.5	94.3	-179.6	-178.8	2.1	0	0	0	109.9	S428 S432 Q433	S428-D430 PolarHBondContact O-N 2.9Å; S428-D430 PolarHBondContact OG-N 3.06Å; S428-D430 PolarHBondContact OG-O 3.2Å; D430-S432 VanDerWaalsContact CG-OG 3.32Å; D430-S432 PolarHBondContact O-N 3.16Å; D430-S432 VanDerWaalsContact OD1-CB 3.3Å; D430-S432 WeakPolarHBondContact OD1-CB 3.45Å; D430-S432 PolarHBondContact OD1-N 2.62Å; D430-S432 PolarHBondContact OD1-OG 3.37Å; D430-S432 PolarHBondContact OD2-OG 3.28Å; D430-Q433 PolarHBondContact O-N 2.99Å; D430-Q433 WeakPolarHBondContact OD2-CG 3.24Å; D430-Q433 PolarHBondContact OD2-NE2 2.76Å
431	P	79.1	Confident	89.8	Confident	117 Å²	117	46.7 Å²	46.7	76%	0.76	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-14	178.4	-23.6	34.8	0	0	0	114.5	Q433	P431-Q433 VanDerWaalsContact C-N 3.3Å
432	S	83.3	Confident	89.5	Confident	102 Å²	102	50.1 Å²	50.1	71%	0.713	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-22.3	178.2	77.1	0	0	0	0	112.7	D430 S434	D430-S432 VanDerWaalsContact CG-OG 3.32Å; D430-S432 PolarHBondContact O-N 3.16Å; D430-S432 VanDerWaalsContact OD1-CB 3.3Å; D430-S432 WeakPolarHBondContact OD1-CB 3.45Å; D430-S432 PolarHBondContact OD1-N 2.62Å; D430-S432 PolarHBondContact OD1-OG 3.37Å; D430-S432 PolarHBondContact OD2-OG 3.28Å; S432-S434 PolarHBondContact O-N 2.89Å
433	Q	82.7	Confident	89.2	Confident	74 Å²	74	52.6 Å²	52.6	35%	0.346	29%	0.294	S	S	.	.	S	Bend	trans	-83.8	110.1	176.6	-74.2	-175.2	76.5	0	0	111	D430 P431 M438	D430-Q433 PolarHBondContact O-N 2.99Å; D430-Q433 WeakPolarHBondContact OD2-CG 3.24Å; D430-Q433 PolarHBondContact OD2-NE2 2.76Å; P431-Q433 VanDerWaalsContact C-N 3.3Å; Q433-M438 HydrophobicContact CB-CE 4.25Å
434	S	86	Confident	89	Confident	59 Å²	59	52.4 Å²	52.4	41%	0.413	29%	0.293	S	S	.	.			trans	-67.7	132.8	176.2	176.3	0	0	0	0	111.2	S432 D436 S437	S432-S434 PolarHBondContact O-N 2.89Å; S434-D436 PolarHBondContact O-N 3.31Å; S434-D436 PolarHBondContact OG-N 2.69Å; S434-S437 WeakPolarHBondContact O-CB 3.42Å; S434-S437 PolarHBondContact O-N 3.19Å; S434-S437 VanDerWaalsContact O-N 3.1Å; S434-S437 PolarHBondContact O-OG 2.71Å
435	P	88.8	Confident	88.7	Confident	29 Å²	29	53.6 Å²	53.6	19%	0.188	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-57.1	-32	171.9	-19.4	28.9	0	0	0	112.3	W298 S437 M438 F444	W298-P435 HydrophobicContact CH2-CB 4.05Å; W298-P435 HydrophobicContact CZ2-CB 4.48Å; W298-P435 VanDerWaalsContact CZ2-O 3.32Å; W298-P435 WeakPolarHBondContact CZ2-O 3.38Å; P435-S437 PolarHBondContact O-N 3.37Å; P435-S437 VanDerWaalsContact O-N 3.12Å; P435-M438 WeakPolarHBondContact O-CB 3.22Å; P435-M438 PolarHBondContact O-N 3.04Å; P435-F444 HydrophobicContact CB-CD2 4.01Å; P435-F444 HydrophobicContact CB-CE2 3.86Å; P435-F444 HydrophobicContact CB-CZ 4.21Å; P435-F444 HydrophobicContact CG-CD2 4.26Å; P435-F444 HydrophobicContact CG-CE2 3.61Å; P435-F444 HydrophobicContact CG-CZ 3.84Å
436	D	85.4	Confident	88.5	Confident	55 Å²	55	59.6 Å²	59.6	29%	0.294	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-67.1	-13.2	-179.4	-75.4	-44.2	0	0	0	113.9	R295 G321 A322 R323 S434 M438	R295-D436 PolarHBondContact NH1-O 3.02Å; G321-D436 VanDerWaalsContact C-OD1 3.26Å; G321-D436 WeakPolarHBondContact CA-OD1 3.22Å; G321-D436 WeakPolarHBondContact CA-OD2 3.37Å; A322-D436 VanDerWaalsContact N-CG 3.31Å; A322-D436 PolarHBondContact N-OD1 2.98Å; A322-D436 PolarHBondContact N-OD2 2.75Å; R323-D436 PolarHBondContact N-OD1 3.47Å; S434-D436 PolarHBondContact O-N 3.31Å; S434-D436 PolarHBondContact OG-N 2.69Å; D436-M438 VanDerWaalsContact C-N 3.32Å
437	S	86.9	Confident	88.3	Confident	68 Å²	68	61.8 Å²	61.8	48%	0.476	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-74	-23.8	170.9	71.1	0	0	0	0	112.5	R295 S434 P435	R295-S437 VanDerWaalsContact NH1-C 3.28Å; R295-S437 PolarHBondContact NH1-O 3.22Å; R295-S437 PolarHBondContact NH2-O 3.38Å; R295-S437 VanDerWaalsContact NH2-O 3.17Å; S434-S437 WeakPolarHBondContact O-CB 3.42Å; S434-S437 PolarHBondContact O-N 3.19Å; S434-S437 VanDerWaalsContact O-N 3.1Å; S434-S437 PolarHBondContact O-OG 2.71Å; P435-S437 PolarHBondContact O-N 3.37Å; P435-S437 VanDerWaalsContact O-N 3.12Å
438	M	89.8	Confident	88.4	Confident	10 Å²	10	60.3 Å²	60.3	5%	0.049	33%	0.328	C	S	.	.			trans	-91	150.7	-170.9	-53.3	-179.3	-172.8	0	0	113	W298 R323 Q433 P435 D436 Q443 F444 H447	W298-M438 HydrophobicContact CZ2-CB 4.15Å; W298-M438 PolarHBondContact NE1-O 3.4Å; R323-M438 PolarHBondContact NH1-O 3.46Å; Q433-M438 HydrophobicContact CB-CE 4.25Å; P435-M438 WeakPolarHBondContact O-CB 3.22Å; P435-M438 PolarHBondContact O-N 3.04Å; D436-M438 VanDerWaalsContact C-N 3.32Å; M438-Q443 HydrophobicContact CB-CB 4.24Å; M438-F444 HydrophobicContact CE-CD2 4.25Å; M438-F444 WeakPolarHBondContact SD-CA 3.49Å; M438-F444 HydrophobicContact SD-CB 3.78Å; M438-F444 HydrophobicContact SD-CD2 3.78Å; M438-F444 HydrophobicContact SD-CG 4.28Å; M438-H447 HydrophobicContact CE-CB 4.44Å
439	D	88.2	Confident	88.6	Confident	95 Å²	95	59.9 Å²	59.9	51%	0.508	32%	0.323	S	S	.	.	S	Bend	trans	-84.4	-22.9	-174.8	-74.6	-48.4	0	0	0	114.3	R295 W298 R323	R295-D439 IonicContact CZ-OD1 3.61Å; R295-D439 IonicContact NH2-OD1 3.25Å; R295-D439 PolarHBondContact NH2-OD1 3.06Å; W298-D439 VanDerWaalsContact CD1-O 3.29Å; R323-D439 IonicContact NH1-OD1 2.68Å
440	S	90	Very high	89	Confident	25 Å²	25	53.4 Å²	53.4	18%	0.175	30%	0.295	C	S	.	.	S	Bend	trans	-153.3	160.9	-174.4	60.2	0	0	0	0	112.4	Q442 Q443 F444	S440-Q442 PolarHBondContact O-N 3.47Å; S440-Q443 PolarHBondContact O-N 3.49Å; S440-Q443 PolarHBondContact OG-N 3.33Å; S440-F444 PolarHBondContact O-N 3.15Å
441	F	90.5	Very high	89.5	Confident	6 Å²	6	54.3 Å²	54.3	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-59.2	-35.5	172	173.1	-106.7	0	0	0	112.1	W298 Y339 G342 Y343 M344 Q443 F444 K445	W298-F441 HydrophobicContact CE3-CB 3.9Å; W298-F441 HydrophobicContact CZ3-CB 4.24Å; W298-F441 HydrophobicContact CZ3-CD2 4.32Å; Y339-F441 HydrophobicContact CD1-CE2 4.45Å; Y339-F441 HydrophobicContact CD1-CZ 4.19Å; Y339-F441 AromaticContact CE1-CE2 3.59Å; Y339-F441 HydrophobicContact CE1-CE2 3.59Å; Y339-F441 AromaticContact CE1-CZ 3.72Å; Y339-F441 HydrophobicContact CE1-CZ 3.72Å; G342-F441 WeakPolarHBondContact O-CZ 3.3Å; Y343-F441 HydrophobicContact CD1-CD1 4.05Å; Y343-F441 AromaticContact CD1-CE1 3.69Å; Y343-F441 HydrophobicContact CD1-CE1 3.69Å; Y343-F441 HydrophobicContact CG-CE1 4.31Å; M344-F441 HydrophobicContact CB-CD2 3.62Å; M344-F441 HydrophobicContact CB-CE2 3.33Å; M344-F441 HydrophobicContact CB-CG 4.39Å; M344-F441 HydrophobicContact CB-CZ 3.89Å; M344-F441 HydrophobicContact CG-CE2 4.49Å; M344-F441 VanDerWaalsContact N-CZ 3.28Å; M344-F441 HydrophobicContact SD-CD2 4.36Å; F441-Q443 VanDerWaalsContact C-N 3.31Å; F441-Q443 PolarHBondContact O-N 3.31Å; F441-F444 HydrophobicContact CD2-CD1 4.25Å; F441-F444 HydrophobicContact CE2-CD1 4.36Å; F441-F444 CarbonylContact O-C 3.57Å; F441-F444 WeakPolarHBondContact O-CA 3.27Å; F441-F444 WeakPolarHBondContact O-CB 3.48Å; F441-F444 PolarHBondContact O-N 3.23Å; F441-K445 HydrophobicContact CE1-CB 4.11Å; F441-K445 HydrophobicContact CE1-CD 3.89Å; F441-K445 HydrophobicContact CE1-CG 4.35Å; F441-K445 HydrophobicContact CE2-CB 4.33Å; F441-K445 HydrophobicContact CZ-CB 3.93Å; F441-K445 HydrophobicContact CZ-CD 4.09Å; F441-K445 HydrophobicContact CZ-CG 4.12Å; F441-K445 WeakPolarHBondContact O-CB 3.35Å; F441-K445 PolarHBondContact O-N 3.21Å
442	Q	90.5	Very high	90.3	Very high	74 Å²	74	48.8 Å²	48.8	35%	0.346	26%	0.259	S	S	.	.	H	α-helix	trans	-62	-37.9	178.9	-67.4	84.5	-18.1	0	0	112	S440 K446	S440-Q442 PolarHBondContact O-N 3.47Å; Q442-K446 WeakPolarHBondContact O-CG 3.32Å
443	Q	91.1	Very high	90.8	Very high	74 Å²	74	44.8 Å²	44.8	35%	0.346	23%	0.229	S	C	.	.	H	α-helix	trans	-67.5	-40.4	172.6	-72.1	178.8	2.1	0	0	111.4	M438 S440 F441 K446 H447	M438-Q443 HydrophobicContact CB-CB 4.24Å; S440-Q443 PolarHBondContact O-N 3.49Å; S440-Q443 PolarHBondContact OG-N 3.33Å; F441-Q443 VanDerWaalsContact C-N 3.31Å; F441-Q443 PolarHBondContact O-N 3.31Å; Q443-K446 PolarHBondContact O-N 3.22Å; Q443-H447 PolarHBondContact O-ND1 2.96Å
444	F	92.7	Very high	91.3	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.018	24%	0.238	C	C	.	.	H	α-helix	trans	-65.2	-44.7	177.8	-176.5	-126.4	0	0	0	112.8	W298 P318 P435 M438 S440 F441 K446 H447 L448	W298-F444 HydrophobicContact CH2-CB 3.54Å; W298-F444 AromaticContact CH2-CD1 3.9Å; W298-F444 HydrophobicContact CH2-CD1 3.9Å; W298-F444 HydrophobicContact CH2-CD2 4.5Å; W298-F444 AromaticContact CH2-CG 3.74Å; W298-F444 HydrophobicContact CH2-CG 3.74Å; W298-F444 HydrophobicContact CZ2-CB 4.32Å; W298-F444 HydrophobicContact CZ3-CB 4.05Å; W298-F444 AromaticContact CZ3-CD1 3.97Å; W298-F444 HydrophobicContact CZ3-CD1 3.97Å; W298-F444 HydrophobicContact CZ3-CG 4.23Å; P318-F444 HydrophobicContact CB-CZ 4.3Å; P318-F444 HydrophobicContact CG-CE1 3.91Å; P318-F444 HydrophobicContact CG-CZ 3.7Å; P435-F444 HydrophobicContact CB-CD2 4.01Å; P435-F444 HydrophobicContact CB-CE2 3.86Å; P435-F444 HydrophobicContact CB-CZ 4.21Å; P435-F444 HydrophobicContact CG-CD2 4.26Å; P435-F444 HydrophobicContact CG-CE2 3.61Å; P435-F444 HydrophobicContact CG-CZ 3.84Å; M438-F444 HydrophobicContact CE-CD2 4.25Å; M438-F444 WeakPolarHBondContact SD-CA 3.49Å; M438-F444 HydrophobicContact SD-CB 3.78Å; M438-F444 HydrophobicContact SD-CD2 3.78Å; M438-F444 HydrophobicContact SD-CG 4.28Å; S440-F444 PolarHBondContact O-N 3.15Å; F441-F444 HydrophobicContact CD2-CD1 4.25Å; F441-F444 HydrophobicContact CE2-CD1 4.36Å; F441-F444 CarbonylContact O-C 3.57Å; F441-F444 WeakPolarHBondContact O-CA 3.27Å; F441-F444 WeakPolarHBondContact O-CB 3.48Å; F441-F444 PolarHBondContact O-N 3.23Å; F444-K446 PolarHBondContact O-N 2.92Å; F444-H447 WeakPolarHBondContact O-CB 3.34Å; F444-H447 PolarHBondContact O-N 3.23Å; F444-L448 HydrophobicContact CD1-CD1 4.07Å; F444-L448 HydrophobicContact CE1-CD1 3.9Å; F444-L448 HydrophobicContact CE1-CD2 4.19Å; F444-L448 HydrophobicContact CE1-CG 4.41Å; F444-L448 HydrophobicContact CE2-CD2 4.16Å; F444-L448 HydrophobicContact CZ-CD1 4.4Å; F444-L448 HydrophobicContact CZ-CD2 3.84Å; F444-L448 HydrophobicContact CZ-CG 4.46Å
445	K	92.3	Very high	91.6	Very high	24 Å²	24	45.8 Å²	45.8	10%	0.104	24%	0.239	C	C	.	.	H	α-helix	trans	-55.6	-34.5	178.2	-171	-177.2	177.2	-169.8	0	112.8	G342 F441 H447 L448 E502	G342-K445 VanDerWaalsContact O-CE 3.28Å; G342-K445 WeakPolarHBondContact O-CE 3.5Å; F441-K445 HydrophobicContact CE1-CB 4.11Å; F441-K445 HydrophobicContact CE1-CD 3.89Å; F441-K445 HydrophobicContact CE1-CG 4.35Å; F441-K445 HydrophobicContact CE2-CB 4.33Å; F441-K445 HydrophobicContact CZ-CB 3.93Å; F441-K445 HydrophobicContact CZ-CD 4.09Å; F441-K445 HydrophobicContact CZ-CG 4.12Å; F441-K445 WeakPolarHBondContact O-CB 3.35Å; F441-K445 PolarHBondContact O-N 3.21Å; K445-H447 PolarHBondContact O-N 2.76Å; K445-L448 WeakPolarHBondContact O-CB 3.37Å; K445-L448 PolarHBondContact O-N 3.22Å; K445-E502 IonicContact NZ-OE2 2.61Å; K445-E502 PolarHBondContact NZ-OE2 3.17Å
446	K	91.1	Very high	91.9	Very high	159 Å²	159	51.2 Å²	51.2	69%	0.691	27%	0.266	S	S	*	.	H	α-helix	trans	-59.5	-28.1	176	-68.8	174.5	-176.7	-176.8	0	113.3	Q442 Q443 F444	Q442-K446 WeakPolarHBondContact O-CG 3.32Å; Q443-K446 PolarHBondContact O-N 3.22Å; F444-K446 PolarHBondContact O-N 2.92Å
447	H	91.1	Very high	92.5	Very high	57 Å²	57	49.6 Å²	49.6	26%	0.264	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-1	178.6	-59.7	88.4	0	0	0	112.8	K429 M438 Q443 F444 K445	K429-H447 WeakPolarHBondContact CB-O 3.28Å; K429-H447 WeakPolarHBondContact CG-O 3.5Å; K429-H447 PolarHBondContact N-O 3.38Å; M438-H447 HydrophobicContact CE-CB 4.44Å; Q443-H447 PolarHBondContact O-ND1 2.96Å; F444-H447 WeakPolarHBondContact O-CB 3.34Å; F444-H447 PolarHBondContact O-N 3.23Å; K445-H447 PolarHBondContact O-N 2.76Å
448	L	94	Very high	93.1	Very high	11 Å²	11	46.4 Å²	46.4	6%	0.058	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	148.3	176.5	-57.9	177.9	0	0	0	110.8	P318 Y339 F426 I427 K429 F444 K445	P318-L448 HydrophobicContact CG-CD2 3.94Å; Y339-L448 HydrophobicContact CE1-CD1 3.86Å; F426-L448 HydrophobicContact CB-CB 4.3Å; F426-L448 HydrophobicContact CB-CD1 4.09Å; F426-L448 HydrophobicContact CD1-CB 3.98Å; F426-L448 HydrophobicContact CD1-CD1 4.43Å; F426-L448 HydrophobicContact CG-CD1 4.49Å; I427-L448 CarbonylContact O-C 3.59Å; I427-L448 VanDerWaalsContact O-CA 3.29Å; I427-L448 WeakPolarHBondContact O-CA 3.5Å; K429-L448 WeakPolarHBondContact CE-O 3.42Å; F444-L448 HydrophobicContact CD1-CD1 4.07Å; F444-L448 HydrophobicContact CE1-CD1 3.9Å; F444-L448 HydrophobicContact CE1-CD2 4.19Å; F444-L448 HydrophobicContact CE1-CG 4.41Å; F444-L448 HydrophobicContact CE2-CD2 4.16Å; F444-L448 HydrophobicContact CZ-CD1 4.4Å; F444-L448 HydrophobicContact CZ-CD2 3.84Å; F444-L448 HydrophobicContact CZ-CG 4.46Å; K445-L448 WeakPolarHBondContact O-CB 3.37Å; K445-L448 PolarHBondContact O-N 3.22Å
449	V	94.1	Very high	93.5	Very high	19 Å²	19	49 Å²	49	12%	0.115	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	137.2	165.3	60.5	0	0	0	0	108.5	F426 I427 K429 R451 E507	F426-V449 CarbonylContact C-O 3.47Å; F426-V449 WeakPolarHBondContact CA-O 3.31Å; I427-V449 HydrophobicContact CB-CG1 4.38Å; I427-V449 PolarHBondContact N-O 3.39Å; I427-V449 PolarHBondContact O-N 2.95Å; K429-V449 HydrophobicContact CG-CB 4.2Å; K429-V449 HydrophobicContact CG-CG1 4.11Å; V449-R451 HydrophobicContact CG1-CG 4.36Å; V449-R451 HydrophobicContact CG2-CG 4.46Å; V449-E507 HydrophobicContact CG2-CG 4.27Å
450	L	96.8	Very high	94	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.026	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	123	174.6	-179.6	61.5	0	0	0	109.3	C424 R425 F426 Y504 Y506 E507	C424-L450 HydrophobicContact CB-CD1 4.06Å; R425-L450 VanDerWaalsContact C-CD1 3.49Å; R425-L450 WeakPolarHBondContact O-CA 3.08Å; F426-L450 HydrophobicContact CD1-CB 4.08Å; F426-L450 HydrophobicContact CD1-CD1 4.48Å; F426-L450 HydrophobicContact CD2-CD1 3.98Å; F426-L450 HydrophobicContact CE1-CB 3.86Å; F426-L450 HydrophobicContact CE1-CD1 4.47Å; F426-L450 HydrophobicContact CE2-CD1 3.94Å; F426-L450 HydrophobicContact CG-CD1 4.25Å; F426-L450 HydrophobicContact CZ-CB 4.21Å; F426-L450 HydrophobicContact CZ-CD1 4.19Å; F426-L450 HydrophobicContact CZ-CD2 4.15Å; F426-L450 HydrophobicContact CZ-CG 4.44Å; L450-Y504 HydrophobicContact CD2-CD2 3.57Å; L450-Y504 HydrophobicContact CD2-CE2 3.43Å; L450-Y504 VanDerWaalsContact CD2-CE2 3.43Å; L450-Y506 CarbonylContact O-C 3.52Å; L450-Y506 VanDerWaalsContact O-CA 3.28Å; L450-Y506 WeakPolarHBondContact O-CA 3.49Å; L450-E507 PolarHBondContact O-N 2.87Å
451	R	95.6	Very high	94.3	Very high	74 Å²	74	48.8 Å²	48.8	28%	0.279	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	138.3	173.3	-58	-161.8	175	168	0	111	C424 R425 I427 V449 E507 L509 E513	C424-R451 CarbonylContact C-O 3.58Å; C424-R451 WeakPolarHBondContact CA-O 3.34Å; R425-R451 PolarHBondContact N-O 2.88Å; R425-R451 PolarHBondContact O-N 3.41Å; I427-R451 HydrophobicContact CD1-CB 3.89Å; I427-R451 HydrophobicContact CD1-CG 3.79Å; V449-R451 HydrophobicContact CG1-CG 4.36Å; V449-R451 HydrophobicContact CG2-CG 4.46Å; R451-E507 CarbonylContact C-O 3.56Å; R451-E507 WeakPolarHBondContact CA-O 3.42Å; R451-E507 HydrophobicContact CG-CB 4.29Å; R451-E507 IonicContact CZ-OE2 2.72Å; R451-E507 IonicContact NE-OE2 2.73Å; R451-E507 PolarHBondContact NE-OE2 3.12Å; R451-E507 IonicContact NH2-OE2 3.16Å; R451-L509 HydrophobicContact CB-CD1 4.44Å; R451-L509 HydrophobicContact CB-CD2 4.03Å; R451-L509 HydrophobicContact CB-CG 4.13Å; R451-L509 HydrophobicContact CG-CD2 4.44Å; R451-E513 IonicContact NH1-OE1 3.97Å
452	C	95.9	Very high	94.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	142.2	-176.5	-67.2	0	0	0	0	111.3	L423 C424 Y506 E507 L508 L509	L423-C452 CarbonylContact O-C 3.6Å; L423-C452 WeakPolarHBondContact O-CA 3.3Å; C424-C452 HydrophobicContact CB-CB 4.15Å; C424-C452 WeakPolarHBondContact CB-SG 3.41Å; C424-C452 WeakPolarHBondContact SG-CB 3.21Å; C424-C452 CovalentContact SG-SG 2.04Å; C424-C452 PolarHBondContact SG-SG 2.84Å; C452-Y506 HydrophobicContact CB-CD2 3.85Å; C452-Y506 HydrophobicContact CB-CE2 4.44Å; C452-Y506 HydrophobicContact CB-CG 4.35Å; C452-E507 PolarHBondContact N-O 3.39Å; C452-L508 HydrophobicContact CB-CD2 4.4Å; C452-L508 WeakPolarHBondContact O-CA 3.15Å; C452-L509 PolarHBondContact O-N 3.1Å
453	L	93.7	Very high	95	Very high	18 Å²	18	48.5 Å²	48.5	9%	0.094	25%	0.25	C	S	.	.			trans	-70.2	159.8	161.8	-60.5	-178.5	0	0	0	110.3	R422 L423 L509 E514	R422-L453 VanDerWaalsContact CD-O 3.31Å; R422-L453 WeakPolarHBondContact CD-O 3.19Å; L423-L453 HydrophobicContact CB-CD1 3.75Å; L423-L453 HydrophobicContact CB-CG 4.04Å; L423-L453 HydrophobicContact CD2-CD1 4.27Å; L423-L453 PolarHBondContact O-N 2.8Å; L453-L509 HydrophobicContact CD2-CB 4.35Å; L453-L509 HydrophobicContact CD2-CD1 3.69Å; L453-E514 HydrophobicContact CD2-CB 4.08Å; L453-E514 HydrophobicContact CD2-CG 3.54Å
454	H	92.1	Very high	95.4	Very high	112 Å²	112	45 Å²	45	52%	0.519	23%	0.234	S	C	.	.	S	Bend	trans	-61.8	153.9	168.4	-66.3	83	0	0	0	111.4	L509 E514	H454-L509 PolarHBondContact CE1-O 2.86Å; H454-L509 PolarHBondContact ND1-O 2.84Å; H454-E514 IonicContact CE1-OE1 2.67Å; H454-E514 IonicContact CG-OE1 3.95Å; H454-E514 PolarHBondContact N-OE1 3.25Å; H454-E514 IonicContact ND1-OE1 3.69Å; H454-E514 PolarHBondContact ND1-OE1 3.37Å
455	G	92.4	Very high	95.6	Very high	43 Å²	43	47.2 Å²	47.2	44%	0.443	25%	0.246	S	C	.	.	S	Bend	trans	122.5	-170	178.9	0	0	0	0	0	113.2	R422	R422-G455 WeakPolarHBondContact CD-O 3.32Å; R422-G455 PolarHBondContact NH1-O 2.8Å
456	N	96.1	Very high	95.8	Very high	142 Å²	142	53.2 Å²	53.2	76%	0.759	28%	0.275	S	S	*	.			trans	-111.4	150.9	-176	-63.5	-33.4	0	0	0	110.8	R422	R422-N456 PolarHBondContact N-O 3.34Å
457	A	98	Very high	96	Very high	21 Å²	21	55.4 Å²	55.4	17%	0.174	28%	0.278	C	S	.	.			trans	-68.4	152	167.7	0	0	0	0	0	110.8	R359 V360 E361	R359-A457 HydrophobicContact CG-CB 3.5Å; V360-A457 WeakPolarHBondContact O-CA 3.27Å; E361-A457 HydrophobicContact CG-CB 3.57Å
458	G	98.2	Very high	96.3	Very high	1 Å²	1	53 Å²	53	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	145.5	160.6	0	0	0	0	0	109.3	R359 V360 K418 Y420	R359-G458 CarbonylContact C-O 3.26Å; R359-G458 WeakPolarHBondContact CA-O 3.47Å; V360-G458 PolarHBondContact N-O 2.93Å; V360-G458 PolarHBondContact O-N 2.85Å; K418-G458 CarbonylContact O-C 3.5Å; K418-G458 VanDerWaalsContact O-C 3.23Å; K418-G458 WeakPolarHBondContact O-CA 2.88Å; Y420-G458 WeakPolarHBondContact O-CA 3.02Å; Y420-G458 PolarHBondContact O-N 2.9Å
459	V	98.5	Very high	96.5	Very high	65 Å²	65	55 Å²	55	39%	0.394	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	131.3	178.2	-175.3	0	0	0	0	109.2	T357 M358 R359 E417 K418	T357-V459 HydrophobicContact CG2-CG1 3.61Å; M358-V459 WeakPolarHBondContact O-CA 3.45Å; R359-V459 HydrophobicContact CG-CG2 4.29Å; E417-V459 CarbonylContact C-O 3.57Å; E417-V459 VanDerWaalsContact CA-O 3.31Å; E417-V459 WeakPolarHBondContact CA-O 3.3Å; K418-V459 PolarHBondContact N-O 2.92Å; K418-V459 CarbonylContact O-C 3.47Å; K418-V459 PolarHBondContact O-N 3.33Å
460	F	98.4	Very high	96.7	Very high	1 Å²	1	59.1 Å²	59.1	0%	0.004	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	160.4	167.5	70.7	-91.4	0	0	0	110.3	M358 V360 L375 A400 Y409 E417 A419 W462	M358-F460 HydrophobicContact CB-CD1 4.01Å; M358-F460 HydrophobicContact CB-CD2 4.25Å; M358-F460 HydrophobicContact CB-CE1 3.66Å; M358-F460 HydrophobicContact CB-CE2 3.9Å; M358-F460 HydrophobicContact CB-CG 4.3Å; M358-F460 HydrophobicContact CB-CZ 3.6Å; M358-F460 HydrophobicContact CG-CD2 4.22Å; M358-F460 HydrophobicContact CG-CE1 4.24Å; M358-F460 HydrophobicContact CG-CE2 3.61Å; M358-F460 HydrophobicContact CG-CZ 3.64Å; M358-F460 PolarHBondContact N-O 2.91Å; M358-F460 PolarHBondContact O-N 2.81Å; M358-F460 VanDerWaalsContact O-N 3.13Å; V360-F460 HydrophobicContact CG2-CD1 4.43Å; V360-F460 HydrophobicContact CG2-CE1 4.03Å; L375-F460 HydrophobicContact CB-CE1 4.27Å; L375-F460 HydrophobicContact CD2-CE1 4.03Å; L375-F460 HydrophobicContact CD2-CZ 4Å; L375-F460 HydrophobicContact CG-CE1 4.42Å; L375-F460 HydrophobicContact CG-CZ 4.36Å; A400-F460 HydrophobicContact CB-CD2 4.34Å; A400-F460 HydrophobicContact CB-CE2 3.71Å; Y409-F460 HydrophobicContact CD2-CB 3.96Å; Y409-F460 HydrophobicContact CD2-CD2 4.49Å; Y409-F460 HydrophobicContact CD2-CG 4.12Å; Y409-F460 HydrophobicContact CE2-CB 4.34Å; Y409-F460 HydrophobicContact CE2-CD2 4.27Å; Y409-F460 HydrophobicContact CE2-CG 4.34Å; E417-F460 HydrophobicContact CB-CB 3.77Å; E417-F460 HydrophobicContact CG-CB 4.02Å; A419-F460 HydrophobicContact CB-CD1 4.49Å; A419-F460 HydrophobicContact CB-CE1 4.46Å; F460-W462 HydrophobicContact CE2-CB 4.47Å
461	Q	97.8	Very high	96.8	Very high	115 Å²	115	61.6 Å²	61.6	54%	0.537	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	147.2	178.5	-70.3	-173.3	-21.9	0	0	111.1	T355 Y356 E417	T355-Q461 HydrophobicContact CG2-CB 3.87Å; T355-Q461 HydrophobicContact CG2-CG 4.18Å; Y356-Q461 CarbonylContact O-C 3.4Å; Y356-Q461 WeakPolarHBondContact O-CA 3.39Å; E417-Q461 PolarHBondContact OE1-N 2.79Å
462	W	97.4	Very high	97	Very high	13 Å²	13	58 Å²	58	5%	0.049	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	132.5	174.8	174.3	57.5	0	0	0	110.5	V350 Y356 M358 I377 F399 A400 F460 P464 T468 V472 I486 V488	V350-W462 HydrophobicContact CG2-CH2 4.19Å; V350-W462 HydrophobicContact CG2-CZ3 4.03Å; Y356-W462 PolarHBondContact N-O 3.37Å; Y356-W462 PolarHBondContact O-N 3.5Å; M358-W462 HydrophobicContact CE-CB 4.41Å; M358-W462 HydrophobicContact CE-CE3 3.66Å; M358-W462 HydrophobicContact CE-CZ3 4.37Å; I377-W462 HydrophobicContact CD1-CD2 3.75Å; I377-W462 HydrophobicContact CD1-CE3 3.54Å; I377-W462 HydrophobicContact CD1-CG 4.22Å; I377-W462 HydrophobicContact CD1-CH2 4.47Å; I377-W462 HydrophobicContact CD1-CZ3 3.93Å; I377-W462 HydrophobicContact CG2-CH2 4.19Å; I377-W462 HydrophobicContact CG2-CZ2 4.07Å; F399-W462 HydrophobicContact CB-CZ2 4.49Å; A400-W462 HydrophobicContact CB-CB 3.92Å; A400-W462 HydrophobicContact CB-CG 3.78Å; F460-W462 HydrophobicContact CE2-CB 4.47Å; W462-P464 HydrophobicContact CH2-CB 3.92Å; W462-P464 HydrophobicContact CH2-CG 4.2Å; W462-P464 HydrophobicContact CZ2-CB 3.69Å; W462-P464 HydrophobicContact CZ2-CG 4.32Å; W462-P464 HydrophobicContact CZ3-CG 4.34Å; W462-T468 HydrophobicContact CZ2-CG2 3.87Å; W462-V472 HydrophobicContact CH2-CG2 3.81Å; W462-V472 HydrophobicContact CZ2-CG2 4.18Å; W462-I486 HydrophobicContact CH2-CD1 4.29Å; W462-I486 HydrophobicContact CH2-CG2 4.17Å; W462-I486 HydrophobicContact CZ3-CD1 3.92Å; W462-I486 HydrophobicContact CZ3-CG2 4.08Å; W462-V488 HydrophobicContact CH2-CG2 4.07Å
463	T	98.2	Very high	97.1	Very high	60 Å²	60	60 Å²	60	37%	0.368	31%	0.312	S	S	.	.			trans	-120.9	101.7	175.6	-54.3	0	0	0	0	107.6	T355 D465	T355-T463 WeakPolarHBondContact CA-OG1 3.34Å; T355-T463 WeakPolarHBondContact CB-OG1 3.43Å; T355-T463 PolarHBondContact OG1-OG1 2.72Å; T463-D465 PolarHBondContact O-N 2.96Å
464	P	98.1	Very high	97.3	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.308	C	S	.	.			trans	-59.3	133.7	173.3	22.5	-30.9	0	0	0	109.7	V350 Q351 R352 G353 V354 Y356 W462 T468 V488	V350-P464 HydrophobicContact CG2-CG 4.01Å; Q351-P464 WeakPolarHBondContact O-CG 3.4Å; R352-P464 CarbonylContact C-O 3.5Å; R352-P464 WeakPolarHBondContact CA-O 3.31Å; G353-P464 PolarHBondContact N-O 3.27Å; V354-P464 WeakPolarHBondContact O-CD 3.3Å; Y356-P464 HydrophobicContact CE2-CG 4.36Å; W462-P464 HydrophobicContact CH2-CB 3.92Å; W462-P464 HydrophobicContact CH2-CG 4.2Å; W462-P464 HydrophobicContact CZ2-CB 3.69Å; W462-P464 HydrophobicContact CZ2-CG 4.32Å; W462-P464 HydrophobicContact CZ3-CG 4.34Å; P464-T468 HydrophobicContact CB-CG2 4.04Å; P464-V488 HydrophobicContact CB-CG1 3.7Å; P464-V488 HydrophobicContact CB-CG2 4.48Å; P464-V488 HydrophobicContact CG-CG1 4.29Å
465	D	97.3	Very high	97.6	Very high	52 Å²	52	53.9 Å²	53.9	28%	0.278	28%	0.283	S	S	.	.			trans	-113.4	-176.3	-178	73.4	3.5	0	0	0	111.6	R352 T463 R467 T468	R352-D465 VanDerWaalsContact CD-O 3.32Å; R352-D465 WeakPolarHBondContact CD-O 3.38Å; R352-D465 PolarHBondContact NE-O 3.43Å; T463-D465 PolarHBondContact O-N 2.96Å; D465-R467 PolarHBondContact O-N 2.9Å; D465-R467 VanDerWaalsContact O-N 3.09Å; D465-R467 WeakPolarHBondContact OD1-CA 3.32Å; D465-R467 WeakPolarHBondContact OD1-CB 3.33Å; D465-R467 PolarHBondContact OD1-N 3.04Å; D465-R467 IonicContact OD1-NE 2.97Å; D465-R467 IonicContact OD2-CZ 2.92Å; D465-R467 VanDerWaalsContact OD2-CZ 3.31Å; D465-R467 IonicContact OD2-NE 3.29Å; D465-R467 PolarHBondContact OD2-NE 2.68Å; D465-R467 IonicContact OD2-NH2 2.72Å; D465-R467 PolarHBondContact OD2-NH2 3.41Å; D465-T468 PolarHBondContact N-OG1 2.89Å; D465-T468 WeakPolarHBondContact O-CB 3.46Å; D465-T468 PolarHBondContact O-N 3.11Å; D465-T468 PolarHBondContact O-OG1 3.36Å; D465-T468 PolarHBondContact OD1-N 3.46Å; D465-T468 VanDerWaalsContact OD1-N 3.12Å; D465-T468 PolarHBondContact OD1-OG1 2.75Å; D465-T468 VanDerWaalsContact OD1-OG1 3.11Å
466	Q	96.7	Very high	97.8	Very high	150 Å²	150	51.8 Å²	51.8	70%	0.701	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-11.5	179	-67.7	-62.3	-19	0	0	114.6
467	R	95.8	Very high	97.9	Very high	205 Å²	205	45.8 Å²	45.8	77%	0.774	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-8.6	176.5	-57.8	172.2	-64.7	170.5	2.7	112	D465 P469	D465-R467 PolarHBondContact O-N 2.9Å; D465-R467 VanDerWaalsContact O-N 3.09Å; D465-R467 WeakPolarHBondContact OD1-CA 3.32Å; D465-R467 WeakPolarHBondContact OD1-CB 3.33Å; D465-R467 PolarHBondContact OD1-N 3.04Å; D465-R467 IonicContact OD1-NE 2.97Å; D465-R467 IonicContact OD2-CZ 2.92Å; D465-R467 VanDerWaalsContact OD2-CZ 3.31Å; D465-R467 IonicContact OD2-NE 3.29Å; D465-R467 PolarHBondContact OD2-NE 2.68Å; D465-R467 IonicContact OD2-NH2 2.72Å; D465-R467 PolarHBondContact OD2-NH2 3.41Å; R467-P469 WeakPolarHBondContact O-CD 3.37Å
468	T	98.1	Very high	97.6	Very high	5 Å²	5	45.1 Å²	45.1	3%	0.031	22%	0.222	C	C	.	.	S	Bend	trans	-75.2	123.3	177.8	-53.8	0	0	0	0	109.2	R352 F399 W462 P464 D465 V472 V488	R352-T468 PolarHBondContact NE-O 3.41Å; R352-T468 PolarHBondContact NH2-O 2.85Å; F399-T468 HydrophobicContact CD1-CG2 4.41Å; W462-T468 HydrophobicContact CZ2-CG2 3.87Å; P464-T468 HydrophobicContact CB-CG2 4.04Å; D465-T468 PolarHBondContact N-OG1 2.89Å; D465-T468 WeakPolarHBondContact O-CB 3.46Å; D465-T468 PolarHBondContact O-N 3.11Å; D465-T468 PolarHBondContact O-OG1 3.36Å; D465-T468 PolarHBondContact OD1-N 3.46Å; D465-T468 VanDerWaalsContact OD1-N 3.12Å; D465-T468 PolarHBondContact OD1-OG1 2.75Å; D465-T468 VanDerWaalsContact OD1-OG1 3.11Å; T468-V472 HydrophobicContact CG2-CG1 3.94Å; T468-V488 HydrophobicContact CG2-CG1 4.23Å; T468-V488 HydrophobicContact CG2-CG2 3.94Å
469	P	98.2	Very high	97.1	Very high	55 Å²	55	46.5 Å²	46.5	36%	0.357	23%	0.23	S	C	.	.			trans	-58.3	157.7	176.2	-23.3	33.4	0	0	0	112.6	F399 R467 V471 V472 V488	F399-P469 HydrophobicContact CE2-CG 4.42Å; F399-P469 HydrophobicContact CZ-CG 3.79Å; R467-P469 WeakPolarHBondContact O-CD 3.37Å; P469-V471 PolarHBondContact O-N 2.81Å; P469-V471 VanDerWaalsContact O-N 3.16Å; P469-V472 HydrophobicContact CB-CG1 4.37Å; P469-V472 HydrophobicContact CG-CG1 4.36Å; P469-V488 WeakPolarHBondContact O-CB 3.3Å
470	D	98.3	Very high	96.6	Very high	105 Å²	105	44.7 Å²	44.7	56%	0.561	22%	0.217	S	C	*	.	S	Bend	trans	-62.6	-22.6	179.3	-62.6	-21.3	0	0	0	113.2	R352 V487 V488	R352-D470 IonicContact CZ-OD1 2.76Å; R352-D470 IonicContact NH1-OD1 3.31Å; R352-D470 IonicContact NH2-OD1 2.92Å; R352-D470 PolarHBondContact NH2-OD1 3.47Å; D470-V487 CarbonylContact O-C 3.22Å; D470-V487 WeakPolarHBondContact O-CA 3.48Å; D470-V488 PolarHBondContact O-N 3.44Å
471	V	98.5	Very high	96.2	Very high	56 Å²	56	44.9 Å²	44.9	34%	0.339	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	121.6	173.4	-177.1	0	0	0	0	109.2	P469 Y473 K485 I486	P469-V471 PolarHBondContact O-N 2.81Å; P469-V471 VanDerWaalsContact O-N 3.16Å; V471-Y473 HydrophobicContact CG1-CE1 4.32Å; V471-Y473 HydrophobicContact CG1-CE2 3.99Å; V471-K485 HydrophobicContact CG1-CB 4.41Å; V471-K485 HydrophobicContact CG1-CD 4.37Å; V471-K485 HydrophobicContact CG1-CG 4.12Å; V471-I486 WeakPolarHBondContact CA-O 3.38Å
472	V	98.7	Very high	96	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	175.7	167.4	-59.1	0	0	0	0	108.5	I377 S378 F399 W462 T468 P469 I486 V488	I377-V472 HydrophobicContact CG2-CB 4.09Å; I377-V472 HydrophobicContact CG2-CG2 3.58Å; S378-V472 CarbonylContact O-C 3.56Å; S378-V472 WeakPolarHBondContact O-CA 3.49Å; S378-V472 WeakPolarHBondContact O-CB 3.46Å; F399-V472 HydrophobicContact CD2-CB 4.23Å; F399-V472 HydrophobicContact CD2-CG1 3.68Å; F399-V472 HydrophobicContact CE2-CB 4.35Å; F399-V472 HydrophobicContact CE2-CG1 3.49Å; F399-V472 VanDerWaalsContact CE2-CG1 3.49Å; F399-V472 HydrophobicContact CZ-CG1 4.22Å; W462-V472 HydrophobicContact CH2-CG2 3.81Å; W462-V472 HydrophobicContact CZ2-CG2 4.18Å; T468-V472 HydrophobicContact CG2-CG1 3.94Å; P469-V472 HydrophobicContact CB-CG1 4.37Å; P469-V472 HydrophobicContact CG-CG1 4.36Å; V472-I486 HydrophobicContact CG2-CB 3.79Å; V472-I486 HydrophobicContact CG2-CD1 4.32Å; V472-I486 HydrophobicContact CG2-CG1 4.39Å; V472-I486 HydrophobicContact CG2-CG2 4.34Å; V472-I486 PolarHBondContact N-O 3.38Å; V472-I486 PolarHBondContact O-N 3.19Å; V472-V488 HydrophobicContact CG2-CG2 4.04Å
473	Y	98.5	Very high	95.9	Very high	42 Å²	42	39 Å²	39	17%	0.165	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	136.1	-173	-60.4	-92.1	0	0	0	110.3	I377 S378 D380 P381 V471 W484 K485	I377-Y473 VanDerWaalsContact CA-O 3.31Å; I377-Y473 WeakPolarHBondContact CA-O 3.4Å; S378-Y473 PolarHBondContact N-O 2.81Å; S378-Y473 PolarHBondContact O-N 2.97Å; D380-Y473 WeakPolarHBondContact O-CB 3.48Å; P381-Y473 VanDerWaalsContact CA-CG 3.43Å; P381-Y473 HydrophobicContact CB-CD1 3.66Å; P381-Y473 HydrophobicContact CB-CD2 3.97Å; P381-Y473 HydrophobicContact CB-CE1 3.5Å; P381-Y473 VanDerWaalsContact CB-CE1 3.5Å; P381-Y473 HydrophobicContact CB-CE2 3.85Å; P381-Y473 HydrophobicContact CB-CG 3.9Å; P381-Y473 HydrophobicContact CG-CE2 4.41Å; V471-Y473 HydrophobicContact CG1-CE1 4.32Å; V471-Y473 HydrophobicContact CG1-CE2 3.99Å; Y473-W484 WeakPolarHBondContact CA-O 3.42Å; Y473-K485 HydrophobicContact CD1-CG 3.98Å; Y473-K485 HydrophobicContact CE1-CB 4.42Å; Y473-K485 HydrophobicContact CE1-CD 4.47Å; Y473-K485 HydrophobicContact CE1-CG 3.43Å; Y473-K485 VanDerWaalsContact CE1-CG 3.43Å
474	Y	98.7	Very high	95.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	129.2	167.4	62.8	-91.7	0	0	0	108.5	F314 W338 V340 T345 P346 L348 L375 Y376 G483 W484 I486	F314-Y474 HydrophobicContact CD1-CD2 4.15Å; F314-Y474 AromaticContact CE1-CD2 3.51Å; F314-Y474 HydrophobicContact CE1-CD2 3.51Å; F314-Y474 AromaticContact CE1-CE2 3.98Å; F314-Y474 HydrophobicContact CE1-CE2 3.98Å; F314-Y474 AromaticContact CE1-CG 3.81Å; F314-Y474 HydrophobicContact CE1-CG 3.81Å; F314-Y474 HydrophobicContact CZ-CG 4.46Å; W338-Y474 HydrophobicContact CB-CD2 4.31Å; W338-Y474 HydrophobicContact CB-CE2 3.83Å; W338-Y474 HydrophobicContact CG-CD2 4.34Å; W338-Y474 HydrophobicContact CG-CE2 4.33Å; V340-Y474 HydrophobicContact CG2-CE2 4.01Å; T345-Y474 VanDerWaalsContact C-OH 3.27Å; T345-Y474 WeakPolarHBondContact CA-OH 3.42Å; T345-Y474 HydrophobicContact CG2-CE2 4.28Å; P346-Y474 PolarHBondContact O-OH 3.37Å; L348-Y474 HydrophobicContact CD1-CD1 3.99Å; L348-Y474 HydrophobicContact CD1-CE1 4Å; L348-Y474 HydrophobicContact CG-CD1 4.35Å; L348-Y474 HydrophobicContact CG-CE1 3.94Å; L375-Y474 HydrophobicContact CD1-CD2 4.49Å; Y376-Y474 WeakPolarHBondContact O-CA 3.31Å; Y474-G483 VanDerWaalsContact O-CA 3.24Å; Y474-G483 WeakPolarHBondContact O-CA 3.36Å; Y474-W484 WeakPolarHBondContact CD1-O 3.31Å; Y474-W484 VanDerWaalsContact CE1-C 3.46Å; Y474-W484 HydrophobicContact CE1-CB 3.99Å; Y474-W484 WeakPolarHBondContact CE1-O 3.41Å; Y474-W484 VanDerWaalsContact CZ-N 3.34Å; Y474-W484 PolarHBondContact N-O 2.8Å; Y474-W484 VanDerWaalsContact N-O 3.13Å; Y474-W484 PolarHBondContact O-N 3.02Å; Y474-W484 WeakPolarHBondContact OH-CB 3.32Å; Y474-I486 HydrophobicContact CD1-CD1 4.21Å; Y474-I486 HydrophobicContact CD1-CG1 3.66Å; Y474-I486 HydrophobicContact CE1-CG1 4.49Å
475	Q	97.4	Very high	95.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	169.5	-176.9	-81.2	-67.1	0.3	0	0	111.8	Y376 P381 G383 G483	Y376-Q475 HydrophobicContact CD1-CB 4.36Å; Y376-Q475 WeakPolarHBondContact CD1-O 3.35Å; Y376-Q475 HydrophobicContact CE1-CB 3.68Å; Y376-Q475 PolarHBondContact N-O 2.73Å; Y376-Q475 VanDerWaalsContact N-O 3.11Å; Y376-Q475 PolarHBondContact O-N 2.98Å; P381-Q475 PolarHBondContact O-NE2 2.78Å; G383-Q475 VanDerWaalsContact CA-CB 3.47Å; Q475-G483 VanDerWaalsContact CD-N 3.32Å; Q475-G483 PolarHBondContact NE2-O 2.87Å
476	S	97.2	Very high	95.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	133.8	168.8	174.4	0	0	0	0	110.4	N373 P374 Y376 G384 T478 N479 M482	N373-S476 PolarHBondContact OD1-OG 3.24Å; P374-S476 WeakPolarHBondContact O-CA 3.3Å; Y376-S476 WeakPolarHBondContact CE1-O 3.5Å; G384-S476 PolarHBondContact N-O 3.21Å; S476-T478 PolarHBondContact O-N 3.27Å; S476-T478 PolarHBondContact OG-N 3.27Å; S476-T478 PolarHBondContact OG-OG1 3.49Å; S476-N479 WeakPolarHBondContact CB-O 3.32Å; S476-N479 PolarHBondContact OG-N 3.04Å; S476-M482 WeakPolarHBondContact CB-SD 3.23Å
477	Y	96.8	Very high	95.8	Very high	15 Å²	15	32.3 Å²	32.3	6%	0.059	15%	0.153	C	C	.	.	S	Bend	trans	-60.7	-32.2	176	174.4	-106.1	0	0	0	112.3	P374 G384 Y385 A386 L402 S406 Q407 P408	P374-Y477 HydrophobicContact CG-CD1 4.38Å; P374-Y477 WeakPolarHBondContact O-CB 3.44Å; P374-Y477 PolarHBondContact O-N 2.9Å; G384-Y477 CarbonylContact C-O 3.48Å; G384-Y477 WeakPolarHBondContact CA-O 3.18Å; Y385-Y477 HydrophobicContact CD1-CD2 4Å; Y385-Y477 AromaticContact CD1-CE2 3.49Å; Y385-Y477 HydrophobicContact CD1-CE2 3.49Å; Y385-Y477 VanDerWaalsContact CD1-CE2 3.49Å; Y385-Y477 HydrophobicContact CE1-CE2 4.29Å; Y385-Y477 HydrophobicContact CG-CD2 4.28Å; Y385-Y477 HydrophobicContact CG-CE2 4.22Å; Y385-Y477 PolarHBondContact N-O 3.22Å; A386-Y477 HydrophobicContact CB-CD1 3.86Å; A386-Y477 HydrophobicContact CB-CE1 3.48Å; A386-Y477 VanDerWaalsContact CB-CE1 3.48Å; A386-Y477 HydrophobicContact CB-CE2 4.42Å; A386-Y477 HydrophobicContact CB-CG 4.47Å; A386-Y477 WeakPolarHBondContact CB-O 3.44Å; A386-Y477 PolarHBondContact N-O 3.49Å; L402-Y477 HydrophobicContact CD1-CD2 3.89Å; L402-Y477 HydrophobicContact CD1-CE2 3.97Å; L402-Y477 HydrophobicContact CD2-CD2 3.53Å; L402-Y477 HydrophobicContact CD2-CE2 3.98Å; L402-Y477 HydrophobicContact CD2-CG 4.22Å; L402-Y477 HydrophobicContact CG-CD2 4.41Å; S406-Y477 WeakPolarHBondContact O-CE2 3.45Å; S406-Y477 PolarHBondContact O-OH 2.72Å; Q407-Y477 PolarHBondContact OE1-OH 2.85Å; P408-Y477 HydrophobicContact CG-CD1 3.44Å; P408-Y477 VanDerWaalsContact CG-CD1 3.44Å; P408-Y477 HydrophobicContact CG-CD2 4.12Å; P408-Y477 HydrophobicContact CG-CE1 3.65Å; P408-Y477 HydrophobicContact CG-CE2 4.29Å; P408-Y477 HydrophobicContact CG-CG 3.7Å
478	T	91.6	Very high	95.9	Very high	7 Å²	7	22.6 Å²	22.6	4%	0.043	12%	0.116	C	C	.	.	S	Bend	trans	-104.6	-28	-173.4	52.9	0	0	0	0	113.6	F372 A386 K387 S476	F372-T478 HydrophobicContact CD1-CG2 3.68Å; F372-T478 HydrophobicContact CE1-CG2 4.01Å; F372-T478 PolarHBondContact O-OG1 3.1Å; A386-T478 HydrophobicContact CB-CG2 4.37Å; K387-T478 VanDerWaalsContact CD-O 3.29Å; K387-T478 WeakPolarHBondContact CD-O 3.37Å; K387-T478 WeakPolarHBondContact CE-O 3.45Å; K387-T478 PolarHBondContact NZ-O 2.8Å; S476-T478 PolarHBondContact O-N 3.27Å; S476-T478 PolarHBondContact OG-N 3.27Å; S476-T478 PolarHBondContact OG-OG1 3.49Å
479	N	89.1	Confident	95.9	Very high	31 Å²	31	23.3 Å²	23.3	17%	0.166	12%	0.121	C	C	.	.	S	Bend	trans	-118.9	138.5	-171.9	-69.5	-55.3	0	0	0	111.3	E369 N373 G384 K387 S476 M482	E369-N479 PolarHBondContact O-ND2 3.02Å; N373-N479 PolarHBondContact OD1-ND2 3.4Å; G384-N479 PolarHBondContact N-O 2.94Å; K387-N479 PolarHBondContact NZ-OD1 3.03Å; S476-N479 WeakPolarHBondContact CB-O 3.32Å; S476-N479 PolarHBondContact OG-N 3.04Å; N479-M482 HydrophobicContact CB-CG 4.16Å; N479-M482 HydrophobicContact CB-SD 3.36Å; N479-M482 WeakPolarHBondContact CB-SD 3.43Å
480	F	87.6	Confident	95.8	Very high	26 Å²	26	25.5 Å²	25.5	11%	0.114	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-80	154.4	179	-63.2	-67.7	0	0	0	111.4	R260 Y382 G383 K387 L388 M482	R260-F480 VanDerWaalsContact NH1-CE1 3.25Å; Y382-F480 CarbonylContact O-C 3.54Å; Y382-F480 WeakPolarHBondContact O-CA 3.34Å; G383-F480 WeakPolarHBondContact O-CD1 3.42Å; G383-F480 WeakPolarHBondContact O-CE1 3.32Å; K387-F480 HydrophobicContact CB-CE2 4.14Å; K387-F480 HydrophobicContact CB-CZ 3.88Å; K387-F480 HydrophobicContact CD-CD2 4.46Å; K387-F480 HydrophobicContact CD-CE2 3.84Å; K387-F480 HydrophobicContact CD-CZ 4.37Å; L388-F480 HydrophobicContact CD2-CE1 4.24Å; L388-F480 HydrophobicContact CD2-CZ 4.3Å; F480-M482 PolarHBondContact O-N 3.34Å
481	N	89.1	Confident	95.6	Very high	6 Å²	6	27.1 Å²	27.1	3%	0.032	13%	0.134	C	C	.	.	S	Bend	trans	56.2	49.9	166	-55.3	-24.1	0	0	0	113.1	Y325 A331 K332 Y382	Y325-N481 HydrophobicContact CE1-CB 4.05Å; Y325-N481 VanDerWaalsContact CE1-O 3.24Å; Y325-N481 WeakPolarHBondContact CE1-O 3.47Å; Y325-N481 WeakPolarHBondContact OH-CA 3.36Å; Y325-N481 PolarHBondContact OH-O 2.97Å; Y325-N481 VanDerWaalsContact OH-O 3.14Å; A331-N481 HydrophobicContact CB-CB 4.39Å; K332-N481 PolarHBondContact O-ND2 3.36Å; Y382-N481 PolarHBondContact O-N 2.97Å
482	M	94	Very high	95.3	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.02	12%	0.12	C	C	.	.			trans	-107.5	-32.4	178.4	-66.1	-169.5	64.3	0	0	113.3	L316 Y325 F336 V337 W338 T345 N373 S476 N479 F480	L316-M482 HydrophobicContact CD2-CE 3.39Å; Y325-M482 PolarHBondContact OH-N 3.21Å; F336-M482 HydrophobicContact CB-CE 4.09Å; F336-M482 WeakPolarHBondContact O-CG 3.48Å; V337-M482 CarbonylContact C-O 3.54Å; V337-M482 WeakPolarHBondContact CA-O 3.44Å; V337-M482 VanDerWaalsContact CB-O 3.28Å; V337-M482 WeakPolarHBondContact CB-O 3.31Å; W338-M482 HydrophobicContact CG-CB 4.43Å; W338-M482 PolarHBondContact N-O 3.35Å; T345-M482 VanDerWaalsContact CG2-O 3.22Å; T345-M482 WeakPolarHBondContact CG2-O 3.13Å; N373-M482 HydrophobicContact CB-CE 4.46Å; N373-M482 WeakPolarHBondContact OD1-CE 3.38Å; N373-M482 PolarHBondContact OD1-SD 3.28Å; S476-M482 WeakPolarHBondContact CB-SD 3.23Å; N479-M482 HydrophobicContact CB-CG 4.16Å; N479-M482 HydrophobicContact CB-SD 3.36Å; N479-M482 WeakPolarHBondContact CB-SD 3.43Å; F480-M482 PolarHBondContact O-N 3.34Å
483	G	95.6	Very high	95	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.135	C	C	.	.			trans	-114.9	-162.8	-172.9	0	0	0	0	0	114.1	Y325 Y474 Q475	Y325-G483 WeakPolarHBondContact CE2-O 3.48Å; Y325-G483 PolarHBondContact OH-O 2.97Å; Y474-G483 VanDerWaalsContact O-CA 3.24Å; Y474-G483 WeakPolarHBondContact O-CA 3.36Å; Q475-G483 VanDerWaalsContact CD-N 3.32Å; Q475-G483 PolarHBondContact NE2-O 2.87Å
484	W	94.4	Very high	94.5	Very high	34 Å²	34	31 Å²	31	13%	0.129	16%	0.163	C	C	.	.			trans	-152.2	-165	-171.6	-160	-123	0	0	0	112.5	L328 A329 T345 Y473 Y474	L328-W484 WeakPolarHBondContact O-CH2 3.19Å; A329-W484 HydrophobicContact CB-CE3 3.97Å; A329-W484 HydrophobicContact CB-CH2 4.26Å; A329-W484 HydrophobicContact CB-CZ3 3.49Å; A329-W484 VanDerWaalsContact CB-CZ3 3.49Å; T345-W484 HydrophobicContact CG2-CB 4Å; Y473-W484 WeakPolarHBondContact CA-O 3.42Å; Y474-W484 WeakPolarHBondContact CD1-O 3.31Å; Y474-W484 VanDerWaalsContact CE1-C 3.46Å; Y474-W484 HydrophobicContact CE1-CB 3.99Å; Y474-W484 WeakPolarHBondContact CE1-O 3.41Å; Y474-W484 VanDerWaalsContact CZ-N 3.34Å; Y474-W484 PolarHBondContact N-O 2.8Å; Y474-W484 VanDerWaalsContact N-O 3.13Å; Y474-W484 PolarHBondContact O-N 3.02Å; Y474-W484 WeakPolarHBondContact OH-CB 3.32Å
485	K	96.8	Very high	94.1	Very high	66 Å²	66	37.6 Å²	37.6	29%	0.287	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	141.2	-173.1	-66.8	176.4	-176.1	-178.2	0	112.5	E347 L348 V471 Y473	E347-K485 HydrophobicContact CG-CB 4.24Å; L348-K485 PolarHBondContact N-O 2.69Å; V471-K485 HydrophobicContact CG1-CB 4.41Å; V471-K485 HydrophobicContact CG1-CD 4.37Å; V471-K485 HydrophobicContact CG1-CG 4.12Å; Y473-K485 HydrophobicContact CD1-CG 3.98Å; Y473-K485 HydrophobicContact CE1-CB 4.42Å; Y473-K485 HydrophobicContact CE1-CD 4.47Å; Y473-K485 HydrophobicContact CE1-CG 3.43Å; Y473-K485 VanDerWaalsContact CE1-CG 3.43Å
486	I	98.7	Very high	93.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	118.9	155.5	-49.6	-175.3	0	0	0	106.8	L348 V350 I377 W462 V471 V472 Y474 V488	L348-I486 HydrophobicContact CB-CB 4.5Å; L348-I486 HydrophobicContact CB-CG1 4.27Å; L348-I486 HydrophobicContact CB-CG2 4.26Å; L348-I486 HydrophobicContact CD1-CD1 4.48Å; L348-I486 HydrophobicContact CD1-CG1 4.28Å; L348-I486 CarbonylContact O-C 3.55Å; L348-I486 VanDerWaalsContact O-CA 3.31Å; L348-I486 WeakPolarHBondContact O-CA 3.27Å; V350-I486 HydrophobicContact CB-CG2 4.34Å; V350-I486 HydrophobicContact CG1-CG2 3.96Å; V350-I486 HydrophobicContact CG2-CG2 3.48Å; V350-I486 VanDerWaalsContact CG2-CG2 3.48Å; I377-I486 HydrophobicContact CD1-CD1 3.84Å; I377-I486 HydrophobicContact CG1-CD1 4.13Å; I377-I486 HydrophobicContact CG2-CD1 4.1Å; W462-I486 HydrophobicContact CH2-CD1 4.29Å; W462-I486 HydrophobicContact CH2-CG2 4.17Å; W462-I486 HydrophobicContact CZ3-CD1 3.92Å; W462-I486 HydrophobicContact CZ3-CG2 4.08Å; V471-I486 WeakPolarHBondContact CA-O 3.38Å; V472-I486 HydrophobicContact CG2-CB 3.79Å; V472-I486 HydrophobicContact CG2-CD1 4.32Å; V472-I486 HydrophobicContact CG2-CG1 4.39Å; V472-I486 HydrophobicContact CG2-CG2 4.34Å; V472-I486 PolarHBondContact N-O 3.38Å; V472-I486 PolarHBondContact O-N 3.19Å; Y474-I486 HydrophobicContact CD1-CD1 4.21Å; Y474-I486 HydrophobicContact CD1-CG1 3.66Å; Y474-I486 HydrophobicContact CE1-CG1 4.49Å; I486-V488 HydrophobicContact CG2-CG2 4.26Å
487	V	98.5	Very high	92.9	Very high	21 Å²	21	43.8 Å²	43.8	13%	0.127	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.5	170.7	-175.1	0	0	0	0	108.3	E347 L348 W349 V350 D470 T489	E347-V487 HydrophobicContact CG-CG2 3.93Å; L348-V487 PolarHBondContact O-N 3.45Å; W349-V487 WeakPolarHBondContact CA-O 3.41Å; W349-V487 HydrophobicContact CD2-CB 3.79Å; W349-V487 HydrophobicContact CD2-CG1 3.91Å; W349-V487 HydrophobicContact CD2-CG2 4.4Å; W349-V487 HydrophobicContact CE3-CB 4.16Å; W349-V487 HydrophobicContact CE3-CG1 3.79Å; W349-V487 HydrophobicContact CG-CB 4.11Å; W349-V487 HydrophobicContact CH2-CG1 3.81Å; W349-V487 HydrophobicContact CZ2-CB 4.21Å; W349-V487 HydrophobicContact CZ2-CG1 3.9Å; W349-V487 HydrophobicContact CZ2-CG2 4.16Å; W349-V487 HydrophobicContact CZ3-CG1 3.74Å; V350-V487 PolarHBondContact N-O 2.94Å; D470-V487 CarbonylContact O-C 3.22Å; D470-V487 WeakPolarHBondContact O-CA 3.48Å; V487-T489 HydrophobicContact CG1-CG2 4.09Å
488	V	98.6	Very high	92	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.012	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.6	-178	-176.5	0	0	0	0	108.6	V350 R352 W462 P464 T468 P469 D470 V472 I486	V350-V488 HydrophobicContact CG2-CB 4.25Å; V350-V488 HydrophobicContact CG2-CG1 4.39Å; V350-V488 HydrophobicContact CG2-CG2 3.77Å; R352-V488 HydrophobicContact CG-CG1 3.61Å; W462-V488 HydrophobicContact CH2-CG2 4.07Å; P464-V488 HydrophobicContact CB-CG1 3.7Å; P464-V488 HydrophobicContact CB-CG2 4.48Å; P464-V488 HydrophobicContact CG-CG1 4.29Å; T468-V488 HydrophobicContact CG2-CG1 4.23Å; T468-V488 HydrophobicContact CG2-CG2 3.94Å; P469-V488 WeakPolarHBondContact O-CB 3.3Å; D470-V488 PolarHBondContact O-N 3.44Å; V472-V488 HydrophobicContact CG2-CG2 4.04Å; I486-V488 HydrophobicContact CG2-CG2 4.26Å
489	T	97.7	Very high	91.7	Very high	20 Å²	20	49.4 Å²	49.4	12%	0.123	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	158.1	-174.1	59.8	0	0	0	0	111.4	W349 V350 Q351 R352 V487 E491 I492	W349-T489 HydrophobicContact CE3-CG2 3.66Å; W349-T489 HydrophobicContact CZ3-CG2 3.61Å; V350-T489 PolarHBondContact O-N 3.03Å; V350-T489 PolarHBondContact O-OG1 3.06Å; V350-T489 VanDerWaalsContact O-OG1 3.06Å; Q351-T489 CarbonylContact C-O 3.48Å; Q351-T489 VanDerWaalsContact CA-O 3.26Å; Q351-T489 WeakPolarHBondContact CA-O 3.37Å; R352-T489 PolarHBondContact N-O 2.84Å; V487-T489 HydrophobicContact CG1-CG2 4.09Å; T489-E491 WeakPolarHBondContact CB-O 3.15Å; T489-E491 PolarHBondContact OG1-O 3.15Å; T489-I492 PolarHBondContact OG1-N 2.98Å
490	D	96.1	Very high	91.5	Very high	100 Å²	100	55.3 Å²	55.3	54%	0.535	29%	0.289	S	S	.	.	S	Bend	trans	-75.3	-33.2	170.7	-62.9	-22.8	0	0	0	111.4	Q351 R352	Q351-D490 WeakPolarHBondContact CG-O 3.46Å; Q351-D490 PolarHBondContact NE2-O 2.91Å; R352-D490 VanDerWaalsContact CD-OD1 3.3Å; R352-D490 WeakPolarHBondContact CD-OD1 3.28Å; R352-D490 IonicContact CZ-OD1 2.83Å; R352-D490 IonicContact NE-OD1 3.6Å; R352-D490 IonicContact NH1-OD1 3.67Å; R352-D490 PolarHBondContact NH1-OD1 3.39Å
491	E	93.5	Very high	91.2	Very high	140 Å²	140	58.1 Å²	58.1	65%	0.654	30%	0.303	S	S	*	.	S	Bend	trans	-145.2	133.8	169.9	-174.4	173.3	-170.9	0	0	108.7	T489 P493	T489-E491 WeakPolarHBondContact CB-O 3.15Å; T489-E491 PolarHBondContact OG1-O 3.15Å; E491-P493 WeakPolarHBondContact O-CD 3.2Å
492	I	92.4	Very high	91	Very high	9 Å²	9	62 Å²	62	5%	0.046	32%	0.321	C	S	.	.			trans	-72.6	122.2	178	-62.2	173.5	0	0	0	108.4	L304 W349 Q351 T489 T494 L496	L304-I492 HydrophobicContact CD1-CG2 4.41Å; L304-I492 HydrophobicContact CD2-CG2 4.05Å; W349-I492 HydrophobicContact CB-CD1 4.45Å; W349-I492 HydrophobicContact CB-CG2 4.43Å; Q351-I492 HydrophobicContact CB-CG1 4.4Å; T489-I492 PolarHBondContact OG1-N 2.98Å; I492-T494 PolarHBondContact O-N 3Å; I492-L496 HydrophobicContact CG2-CD1 4.01Å
493	P	92.5	Very high	90.6	Very high	49 Å²	49	68.2 Å²	68.2	32%	0.318	36%	0.361	S	S	.	.			trans	-54.5	136.9	-179.1	-23.9	30.5	0	0	0	112.7	W349 E491 D495 L496	W349-P493 HydrophobicContact CZ3-CG 3.99Å; E491-P493 WeakPolarHBondContact O-CD 3.2Å; P493-D495 VanDerWaalsContact C-N 3.27Å; P493-D495 WeakPolarHBondContact CB-OD1 3.11Å; P493-D495 PolarHBondContact O-N 2.79Å; P493-L496 HydrophobicContact CB-CD1 4.16Å; P493-L496 HydrophobicContact CB-CG 4.12Å; P493-L496 HydrophobicContact CG-CD1 4.06Å; P493-L496 HydrophobicContact CG-CG 4.45Å; P493-L496 PolarHBondContact O-N 2.94Å
494	T	88.3	Confident	90.1	Very high	122 Å²	122	71.5 Å²	71.5	75%	0.748	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-16.8	-175	52.5	0	0	0	0	114	I492	I492-T494 PolarHBondContact O-N 3Å
495	D	89.7	Confident	89.9	Confident	137 Å²	137	74.8 Å²	74.8	73%	0.733	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-7.9	-179.7	63.4	-43.7	0	0	0	113.5	P493	P493-D495 VanDerWaalsContact C-N 3.27Å; P493-D495 WeakPolarHBondContact CB-OD1 3.11Å; P493-D495 PolarHBondContact O-N 2.79Å
496	L	87.2	Confident	89.7	Confident	39 Å²	39	76.7 Å²	76.7	20%	0.204	41%	0.408	C	S	.	.	S	Bend	trans	-65.4	136.5	174.4	-72.4	171.2	0	0	0	111	L304 W349 I492 P493 F498	L304-L496 HydrophobicContact CD1-CB 4.03Å; L304-L496 HydrophobicContact CD2-CB 4.06Å; L304-L496 HydrophobicContact CD2-CD1 3.97Å; W349-L496 HydrophobicContact CD2-CD1 3.5Å; W349-L496 HydrophobicContact CE3-CD1 3.38Å; W349-L496 HydrophobicContact CG-CD1 4.2Å; W349-L496 HydrophobicContact CH2-CD1 3.83Å; W349-L496 HydrophobicContact CH2-CD2 4.33Å; W349-L496 HydrophobicContact CZ2-CD1 3.95Å; W349-L496 HydrophobicContact CZ2-CD2 4.12Å; W349-L496 HydrophobicContact CZ3-CD1 3.55Å; I492-L496 HydrophobicContact CG2-CD1 4.01Å; P493-L496 HydrophobicContact CB-CD1 4.16Å; P493-L496 HydrophobicContact CB-CG 4.12Å; P493-L496 HydrophobicContact CG-CD1 4.06Å; P493-L496 HydrophobicContact CG-CG 4.45Å; P493-L496 PolarHBondContact O-N 2.94Å; L496-F498 PolarHBondContact O-N 2.88Å
497	P	81.9	Confident	89.4	Confident	91 Å²	91	81.2 Å²	81.2	59%	0.591	43%	0.43	S	S	*	.			trans	-63.9	122	179.2	26.4	-33.3	0	0	0	110.1	T499	P497-T499 PolarHBondContact O-N 2.81Å
498	F	79.4	Confident	89.1	Confident	107 Å²	107	84.1 Å²	84.1	47%	0.469	44%	0.444	S	S	.	.			trans	-79	110	172.8	-175.9	-96.6	0	0	0	109.6	L304 L496 E500	L304-F498 HydrophobicContact CB-CD2 4.33Å; L304-F498 HydrophobicContact CD1-CB 4.39Å; L304-F498 HydrophobicContact CD1-CD2 4.2Å; L496-F498 PolarHBondContact O-N 2.88Å; F498-E500 HydrophobicContact CD1-CG 4.07Å; F498-E500 HydrophobicContact CE1-CG 4Å; F498-E500 PolarHBondContact O-N 3.03Å
499	T	84.9	Confident	88.3	Confident	33 Å²	33	84.1 Å²	84.1	20%	0.202	44%	0.444	C	S	.	.			trans	-77.2	112.3	169.7	-52.3	0	0	0	0	109.4	V301 T302 L303 R309 Y343 P497	V301-T499 HydrophobicContact CG1-CG2 3.85Å; T302-T499 VanDerWaalsContact O-CB 3.29Å; T302-T499 WeakPolarHBondContact O-CB 3.44Å; T302-T499 PolarHBondContact O-OG1 2.92Å; L303-T499 HydrophobicContact CD2-CG2 4.4Å; R309-T499 PolarHBondContact NH2-O 2.9Å; Y343-T499 HydrophobicContact CE1-CG2 4.29Å; Y343-T499 HydrophobicContact CE2-CG2 4.43Å; P497-T499 PolarHBondContact O-N 2.81Å
500	E	84.2	Confident	87.4	Confident	155 Å²	155	87.1 Å²	87.1	72%	0.724	46%	0.459	S	S	*	.			trans	-64.6	135.6	169.4	-72.1	-172.7	175.6	0	0	110.5	Y343 F498 E502	Y343-E500 PolarHBondContact OH-O 3.05Å; F498-E500 HydrophobicContact CD1-CG 4.07Å; F498-E500 HydrophobicContact CE1-CG 4Å; F498-E500 PolarHBondContact O-N 3.03Å; E500-E502 PolarHBondContact O-N 3.17Å
501	E	82.5	Confident	86.2	Confident	86 Å²	86	87 Å²	87	40%	0.402	47%	0.466	S	S	.	.			trans	-79.8	114.4	-178.9	-168.3	165.1	150.2	0	0	110.6	R309 N341	R309-E501 IonicContact NE-OE2 3.69Å; R309-E501 PolarHBondContact NE-OE2 2.85Å; R309-E501 IonicContact NH2-OE2 2.98Å; N341-E501 HydrophobicContact CB-CG 4.29Å; N341-E501 WeakPolarHBondContact CB-OE1 3.41Å; N341-E501 PolarHBondContact ND2-OE1 2.61Å; N341-E501 PolarHBondContact ND2-OE2 3.21Å
502	E	84.2	Confident	85	Confident	88 Å²	88	85.2 Å²	85.2	41%	0.411	46%	0.464	S	S	.	.			trans	-71.8	126.4	173	-67.6	170.7	173.9	0	0	110.3	Y343 K445 E500	Y343-E502 PolarHBondContact OH-N 2.96Å; K445-E502 IonicContact NZ-OE2 2.61Å; K445-E502 PolarHBondContact NZ-OE2 3.17Å; E500-E502 PolarHBondContact O-N 3.17Å
503	P	84.8	Confident	83.7	Confident	134 Å²	134	88 Å²	88	87%	0.87	48%	0.477	S	S	*	.			trans	-62.6	140.5	176.9	27.1	-34.1	0	0	0	110.6
504	Y	86	Confident	82.4	Confident	68 Å²	68	87.8 Å²	87.8	27%	0.267	47%	0.472	S	S	.	.			trans	-139.4	146.1	174.5	63.3	-81.6	0	0	0	110.4	Q315 N341 G342 F426 L450	Q315-Y504 VanDerWaalsContact OE1-CE2 3.26Å; Q315-Y504 PolarHBondContact OE1-OH 3.43Å; N341-Y504 VanDerWaalsContact C-CE1 3.43Å; G342-Y504 PolarHBondContact N-OH 3.06Å; F426-Y504 HydrophobicContact CE1-CD2 4.47Å; F426-Y504 AromaticContact CZ-CD2 3.95Å; F426-Y504 HydrophobicContact CZ-CD2 3.95Å; F426-Y504 AromaticContact CZ-CE2 3.94Å; F426-Y504 HydrophobicContact CZ-CE2 3.94Å; L450-Y504 HydrophobicContact CD2-CD2 3.57Å; L450-Y504 HydrophobicContact CD2-CE2 3.43Å; L450-Y504 VanDerWaalsContact CD2-CE2 3.43Å
505	S	90	Very high	81.1	Confident	104 Å²	104	83.4 Å²	83.4	73%	0.727	45%	0.452	S	S	*	.			trans	-109.7	158.7	177	58.5	0	0	0	0	110.6
506	Y	92.2	Very high	79.7	Confident	105 Å²	105	82.9 Å²	82.9	41%	0.412	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	152.3	172.7	65.5	-91.9	0	0	0	111.2	L450 C452 L508	L450-Y506 CarbonylContact O-C 3.52Å; L450-Y506 VanDerWaalsContact O-CA 3.28Å; L450-Y506 WeakPolarHBondContact O-CA 3.49Å; C452-Y506 HydrophobicContact CB-CD2 3.85Å; C452-Y506 HydrophobicContact CB-CE2 4.44Å; C452-Y506 HydrophobicContact CB-CG 4.35Å; Y506-L508 HydrophobicContact CD2-CD2 4.13Å; Y506-L508 HydrophobicContact CD2-CG 4.23Å; Y506-L508 HydrophobicContact CE2-CD1 4.46Å; Y506-L508 HydrophobicContact CE2-CD2 3.6Å; Y506-L508 HydrophobicContact CE2-CG 3.72Å
507	E	93.2	Very high	78.4	Confident	96 Å²	96	82.8 Å²	82.8	45%	0.449	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	135.1	166.8	-62.4	168.6	177	0	0	108.6	V449 L450 R451 C452	V449-E507 HydrophobicContact CG2-CG 4.27Å; L450-E507 PolarHBondContact O-N 2.87Å; R451-E507 CarbonylContact C-O 3.56Å; R451-E507 WeakPolarHBondContact CA-O 3.42Å; R451-E507 HydrophobicContact CG-CB 4.29Å; R451-E507 IonicContact CZ-OE2 2.72Å; R451-E507 IonicContact NE-OE2 2.73Å; R451-E507 PolarHBondContact NE-OE2 3.12Å; R451-E507 IonicContact NH2-OE2 3.16Å; C452-E507 PolarHBondContact N-O 3.39Å
508	L	90.9	Very high	77.3	Confident	82 Å²	82	84 Å²	84	43%	0.429	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	128.1	169.5	-74.1	172.7	0	0	0	109.1	C452 Y506	C452-L508 HydrophobicContact CB-CD2 4.4Å; C452-L508 WeakPolarHBondContact O-CA 3.15Å; Y506-L508 HydrophobicContact CD2-CD2 4.13Å; Y506-L508 HydrophobicContact CD2-CG 4.23Å; Y506-L508 HydrophobicContact CE2-CD1 4.46Å; Y506-L508 HydrophobicContact CE2-CD2 3.6Å; Y506-L508 HydrophobicContact CE2-CG 3.72Å
509	L	83.6	Confident	75.9	Confident	2 Å²	2	86.8 Å²	86.8	1%	0.01	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-69.8	134	172.8	-67.2	169.9	0	0	0	109.4	R451 C452 L453 H454 E513 E514 Y517	R451-L509 HydrophobicContact CB-CD1 4.44Å; R451-L509 HydrophobicContact CB-CD2 4.03Å; R451-L509 HydrophobicContact CB-CG 4.13Å; R451-L509 HydrophobicContact CG-CD2 4.44Å; C452-L509 PolarHBondContact O-N 3.1Å; L453-L509 HydrophobicContact CD2-CB 4.35Å; L453-L509 HydrophobicContact CD2-CD1 3.69Å; H454-L509 PolarHBondContact CE1-O 2.86Å; H454-L509 PolarHBondContact ND1-O 2.84Å; L509-E513 HydrophobicContact CB-CB 4.21Å; L509-E513 HydrophobicContact CD2-CB 4.03Å; L509-E513 WeakPolarHBondContact CD2-OE2 3.26Å; L509-E514 HydrophobicContact CB-CG 4.08Å; L509-Y517 HydrophobicContact CD1-CD1 4.44Å; L509-Y517 HydrophobicContact CD1-CD2 3.69Å; L509-Y517 HydrophobicContact CD1-CE1 4.48Å; L509-Y517 HydrophobicContact CD1-CE2 3.75Å; L509-Y517 HydrophobicContact CD1-CG 4.06Å; L509-Y517 HydrophobicContact CD2-CD2 4.44Å; L509-Y517 HydrophobicContact CD2-CE2 4.27Å
510	D	77.5	Confident	74	Confident	83 Å²	83	90.2 Å²	90.2	44%	0.444	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-75.3	165.7	173.6	76.2	28.7	0	0	0	111.7	V512 E513 E514	D510-V512 PolarHBondContact O-N 2.84Å; D510-V512 VanDerWaalsContact O-N 3.1Å; D510-V512 WeakPolarHBondContact OD1-CA 3.42Å; D510-V512 WeakPolarHBondContact OD1-CB 3.22Å; D510-V512 PolarHBondContact OD1-N 2.89Å; D510-E513 PolarHBondContact N-OE2 3.44Å; D510-E513 PolarHBondContact O-N 3.16Å; D510-E513 VanDerWaalsContact O-N 3.09Å; D510-E513 WeakPolarHBondContact OD1-CG 3.35Å; D510-E513 PolarHBondContact OD1-N 2.92Å; D510-E514 VanDerWaalsContact O-CG 3.28Å; D510-E514 WeakPolarHBondContact O-CG 3.18Å; D510-E514 PolarHBondContact O-N 3.36Å
511	S	70.6	Confident	71.9	Confident	97 Å²	97	84.1 Å²	84.1	68%	0.678	45%	0.451	S	S	*	.	H	α-helix	trans	-60.3	-25.3	-174.9	59.2	0	0	0	0	114.5	G515	S511-G515 PolarHBondContact O-N 2.88Å
512	V	69.3	Low	69.3	Low	102 Å²	102	81.7 Å²	81.7	62%	0.618	45%	0.449	S	S	*	.	H	α-helix	trans	-75	-47.3	176.5	-175.9	0	0	0	0	109.4	D510 G515 M516	D510-V512 PolarHBondContact O-N 2.84Å; D510-V512 VanDerWaalsContact O-N 3.1Å; D510-V512 WeakPolarHBondContact OD1-CA 3.42Å; D510-V512 WeakPolarHBondContact OD1-CB 3.22Å; D510-V512 PolarHBondContact OD1-N 2.89Å; V512-G515 PolarHBondContact O-N 2.72Å; V512-M516 PolarHBondContact O-N 2.81Å
513	E	64.4	Low	66.6	Low	68 Å²	68	84.5 Å²	84.5	32%	0.318	47%	0.467	S	S	.	.	H	α-helix	trans	-62	-41.5	175.3	-68.2	-173	136.4	0	0	111.5	R451 L509 D510 G515 M516 Y517	R451-E513 IonicContact NH1-OE1 3.97Å; L509-E513 HydrophobicContact CB-CB 4.21Å; L509-E513 HydrophobicContact CD2-CB 4.03Å; L509-E513 WeakPolarHBondContact CD2-OE2 3.26Å; D510-E513 PolarHBondContact N-OE2 3.44Å; D510-E513 PolarHBondContact O-N 3.16Å; D510-E513 VanDerWaalsContact O-N 3.09Å; D510-E513 WeakPolarHBondContact OD1-CG 3.35Å; D510-E513 PolarHBondContact OD1-N 2.92Å; E513-G515 VanDerWaalsContact C-N 3.28Å; E513-G515 PolarHBondContact O-N 2.94Å; E513-M516 PolarHBondContact O-N 3.4Å; E513-Y517 WeakPolarHBondContact O-CB 3.39Å; E513-Y517 PolarHBondContact O-N 2.69Å
514	E	64.8	Low	63.9	Low	44 Å²	44	87.6 Å²	87.6	21%	0.206	47%	0.47	C	S	.	.	H	α-helix	trans	-57.4	-42.7	174.3	-65.2	-165	165.8	0	0	111.1	L453 H454 L509 D510 Y517 K518	L453-E514 HydrophobicContact CD2-CB 4.08Å; L453-E514 HydrophobicContact CD2-CG 3.54Å; H454-E514 IonicContact CE1-OE1 2.67Å; H454-E514 IonicContact CG-OE1 3.95Å; H454-E514 PolarHBondContact N-OE1 3.25Å; H454-E514 IonicContact ND1-OE1 3.69Å; H454-E514 PolarHBondContact ND1-OE1 3.37Å; L509-E514 HydrophobicContact CB-CG 4.08Å; D510-E514 VanDerWaalsContact O-CG 3.28Å; D510-E514 WeakPolarHBondContact O-CG 3.18Å; D510-E514 PolarHBondContact O-N 3.36Å; E514-Y517 WeakPolarHBondContact O-CB 3.41Å; E514-Y517 PolarHBondContact O-N 3.24Å; E514-K518 PolarHBondContact O-N 3.42Å; E514-K518 VanDerWaalsContact O-N 3.07Å
515	G	62.5	Low	61	Low	31 Å²	31	90.7 Å²	90.7	32%	0.32	49%	0.486	S	S	.	.	H	α-helix	trans	-62.8	-42	176.2	0	0	0	0	0	112.9	S511 V512 E513 K519	S511-G515 PolarHBondContact O-N 2.88Å; V512-G515 PolarHBondContact O-N 2.72Å; E513-G515 VanDerWaalsContact C-N 3.28Å; E513-G515 PolarHBondContact O-N 2.94Å; G515-K519 VanDerWaalsContact O-CB 3.3Å; G515-K519 WeakPolarHBondContact O-CB 3.35Å; G515-K519 VanDerWaalsContact O-CG 3.29Å; G515-K519 WeakPolarHBondContact O-CG 3.41Å; G515-K519 PolarHBondContact O-N 2.81Å
516	M	59.4	Low	57.9	Low	125 Å²	125	94 Å²	94	62%	0.616	49%	0.49	S	S	*	.	H	α-helix	trans	-66.8	-40.6	173.8	-71.3	-174.6	68	0	0	111.8	V512 E513 K518 K519 T520	V512-M516 PolarHBondContact O-N 2.81Å; E513-M516 PolarHBondContact O-N 3.4Å; M516-K518 VanDerWaalsContact C-N 3.28Å; M516-K518 PolarHBondContact O-N 2.76Å; M516-K519 PolarHBondContact O-N 3.02Å; M516-K519 VanDerWaalsContact O-N 3.17Å; M516-T520 WeakPolarHBondContact O-CG2 3.37Å; M516-T520 PolarHBondContact O-N 3.08Å; M516-T520 PolarHBondContact O-OG1 2.67Å
517	Y	59.6	Low	54.7	Low	38 Å²	38	94.7 Å²	94.7	15%	0.149	51%	0.508	C	S	.	.	H	α-helix	trans	-58.3	-38.8	178.5	-121	-95	0	0	0	112.6	L423 I427 L509 E513 E514	L423-Y517 HydrophobicContact CD2-CD1 4.28Å; L423-Y517 HydrophobicContact CD2-CE1 4.31Å; I427-Y517 HydrophobicContact CD1-CE2 4.4Å; I427-Y517 WeakPolarHBondContact CD1-OH 3.21Å; L509-Y517 HydrophobicContact CD1-CD1 4.44Å; L509-Y517 HydrophobicContact CD1-CD2 3.69Å; L509-Y517 HydrophobicContact CD1-CE1 4.48Å; L509-Y517 HydrophobicContact CD1-CE2 3.75Å; L509-Y517 HydrophobicContact CD1-CG 4.06Å; L509-Y517 HydrophobicContact CD2-CD2 4.44Å; L509-Y517 HydrophobicContact CD2-CE2 4.27Å; E513-Y517 WeakPolarHBondContact O-CB 3.39Å; E513-Y517 PolarHBondContact O-N 2.69Å; E514-Y517 WeakPolarHBondContact O-CB 3.41Å; E514-Y517 PolarHBondContact O-N 3.24Å
518	K	58.8	Low	51.4	Low	115 Å²	115	100.8 Å²	100.8	50%	0.5	53%	0.527	S	S	.	.	H	α-helix	trans	-78.6	-37.9	174.9	-68.5	-176.7	177.1	-178.7	0	112.3	E514 M516	E514-K518 PolarHBondContact O-N 3.42Å; E514-K518 VanDerWaalsContact O-N 3.07Å; M516-K518 VanDerWaalsContact C-N 3.28Å; M516-K518 PolarHBondContact O-N 2.76Å
519	K	51	Low	48.3	Very low	166 Å²	166	99.9 Å²	99.9	72%	0.722	54%	0.538	S	S	*	.	H	α-helix	trans	-73.9	-31.6	-176.1	-81.5	-179.9	178.3	177.5	0	115.1	G515 M516 G521 G522	G515-K519 VanDerWaalsContact O-CB 3.3Å; G515-K519 WeakPolarHBondContact O-CB 3.35Å; G515-K519 VanDerWaalsContact O-CG 3.29Å; G515-K519 WeakPolarHBondContact O-CG 3.41Å; G515-K519 PolarHBondContact O-N 2.81Å; M516-K519 PolarHBondContact O-N 3.02Å; M516-K519 VanDerWaalsContact O-N 3.17Å; K519-G521 PolarHBondContact O-N 2.91Å; K519-G522 PolarHBondContact O-N 2.68Å
520	T	44.5	Very low	45.6	Very low	105 Å²	105	104.5 Å²	104.5	64%	0.644	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-5	177.7	48.9	0	0	0	0	113.3	M516	M516-T520 WeakPolarHBondContact O-CG2 3.37Å; M516-T520 PolarHBondContact O-N 3.08Å; M516-T520 PolarHBondContact O-OG1 2.67Å
521	G	40.3	Very low	43.4	Very low	27 Å²	27	104.1 Å²	104.1	28%	0.278	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.7	-9.7	166.5	0	0	0	0	0	117.3	R370 K519	R370-G521 VanDerWaalsContact NH1-CA 3.31Å; R370-G521 VanDerWaalsContact NH2-N 3.2Å; K519-G521 PolarHBondContact O-N 2.91Å
522	G	28.4	Very low	41.5	Very low	36 Å²	36	104 Å²	104	37%	0.371	58%	0.579	S	S	.	*	S	Bend	trans	-95.7	-12.8	-171	0	0	0	0	0	116.4	K519 H524 Q525	K519-G522 PolarHBondContact O-N 2.68Å; G522-H524 PolarHBondContact O-N 2.82Å; G522-Q525 PolarHBondContact O-N 3.25Å
523	N	26.9	Very low	39.8	Very low	146 Å²	146	106.8 Å²	106.8	78%	0.781	59%	0.585	S	S	*	*			trans	-98.2	30.8	-168.3	-79.9	1.7	0	0	0	115.4	Q525	N523-Q525 VanDerWaalsContact C-N 3.3Å
524	H	28.3	Very low	38.3	Very low	199 Å²	199	106.7 Å²	106.7	92%	0.921	60%	0.596	S	S	*	*			trans	-101.1	37.2	148.4	-76.4	-62.4	0	0	0	110.6	G522 E526	G522-H524 PolarHBondContact O-N 2.82Å; H524-E526 PolarHBondContact O-N 3.47Å
525	Q	25.2	Very low	36.8	Very low	133 Å²	133	110.1 Å²	110.1	62%	0.621	61%	0.614	S	S	*	*			trans	-78.4	99.1	155.6	-80.4	177.2	-10.7	0	0	107.2	G522 N523	G522-Q525 PolarHBondContact O-N 3.25Å; N523-Q525 VanDerWaalsContact C-N 3.3Å
526	E	24.8	Very low	35.5	Very low	173 Å²	173	117.7 Å²	117.7	81%	0.808	63%	0.633	S	S	*	*			trans	-36	133.5	155.3	-130.4	167.4	-167.8	0	0	109.2	H524 R528	H524-E526 PolarHBondContact O-N 3.47Å; E526-R528 PolarHBondContact O-N 3.35Å
527	P	24.8	Very low	34.5	Very low	121 Å²	121	117.7 Å²	117.7	79%	0.786	64%	0.636	S	S	*	*			trans	-54.3	122.9	-174.4	12.7	-20.2	0	0	0	108.7	G529	P527-G529 PolarHBondContact O-N 2.94Å
528	R	23.5	Very low	33.6	Very low	223 Å²	223	119.4 Å²	119.4	84%	0.842	65%	0.653	S	S	*	*			trans	-64.3	71.9	164.5	-70.9	-176.4	-171.1	179.4	3.1	108	E526 S530	E526-R528 PolarHBondContact O-N 3.35Å; R528-S530 PolarHBondContact O-N 3.21Å
529	G	26.2	Very low	32.4	Very low	64 Å²	64	122.6 Å²	122.6	66%	0.66	66%	0.662	S	S	*	*			trans	-72.6	106.7	166.5	0	0	0	0	0	107.5	P527	P527-G529 PolarHBondContact O-N 2.94Å
530	S	27.5	Very low	32.1	Very low	98 Å²	98	121.3 Å²	121.3	69%	0.685	66%	0.66	S	S	*	*	S	Bend	trans	34.8	104.5	141.4	-174.5	0	0	0	0	116.5	R528	R528-S530 PolarHBondContact O-N 3.21Å
531	S	30.2	Very low	32	Very low	76 Å²	76	118.9 Å²	118.9	53%	0.531	65%	0.651	S	S	.	*			trans	24.8	116.6	149.3	57.1	0	0	0	0	117.5	E533 A534	S531-E533 PolarHBondContact O-N 3.34Å; S531-A534 PolarHBondContact O-N 2.9Å
532	A	30.5	Very low	31.8	Very low	94 Å²	94	121.6 Å²	121.6	78%	0.777	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	13.5	169	0	0	0	0	0	115.6
533	E	34	Very low	32.2	Very low	160 Å²	160	126.9 Å²	126.9	75%	0.748	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-19.6	175.9	-72	-177.1	154.1	0	0	113.2	S531	S531-E533 PolarHBondContact O-N 3.34Å
534	A	32.7	Very low	33	Very low	66 Å²	66	122.9 Å²	122.9	55%	0.545	67%	0.665	S	S	.	*	S	Bend	trans	-80.8	-30.9	178	0	0	0	0	0	113.4	S531	S531-A534 PolarHBondContact O-N 2.9Å
535	I	33.1	Very low	33.6	Very low	116 Å²	116	119 Å²	119	60%	0.595	65%	0.651	S	S	*	*	H	α-helix	trans	-77.9	-25	-175.2	-60	176.2	0	0	0	111.8	N537 S538	I535-N537 VanDerWaalsContact C-N 3.26Å; I535-N537 PolarHBondContact O-N 3.27Å; I535-S538 PolarHBondContact O-N 3.04Å
536	R	35	Very low	34.3	Very low	191 Å²	191	118 Å²	118	72%	0.721	65%	0.648	S	S	*	*	H	α-helix	trans	-69.1	-24	178.9	-157.5	173.4	171.9	-165.7	-3.8	113.1
537	N	40.2	Very low	34.9	Very low	125 Å²	125	116.8 Å²	116.8	67%	0.668	64%	0.641	S	S	*	*	H	α-helix	trans	-88.5	-13.5	179.4	-74.7	-2.8	0	0	0	114.3	I535	I535-N537 VanDerWaalsContact C-N 3.26Å; I535-N537 PolarHBondContact O-N 3.27Å
538	S	40.3	Very low	35.8	Very low	73 Å²	73	115.8 Å²	115.8	51%	0.51	63%	0.633	S	S	.	*	H	α-helix	trans	-86.4	-29.8	175	-166.9	0	0	0	0	112.5	I535 M540 A541 C542	I535-S538 PolarHBondContact O-N 3.04Å; S538-M540 PolarHBondContact O-N 2.73Å; S538-A541 PolarHBondContact O-N 3.38Å; S538-C542 PolarHBondContact O-N 3.16Å
539	W	34.2	Very low	36.5	Very low	182 Å²	182	111.3 Å²	111.3	69%	0.689	63%	0.625	S	S	*	*	H	α-helix	trans	-71.4	-30.3	179.7	-79.3	60.1	0	0	0	113.6	A541 F543	W539-A541 VanDerWaalsContact C-N 3.32Å; W539-F543 PolarHBondContact O-N 2.76Å
540	M	42.8	Very low	37	Very low	139 Å²	139	114.3 Å²	114.3	69%	0.685	63%	0.625	S	S	*	*	H	α-helix	trans	-73.6	-22.9	172.5	-78.8	-153.4	-104.5	0	0	113.3	S538	S538-M540 PolarHBondContact O-N 2.73Å
541	A	42.6	Very low	37.5	Very low	55 Å²	55	116.1 Å²	116.1	46%	0.455	63%	0.626	S	S	.	*	H	α-helix	trans	-76.5	-34.6	175.8	0	0	0	0	0	112.4	S538 W539 A544	S538-A541 PolarHBondContact O-N 3.38Å; W539-A541 VanDerWaalsContact C-N 3.32Å; A541-A544 PolarHBondContact O-N 2.98Å
542	C	37.4	Very low	37.9	Very low	83 Å²	83	117.1 Å²	117.1	56%	0.561	63%	0.633	S	S	*	*	H	α-helix	trans	-73.5	-30.3	178.6	-79.2	0	0	0	0	113.7	S538 A544	S538-C542 PolarHBondContact O-N 3.16Å; C542-A544 VanDerWaalsContact C-N 3.34Å
543	F	37.2	Very low	38.1	Very low	147 Å²	147	117.2 Å²	117.2	65%	0.645	63%	0.628	S	S	*	*	H	α-helix	trans	-73.5	-24.4	175	-94.7	-83.5	0	0	0	113.5	W539	W539-F543 PolarHBondContact O-N 2.76Å
544	A	42.7	Very low	38.2	Very low	63 Å²	63	115.7 Å²	115.7	52%	0.521	63%	0.63	S	S	.	*	H	α-helix	trans	-75.8	-28.1	176.4	0	0	0	0	0	113.3	A541 C542 T548	A541-A544 PolarHBondContact O-N 2.98Å; C542-A544 VanDerWaalsContact C-N 3.34Å; A544-T548 PolarHBondContact O-OG1 2.77Å; A544-T548 VanDerWaalsContact O-OG1 3.04Å
545	L	40.1	Very low	38.3	Very low	118 Å²	118	121.9 Å²	121.9	62%	0.618	64%	0.644	S	S	*	*	H	α-helix	trans	-82.6	-27.1	-179.5	-108.2	117.7	0	0	0	114	T548	L545-T548 PolarHBondContact O-OG1 2.64Å
546	I	40.9	Very low	38.3	Very low	110 Å²	110	121.8 Å²	121.8	56%	0.564	65%	0.654	S	S	*	*	H	α-helix	trans	-77.6	-29.2	177.7	-63.6	175.3	0	0	0	111.3	L550	I546-L550 HydrophobicContact CG2-CD1 4.21Å
547	F	37	Very low	38.3	Very low	148 Å²	148	127.6 Å²	127.6	65%	0.649	68%	0.678	S	S	*	*	H	α-helix	trans	-77	-19.8	177.8	-111.6	-87.2	0	0	0	114.4	L551	F547-L551 HydrophobicContact CD1-CD1 4.44Å
548	T	43.2	Very low	38.2	Very low	101 Å²	101	127.8 Å²	127.8	62%	0.62	68%	0.679	S	S	*	*	H	α-helix	trans	-86.3	-17.2	177.9	33.3	0	0	0	0	113.5	A544 L545	A544-T548 PolarHBondContact O-OG1 2.77Å; A544-T548 VanDerWaalsContact O-OG1 3.04Å; L545-T548 PolarHBondContact O-OG1 2.64Å
549	L	38.4	Very low	38.1	Very low	128 Å²	128	130.6 Å²	130.6	67%	0.67	69%	0.687	S	S	*	*	H	α-helix	trans	-93.4	-14.4	177.5	-86.6	152.7	0	0	0	114.6
550	L	36.9	Very low	38.3	Very low	127 Å²	127	127.8 Å²	127.8	67%	0.665	69%	0.687	S	S	*	*	S	Bend	trans	-93.6	-4.2	179.8	-86	157.9	0	0	0	114.9	I546	I546-L550 HydrophobicContact CG2-CD1 4.21Å
551	L	38.4	Very low	38.1	Very low	136 Å²	136	127.1 Å²	127.1	71%	0.712	69%	0.688	S	S	*	*	S	Bend	trans	-110.3	3.6	-178.8	-86.3	154.6	0	0	0	115.1	F547	F547-L551 HydrophobicContact CD1-CD1 4.44Å
552	S	37.7	Very low	37.8	Very low	97 Å²	97	131.6 Å²	131.6	68%	0.678	70%	0.702	S	S	*	*	S	Bend	trans	-103.2	4.6	178.3	62.9	0	0	0	0	115.6
553	S	34.8	Very low	37.8	Very low	97 Å²	97	134.9 Å²	134.9	68%	0.678	71%	0.711	S	S	*	*	S	Bend	trans	-109	12.6	178.1	61.8	0	0	0	0	114.9
554	V	37.5	Very low	37.9	Very low	128 Å²	128	134 Å²	134	78%	0.776	72%	0.716	S	S	*	*			trans	-105.7	72.1	169.6	-170.5	0	0	0	0	109.1
555	K	34.3	Very low	37.5	Very low	196 Å²	196	139.5 Å²	139.5	85%	0.852	73%	0.731	S	S	*	*	S	Bend	trans	-160.1	124.5	158.6	-109.4	171.4	-172.7	-179.1	0	108.9
556	S	33.6	Very low	37.3	Very low	114 Å²	114	141.3 Å²	141.3	80%	0.797	74%	0.741	S	S	*	*			trans	83.4	74.2	172.9	-49.8	0	0	0	0	116.4
557	Y	35	Very low	37	Very low	313 Å²	313	144.1 Å²	144.1	100%	1.227	76%	0.757	S	S	*	*				-148.9	0	121.2	-104.3	-76.5	0	0	0	109.7

Retrieved 557 of 557 residues in 438.4 ms (Link to these results)

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