A0A087XPJ2_POEFO Loading...

receptor protein-tyrosine kinase

AlphaFold DB , UniProt , Accession A0A087XPJ2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 775 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	P	36.4	Very low	29.7	Very low	180 Å²	180	154.2 Å²	154.2	100%	1.169	84%	0.837	S	S	*	*				0	72.3	0	29.8	-8.7	0	0	0	110.9
2	E	30.6	Very low	31.8	Very low	196 Å²	196	154.5 Å²	154.5	92%	0.916	84%	0.835	S	S	*	*			trans	-174.6	67.4	165.2	-113.8	174	-166	0	0	108.1
3	Q	28	Very low	34.2	Very low	192 Å²	192	146.5 Å²	146.5	90%	0.897	79%	0.791	S	S	*	*			trans	-159.2	56.2	176.7	-121.8	-177.9	14.2	0	0	109.4
4	N	29.8	Very low	37.2	Very low	159 Å²	159	138.9 Å²	138.9	85%	0.85	75%	0.754	S	S	*	*			trans	-162.1	40.6	173.2	-118.8	-2.5	0	0	0	114.7
5	Q	26.4	Very low	40.5	Very low	184 Å²	184	131.8 Å²	131.8	86%	0.86	72%	0.718	S	S	*	*			trans	-141.1	78.1	170.2	-72.1	-170.9	-6.1	0	0	110.3
6	N	25.5	Very low	43.6	Very low	156 Å²	156	125.8 Å²	125.8	83%	0.834	68%	0.684	S	S	*	*	S	Bend	trans	-170.2	46.8	161.1	-102.7	-15.1	0	0	0	112.8
7	L	29.9	Very low	46.6	Very low	146 Å²	146	121.9 Å²	121.9	76%	0.764	67%	0.665	S	S	*	*	S	Bend	trans	-127.8	12	173.5	-90.4	166.6	0	0	0	113.6
8	S	26.5	Very low	49.2	Very low	120 Å²	120	116.7 Å²	116.7	84%	0.839	64%	0.636	S	S	*	*	S	Bend	trans	-114.7	33.8	-175.6	61.9	0	0	0	0	113.5
9	S	25.9	Very low	51.6	Low	98 Å²	98	112.1 Å²	112.1	69%	0.685	61%	0.61	S	S	*	*			trans	-151.9	54.6	169.4	70.7	0	0	0	0	112.6	S11	S9-S11 VanDerWaalsContact C-N 3.26Å; S9-S11 PolarHBondContact O-N 2.75Å
10	F	33.3	Very low	53.8	Low	175 Å²	175	107.9 Å²	107.9	77%	0.768	59%	0.587	S	S	*	*			trans	-65.1	98.4	151.5	-91.3	-82.7	0	0	0	107	I12	F10-I12 PolarHBondContact O-N 2.8Å
11	S	34.7	Very low	55.6	Low	90 Å²	90	103 Å²	103	63%	0.629	56%	0.561	S	S	*	*			trans	-50.4	125.1	163.8	42.4	0	0	0	0	107.7	S9 L13	S9-S11 VanDerWaalsContact C-N 3.26Å; S9-S11 PolarHBondContact O-N 2.75Å; S11-L13 VanDerWaalsContact C-N 3.35Å; S11-L13 PolarHBondContact O-N 2.72Å
12	I	54.2	Low	58.1	Low	158 Å²	158	97.4 Å²	97.4	81%	0.81	52%	0.518	S	S	*	.			trans	-63.9	101	-179.3	-61.4	172.1	0	0	0	106.8	F10	F10-I12 PolarHBondContact O-N 2.8Å
13	L	63.6	Low	60.8	Low	50 Å²	50	94.3 Å²	94.3	26%	0.262	51%	0.507	S	S	.	.			trans	-59	129.2	-178.2	-76.2	154.9	0	0	0	108.6	S11 S15	S11-L13 VanDerWaalsContact C-N 3.35Å; S11-L13 PolarHBondContact O-N 2.72Å; L13-S15 WeakPolarHBondContact O-CB 3.01Å; L13-S15 PolarHBondContact O-N 2.59Å; L13-S15 PolarHBondContact O-OG 2.86Å
14	P	76.2	Confident	63.4	Low	41 Å²	41	89.1 Å²	89.1	27%	0.266	48%	0.483	S	S	.	.			trans	-63	111.8	-172.3	27.3	-35.8	0	0	0	109.5	K187 P189 G237	P14-K187 WeakPolarHBondContact CB-O 3.11Å; P14-K187 WeakPolarHBondContact CG-O 3.42Å; P14-K187 PolarHBondContact O-N 3.42Å; P14-K187 VanDerWaalsContact O-N 3.1Å; P14-P189 HydrophobicContact CB-CG 4.23Å; P14-P189 HydrophobicContact CG-CG 4.48Å; P14-G237 WeakPolarHBondContact CG-O 3.48Å
15	S	86.1	Confident	65.4	Low	32 Å²	32	88 Å²	88	22%	0.224	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	147.9	-170	47.2	0	0	0	0	110.5	L13 F185	L13-S15 WeakPolarHBondContact O-CB 3.01Å; L13-S15 PolarHBondContact O-N 2.59Å; L13-S15 PolarHBondContact O-OG 2.86Å; S15-F185 CarbonylContact C-O 3.54Å; S15-F185 WeakPolarHBondContact CA-O 3.24Å; S15-F185 VanDerWaalsContact CB-O 3.23Å; S15-F185 WeakPolarHBondContact CB-O 3.42Å
16	E	91.2	Very high	68	Low	35 Å²	35	82.3 Å²	82.3	16%	0.164	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	123.3	175.7	-178	169.2	153.3	0	0	109.2	R77 F184 F185 K187	E16-R77 WeakPolarHBondContact OE1-CD 3.36Å; E16-R77 IonicContact OE1-CZ 2.66Å; E16-R77 VanDerWaalsContact OE1-CZ 3.27Å; E16-R77 IonicContact OE1-NE 3.54Å; E16-R77 PolarHBondContact OE1-NE 2.94Å; E16-R77 IonicContact OE1-NH1 3.44Å; E16-R77 PolarHBondContact OE1-NH1 2.78Å; E16-F184 CarbonylContact O-C 3.58Å; E16-F184 WeakPolarHBondContact O-CA 3.39Å; E16-F184 VanDerWaalsContact O-CB 3.25Å; E16-F184 WeakPolarHBondContact O-CB 3.49Å; E16-F185 HydrophobicContact CB-CD1 4.14Å; E16-F185 HydrophobicContact CB-CE1 3.61Å; E16-F185 HydrophobicContact CB-CE2 4.03Å; E16-F185 HydrophobicContact CB-CZ 3.56Å; E16-F185 VanDerWaalsContact CD-CZ 3.46Å; E16-F185 HydrophobicContact CG-CE1 3.75Å; E16-F185 HydrophobicContact CG-CZ 3.86Å; E16-F185 PolarHBondContact N-O 2.92Å; E16-F185 PolarHBondContact O-N 3.17Å; E16-F185 WeakPolarHBondContact OE2-CZ 3.45Å; E16-K187 HydrophobicContact CB-CD 4.11Å; E16-K187 IonicContact OE2-NZ 3.07Å; E16-K187 PolarHBondContact OE2-NZ 2.73Å
17	V	93.8	Very high	70.7	Confident	61 Å²	61	77.9 Å²	77.9	37%	0.37	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	126.5	-176.5	179.1	0	0	0	0	109.2	M19 N20 R182 F184	V17-M19 WeakPolarHBondContact CG1-O 3.1Å; V17-N20 HydrophobicContact CG1-CB 3.77Å; V17-R182 HydrophobicContact CG1-CG 4.34Å; V17-F184 HydrophobicContact CG2-CB 4.24Å
18	L	94.5	Very high	73.3	Confident	28 Å²	28	71.5 Å²	71.5	15%	0.147	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-32	-179.9	-62	176.4	0	0	0	112.3	I74 P75 R77 L82 V183 F185	L18-I74 HydrophobicContact CB-CG2 3.73Å; L18-I74 HydrophobicContact CD1-CG2 4.39Å; L18-P75 WeakPolarHBondContact CD1-O 3.37Å; L18-P75 WeakPolarHBondContact CD2-O 3.35Å; L18-R77 HydrophobicContact CD2-CG 4.01Å; L18-L82 HydrophobicContact CD1-CD1 3.75Å; L18-L82 HydrophobicContact CD1-CD2 3.47Å; L18-L82 VanDerWaalsContact CD1-CD2 3.47Å; L18-L82 HydrophobicContact CD1-CG 4.28Å; L18-V183 PolarHBondContact N-O 3.09Å; L18-F185 HydrophobicContact CD1-CD1 4.02Å; L18-F185 HydrophobicContact CD2-CD1 4.22Å; L18-F185 HydrophobicContact CD2-CE1 3.93Å; L18-F185 HydrophobicContact CG-CD1 4.1Å; L18-F185 HydrophobicContact CG-CE1 4.32Å
19	M	94.8	Very high	76.3	Confident	29 Å²	29	74.1 Å²	74.1	14%	0.143	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	141	173	-173.8	-179.8	69.9	0	0	108.7	V17 W30 T71 I74 V181 R182 V183	V17-M19 WeakPolarHBondContact CG1-O 3.1Å; M19-W30 HydrophobicContact CE-CH2 4.2Å; M19-W30 HydrophobicContact CE-CZ2 3.89Å; M19-W30 HydrophobicContact SD-CZ2 3.87Å; M19-T71 HydrophobicContact CE-CG2 4.09Å; M19-T71 HydrophobicContact SD-CG2 4.37Å; M19-I74 HydrophobicContact CB-CD1 4.3Å; M19-I74 HydrophobicContact CE-CD1 3.81Å; M19-I74 HydrophobicContact SD-CD1 3.85Å; M19-I74 HydrophobicContact SD-CG1 4.27Å; M19-V181 HydrophobicContact CE-CB 4.1Å; M19-V181 HydrophobicContact CE-CG1 3.64Å; M19-R182 CarbonylContact O-C 3.56Å; M19-R182 VanDerWaalsContact O-CA 3.3Å; M19-R182 WeakPolarHBondContact O-CA 3.37Å; M19-V183 HydrophobicContact CB-CB 4.2Å; M19-V183 HydrophobicContact CB-CG2 4.38Å; M19-V183 HydrophobicContact CE-CG2 3.83Å; M19-V183 PolarHBondContact N-O 3Å; M19-V183 PolarHBondContact O-N 3.4Å
20	N	93.9	Very high	79.6	Confident	27 Å²	27	70.5 Å²	70.5	14%	0.144	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	102	169.6	-178	2.6	0	0	0	110.6	V17 K22 L23 V181 R182	V17-N20 HydrophobicContact CG1-CB 3.77Å; N20-K22 PolarHBondContact O-N 3.44Å; N20-K22 VanDerWaalsContact O-N 3.09Å; N20-K22 VanDerWaalsContact OD1-CB 3.3Å; N20-K22 WeakPolarHBondContact OD1-CB 3.18Å; N20-K22 PolarHBondContact OD1-N 3.07Å; N20-K22 VanDerWaalsContact OD1-N 3.15Å; N20-L23 HydrophobicContact CB-CD1 4.2Å; N20-L23 HydrophobicContact CB-CG 4.33Å; N20-L23 PolarHBondContact O-N 2.85Å; N20-V181 WeakPolarHBondContact CA-O 3.07Å; N20-R182 HydrophobicContact CB-CB 4.43Å; N20-R182 HydrophobicContact CB-CG 4.32Å
21	T	92.8	Very high	82.5	Confident	5 Å²	5	63.8 Å²	63.8	3%	0.031	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-64.2	-17.1	-176.5	65.8	0	0	0	0	113.7	L23 E24 L28 W30 A180 V181	T21-L23 PolarHBondContact O-N 2.91Å; T21-E24 PolarHBondContact O-N 3.3Å; T21-L28 HydrophobicContact CG2-CD1 3.82Å; T21-L28 HydrophobicContact CG2-CD2 4.13Å; T21-W30 HydrophobicContact CG2-CH2 3.85Å; T21-W30 HydrophobicContact CG2-CZ2 3.54Å; T21-A180 WeakPolarHBondContact OG1-CA 3.39Å; T21-V181 HydrophobicContact CG2-CB 4.28Å; T21-V181 PolarHBondContact N-O 2.89Å; T21-V181 PolarHBondContact OG1-N 3.02Å
22	K	89.2	Confident	85.4	Confident	64 Å²	64	60.6 Å²	60.6	28%	0.278	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-67.4	-22.6	173.6	-161.6	-174.6	178.2	-176	0	112.6	N20 D47 D49 V53	N20-K22 PolarHBondContact O-N 3.44Å; N20-K22 VanDerWaalsContact O-N 3.09Å; N20-K22 VanDerWaalsContact OD1-CB 3.3Å; N20-K22 WeakPolarHBondContact OD1-CB 3.18Å; N20-K22 PolarHBondContact OD1-N 3.07Å; N20-K22 VanDerWaalsContact OD1-N 3.15Å; K22-D47 WeakPolarHBondContact CE-OD2 3.48Å; K22-D47 IonicContact NZ-OD2 3.66Å; K22-D47 PolarHBondContact NZ-OD2 3.26Å; K22-D49 IonicContact NZ-OD2 2.87Å; K22-D49 PolarHBondContact NZ-OD2 2.91Å; K22-V53 HydrophobicContact CG-CG1 3.98Å
23	L	86.1	Confident	87.2	Confident	130 Å²	130	56 Å²	56	68%	0.681	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-97.8	-4.8	-179.4	-58.9	178	0	0	0	113.1	N20 T21	N20-L23 HydrophobicContact CB-CD1 4.2Å; N20-L23 HydrophobicContact CB-CG 4.33Å; N20-L23 PolarHBondContact O-N 2.85Å; T21-L23 PolarHBondContact O-N 2.91Å
24	E	82.9	Confident	88.6	Confident	84 Å²	84	55.1 Å²	55.1	39%	0.393	29%	0.289	S	S	.	.			trans	-85.8	116	-176.4	-70	-66.8	170.3	0	0	111.1	T21 L28	T21-E24 PolarHBondContact O-N 3.3Å; E24-L28 HydrophobicContact CB-CD2 3.66Å; E24-L28 HydrophobicContact CG-CD2 3.69Å
25	T	72.1	Confident	89.2	Confident	134 Å²	134	55.9 Å²	55.9	82%	0.822	30%	0.3	S	S	*	.			trans	-92.2	-6.6	-179.5	58	0	0	0	0	113.3
26	S	80.8	Confident	89.3	Confident	65 Å²	65	61.7 Å²	61.7	46%	0.455	33%	0.328	S	S	.	.	S	Bend	trans	-113.5	167.9	-179	73.9	0	0	0	0	111.7	L28	S26-L28 PolarHBondContact O-N 2.82Å
27	D	81.7	Confident	89.1	Confident	63 Å²	63	62.7 Å²	62.7	34%	0.337	34%	0.335	S	S	.	.			trans	-62.4	129.3	178.3	-43.5	-45.2	0	0	0	110.5	R29 E42 R54 R72	D27-R29 VanDerWaalsContact C-N 3.33Å; D27-R29 HydrophobicContact CB-CG 3.86Å; D27-R29 PolarHBondContact O-N 3.25Å; D27-R29 IonicContact OD2-NE 3.18Å; D27-R29 IonicContact OD2-NH2 2.73Å; D27-E42 VanDerWaalsContact CA-OE1 3.28Å; D27-E42 WeakPolarHBondContact CA-OE1 3.38Å; D27-R54 IonicContact OD1-CZ 3.73Å; D27-R54 IonicContact OD1-NH1 3.24Å; D27-R54 PolarHBondContact OD1-NH1 2.97Å; D27-R54 IonicContact OD1-NH2 3.91Å; D27-R54 PolarHBondContact OD1-NH2 3Å; D27-R72 PolarHBondContact O-NH2 2.95Å
28	L	86.1	Confident	88.9	Confident	12 Å²	12	65.2 Å²	65.2	6%	0.063	34%	0.342	C	S	.	.			trans	-67.5	-36.5	-178.3	-66.6	173.3	0	0	0	110.9	T21 E24 S26 W30 E42 R54 F56 R72	T21-L28 HydrophobicContact CG2-CD1 3.82Å; T21-L28 HydrophobicContact CG2-CD2 4.13Å; E24-L28 HydrophobicContact CB-CD2 3.66Å; E24-L28 HydrophobicContact CG-CD2 3.69Å; S26-L28 PolarHBondContact O-N 2.82Å; L28-W30 VanDerWaalsContact C-N 3.31Å; L28-W30 HydrophobicContact CB-CG 4.4Å; L28-W30 PolarHBondContact O-N 2.89Å; L28-E42 PolarHBondContact N-OE1 3.47Å; L28-E42 PolarHBondContact N-OE2 2.9Å; L28-R54 HydrophobicContact CD1-CB 3.7Å; L28-R54 HydrophobicContact CG-CB 3.93Å; L28-R54 HydrophobicContact CG-CG 4.47Å; L28-F56 HydrophobicContact CB-CE2 4.03Å; L28-F56 HydrophobicContact CB-CZ 4.05Å; L28-F56 HydrophobicContact CD1-CD2 4.35Å; L28-F56 HydrophobicContact CD1-CE2 3.58Å; L28-F56 HydrophobicContact CD1-CZ 4.37Å; L28-F56 HydrophobicContact CG-CE2 4.45Å; L28-R72 PolarHBondContact O-NE 2.8Å; L28-R72 PolarHBondContact O-NH2 3.14Å
29	R	88.3	Confident	88.8	Confident	176 Å²	176	67.1 Å²	67.1	66%	0.664	35%	0.35	S	S	*	.			trans	52.4	48.7	178.5	-54.2	-177.7	-177.4	-172.6	-1.1	112.1	D27 E42	D27-R29 VanDerWaalsContact C-N 3.33Å; D27-R29 HydrophobicContact CB-CG 3.86Å; D27-R29 PolarHBondContact O-N 3.25Å; D27-R29 IonicContact OD2-NE 3.18Å; D27-R29 IonicContact OD2-NH2 2.73Å; R29-E42 PolarHBondContact N-OE2 2.76Å
30	W	94.4	Very high	88.8	Confident	21 Å²	21	66 Å²	66	8%	0.08	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-69.8	152.5	170.9	-71.9	7.8	0	0	0	109.7	M19 T21 L28 F56 L69 R70 T71 F169 V181	M19-W30 HydrophobicContact CE-CH2 4.2Å; M19-W30 HydrophobicContact CE-CZ2 3.89Å; M19-W30 HydrophobicContact SD-CZ2 3.87Å; T21-W30 HydrophobicContact CG2-CH2 3.85Å; T21-W30 HydrophobicContact CG2-CZ2 3.54Å; L28-W30 VanDerWaalsContact C-N 3.31Å; L28-W30 HydrophobicContact CB-CG 4.4Å; L28-W30 PolarHBondContact O-N 2.89Å; W30-F56 HydrophobicContact CB-CE1 4.28Å; W30-F56 HydrophobicContact CB-CE2 4.17Å; W30-F56 HydrophobicContact CB-CZ 3.66Å; W30-F56 HydrophobicContact CD2-CD2 4.41Å; W30-F56 AromaticContact CD2-CE2 3.6Å; W30-F56 HydrophobicContact CD2-CE2 3.6Å; W30-F56 HydrophobicContact CD2-CZ 4.04Å; W30-F56 AromaticContact CE3-CD2 3.85Å; W30-F56 HydrophobicContact CE3-CD2 3.85Å; W30-F56 AromaticContact CE3-CE2 3.49Å; W30-F56 HydrophobicContact CE3-CE2 3.49Å; W30-F56 VanDerWaalsContact CE3-CE2 3.49Å; W30-F56 HydrophobicContact CE3-CZ 4.16Å; W30-F56 AromaticContact CG-CE2 3.92Å; W30-F56 HydrophobicContact CG-CE2 3.92Å; W30-F56 AromaticContact CG-CZ 3.86Å; W30-F56 HydrophobicContact CG-CZ 3.86Å; W30-F56 HydrophobicContact CZ3-CD2 4.1Å; W30-F56 HydrophobicContact CZ3-CE2 4.07Å; W30-L69 HydrophobicContact CB-CD1 3.62Å; W30-L69 HydrophobicContact CB-CG 4.31Å; W30-L69 HydrophobicContact CE3-CD1 4.37Å; W30-L69 HydrophobicContact CE3-CD2 3.87Å; W30-L69 HydrophobicContact CE3-CG 3.94Å; W30-L69 HydrophobicContact CZ3-CD2 4.37Å; W30-R70 CarbonylContact C-O 3.57Å; W30-R70 WeakPolarHBondContact CA-O 3.48Å; W30-R70 WeakPolarHBondContact CB-O 3.04Å; W30-T71 HydrophobicContact CD2-CG2 4Å; W30-T71 HydrophobicContact CE3-CG2 4.07Å; W30-T71 HydrophobicContact CH2-CG2 3.75Å; W30-T71 HydrophobicContact CZ2-CG2 3.64Å; W30-T71 HydrophobicContact CZ3-CG2 3.96Å; W30-F169 HydrophobicContact CE3-CE2 4.42Å; W30-F169 HydrophobicContact CH2-CE2 4.2Å; W30-F169 HydrophobicContact CZ3-CD2 4.17Å; W30-F169 AromaticContact CZ3-CE2 3.64Å; W30-F169 HydrophobicContact CZ3-CE2 3.64Å; W30-F169 HydrophobicContact CZ3-CZ 4.37Å; W30-V181 HydrophobicContact CH2-CB 4.06Å; W30-V181 HydrophobicContact CH2-CG2 3.88Å; W30-V181 HydrophobicContact CZ3-CG2 4.38Å
31	T	95.3	Very high	88.8	Confident	34 Å²	34	70.1 Å²	70.1	21%	0.209	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	127.3	-171.7	-45.8	0	0	0	0	110.6	L69 R70 P119 W124	T31-L69 CarbonylContact O-C 3.47Å; T31-L69 WeakPolarHBondContact O-CA 3.31Å; T31-R70 PolarHBondContact N-O 3.48Å; T31-R70 PolarHBondContact O-N 3.12Å; T31-R70 PolarHBondContact OG1-NH2 3.25Å; T31-R70 VanDerWaalsContact OG1-NH2 3.14Å; T31-P119 HydrophobicContact CG2-CB 4.44Å; T31-W124 HydrophobicContact CG2-CH2 4.24Å; T31-W124 HydrophobicContact CG2-CZ2 3.75Å; T31-W124 WeakPolarHBondContact O-CH2 3.19Å
32	N	94.6	Very high	88.8	Confident	23 Å²	23	72.5 Å²	72.5	12%	0.123	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	146	177.5	-77.2	-24.6	0	0	0	112.4	Q38 W40 L69	N32-Q38 HydrophobicContact CB-CB 4.28Å; N32-Q38 HydrophobicContact CB-CG 3.88Å; N32-Q38 PolarHBondContact ND2-OE1 3.09Å; N32-Q38 VanDerWaalsContact ND2-OE1 3.11Å; N32-W40 PolarHBondContact ND2-O 3.43Å; N32-W40 VanDerWaalsContact OD1-CB 3.31Å; N32-W40 WeakPolarHBondContact OD1-CB 3.45Å; N32-L69 VanDerWaalsContact OD1-CD1 3.23Å; N32-L69 WeakPolarHBondContact OD1-CD1 3.25Å
33	H	93.9	Very high	88.9	Confident	63 Å²	63	72.6 Å²	72.6	29%	0.292	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	136.8	167.5	-178.1	87.9	0	0	0	111.8	Y67 W68 W124	H33-Y67 CarbonylContact O-C 3.52Å; H33-Y67 WeakPolarHBondContact O-CA 3.38Å; H33-W68 HydrophobicContact CB-CB 4.29Å; H33-W68 PolarHBondContact N-O 3.47Å; H33-W68 PolarHBondContact O-N 2.77Å; H33-W124 HydrophobicContact CB-CB 4.43Å; H33-W124 HydrophobicContact CB-CD2 3.48Å; H33-W124 VanDerWaalsContact CB-CD2 3.48Å; H33-W124 VanDerWaalsContact CB-CE2 3.49Å; H33-W124 HydrophobicContact CB-CE3 3.94Å; H33-W124 HydrophobicContact CB-CG 3.72Å; H33-W124 HydrophobicContact CB-CH2 4.28Å; H33-W124 HydrophobicContact CB-CZ2 3.92Å; H33-W124 HydrophobicContact CB-CZ3 4.31Å; H33-W124 AromaticContact CD2-CG 3.73Å; H33-W124 AromaticContact CE1-CD1 3.74Å; H33-W124 AromaticContact CG-CD1 3.46Å; H33-W124 VanDerWaalsContact CG-CD1 3.46Å; H33-W124 AromaticContact CG-CD2 3.78Å; H33-W124 AromaticContact CG-CE2 3.99Å; H33-W124 AromaticContact CG-CG 3.41Å; H33-W124 VanDerWaalsContact CG-CG 3.41Å; H33-W124 AromaticContact CG-NE1 3.81Å; H33-W124 AromaticContact ND1-CD1 3.23Å; H33-W124 AromaticContact ND1-CG 3.67Å; H33-W124 AromaticContact ND1-NE1 3.63Å
34	P	92.1	Very high	89	Confident	30 Å²	30	70.1 Å²	70.1	20%	0.195	37%	0.37	C	S	.	.	S	Bend	cis	-61.3	151	-2.9	-21.5	35	0	0	0	113.2	D36 D37	P34-D36 WeakPolarHBondContact CB-OD1 3.46Å; P34-D37 HydrophobicContact CB-CB 4.46Å; P34-D37 CarbonylContact O-C 3.49Å
35	A	87.9	Confident	89	Confident	58 Å²	58	67.1 Å²	67.1	48%	0.479	36%	0.362	S	S	.	.	S	Bend	trans	-82	-22.4	-174.2	0	0	0	0	0	112.5	Q38	A35-Q38 WeakPolarHBondContact O-CG 3.38Å; A35-Q38 PolarHBondContact O-NE2 2.96Å
36	D	88.4	Confident	89.5	Confident	153 Å²	153	67 Å²	67	82%	0.818	36%	0.356	S	S	*	.	S	Bend	trans	-84.4	-23.3	174.2	54.8	-42	0	0	0	113.4	P34	P34-D36 WeakPolarHBondContact CB-OD1 3.46Å
37	D	88.1	Confident	89.5	Confident	57 Å²	57	65.1 Å²	65.1	31%	0.305	34%	0.341	S	S	.	.	S	Bend	trans	-128.9	75.1	176.5	-175.4	24	0	0	0	111.2	P34 Q39 Y67	P34-D37 HydrophobicContact CB-CB 4.46Å; P34-D37 CarbonylContact O-C 3.49Å; D37-Q39 PolarHBondContact O-N 3.25Å; D37-Q39 VanDerWaalsContact O-N 3.15Å; D37-Q39 PolarHBondContact OD1-NE2 2.71Å; D37-Y67 HydrophobicContact CB-CE1 4.39Å; D37-Y67 WeakPolarHBondContact O-CE1 3.39Å; D37-Y67 WeakPolarHBondContact OD2-CE1 3.44Å; D37-Y67 PolarHBondContact OD2-OH 3.18Å
38	Q	88.4	Confident	89.4	Confident	113 Å²	113	68.7 Å²	68.7	53%	0.528	36%	0.355	S	S	.	.			trans	-82.3	91.3	-175.4	-61.6	-171.5	35.8	0	0	111.9	N32 A35	N32-Q38 HydrophobicContact CB-CB 4.28Å; N32-Q38 HydrophobicContact CB-CG 3.88Å; N32-Q38 PolarHBondContact ND2-OE1 3.09Å; N32-Q38 VanDerWaalsContact ND2-OE1 3.11Å; A35-Q38 WeakPolarHBondContact O-CG 3.38Å; A35-Q38 PolarHBondContact O-NE2 2.96Å
39	Q	93.6	Very high	89.2	Confident	69 Å²	69	73.1 Å²	73.1	32%	0.322	38%	0.379	S	S	.	.			trans	-88	-7.2	-179.9	-65	-65.9	-43.4	0	0	114.9	D37 I58 T60 Y67	D37-Q39 PolarHBondContact O-N 3.25Å; D37-Q39 VanDerWaalsContact O-N 3.15Å; D37-Q39 PolarHBondContact OD1-NE2 2.71Å; Q39-I58 HydrophobicContact CB-CD1 3.73Å; Q39-I58 HydrophobicContact CB-CG1 4.12Å; Q39-I58 WeakPolarHBondContact O-CB 3.44Å; Q39-I58 VanDerWaalsContact O-CG1 3.31Å; Q39-I58 WeakPolarHBondContact O-CG1 3.31Å; Q39-T60 HydrophobicContact CB-CG2 3.78Å; Q39-T60 HydrophobicContact CG-CG2 3.75Å; Q39-Y67 HydrophobicContact CB-CD1 3.69Å; Q39-Y67 HydrophobicContact CB-CD2 4.38Å; Q39-Y67 HydrophobicContact CB-CE1 3.89Å; Q39-Y67 HydrophobicContact CB-CG 3.95Å; Q39-Y67 HydrophobicContact CG-CD1 3.64Å; Q39-Y67 HydrophobicContact CG-CD2 4.42Å; Q39-Y67 HydrophobicContact CG-CE1 3.26Å; Q39-Y67 HydrophobicContact CG-CE2 4.09Å; Q39-Y67 HydrophobicContact CG-CG 4.2Å; Q39-Y67 VanDerWaalsContact CG-CZ 3.5Å
40	W	94.4	Very high	89	Confident	5 Å²	5	69 Å²	69	2%	0.019	38%	0.378	C	S	.	.			trans	-96.1	109.3	173.4	-79.2	107.5	0	0	0	109.6	N32 F56 Q57 I58 Y67 L69 F169 M176 L178	N32-W40 PolarHBondContact ND2-O 3.43Å; N32-W40 VanDerWaalsContact OD1-CB 3.31Å; N32-W40 WeakPolarHBondContact OD1-CB 3.45Å; W40-F56 HydrophobicContact CE3-CB 4.06Å; W40-F56 HydrophobicContact CZ3-CB 4.32Å; W40-Q57 WeakPolarHBondContact CA-O 3.42Å; W40-I58 HydrophobicContact CD2-CB 3.79Å; W40-I58 HydrophobicContact CD2-CD1 4.05Å; W40-I58 HydrophobicContact CD2-CG2 3.86Å; W40-I58 HydrophobicContact CE3-CB 3.75Å; W40-I58 HydrophobicContact CE3-CG2 3.66Å; W40-I58 HydrophobicContact CG-CB 4.3Å; W40-I58 HydrophobicContact CG-CD1 3.98Å; W40-I58 HydrophobicContact CH2-CG2 3.58Å; W40-I58 HydrophobicContact CZ2-CG2 3.76Å; W40-I58 HydrophobicContact CZ3-CB 4.15Å; W40-I58 HydrophobicContact CZ3-CG2 3.52Å; W40-Y67 PolarHBondContact NE1-O 3.11Å; W40-L69 HydrophobicContact CB-CB 4.38Å; W40-L69 HydrophobicContact CB-CD1 4.3Å; W40-L69 HydrophobicContact CD2-CB 3.94Å; W40-L69 HydrophobicContact CD2-CD2 3.93Å; W40-L69 HydrophobicContact CD2-CG 4.5Å; W40-L69 HydrophobicContact CE3-CD2 3.82Å; W40-L69 HydrophobicContact CG-CB 3.83Å; W40-L69 HydrophobicContact CG-CD2 4.31Å; W40-L69 HydrophobicContact CG-CG 4.48Å; W40-L69 HydrophobicContact CZ3-CD2 4.22Å; W40-F169 HydrophobicContact CH2-CB 4.46Å; W40-F169 HydrophobicContact CZ2-CB 4.16Å; W40-M176 HydrophobicContact CH2-CE 4.12Å; W40-M176 HydrophobicContact CH2-CG 4.4Å; W40-M176 HydrophobicContact CH2-SD 3.96Å; W40-L178 HydrophobicContact CH2-CD1 3.86Å; W40-L178 HydrophobicContact CH2-CG 4.17Å; W40-L178 HydrophobicContact CZ3-CD1 3.78Å; W40-L178 HydrophobicContact CZ3-CG 4.01Å
41	E	94.1	Very high	88.5	Confident	113 Å²	113	72.3 Å²	72.3	53%	0.528	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	129.7	-177.5	-64.2	-178.1	169.9	0	0	111.2	L43 F56 Q57	E41-L43 HydrophobicContact CB-CG 4.37Å; E41-F56 CarbonylContact O-C 3.48Å; E41-F56 VanDerWaalsContact O-CA 3.31Å; E41-F56 WeakPolarHBondContact O-CA 3.5Å; E41-Q57 PolarHBondContact N-O 3.33Å; E41-Q57 PolarHBondContact O-N 2.68Å
42	E	93.3	Very high	88.1	Confident	56 Å²	56	74.7 Å²	74.7	26%	0.262	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	119.8	171.3	-163	179.3	146.1	0	0	109.9	D27 L28 R29 F56	D27-E42 VanDerWaalsContact CA-OE1 3.28Å; D27-E42 WeakPolarHBondContact CA-OE1 3.38Å; L28-E42 PolarHBondContact N-OE1 3.47Å; L28-E42 PolarHBondContact N-OE2 2.9Å; R29-E42 PolarHBondContact N-OE2 2.76Å; E42-F56 HydrophobicContact CB-CD1 3.98Å; E42-F56 HydrophobicContact CB-CE1 3.52Å; E42-F56 HydrophobicContact CB-CZ 4.08Å; E42-F56 HydrophobicContact CG-CD1 4.25Å; E42-F56 HydrophobicContact CG-CE1 3.69Å; E42-F56 HydrophobicContact CG-CE2 4.33Å; E42-F56 HydrophobicContact CG-CZ 3.71Å; E42-F56 WeakPolarHBondContact OE2-CZ 3.38Å
43	L	90.9	Very high	87.9	Confident	65 Å²	65	73.9 Å²	73.9	34%	0.34	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	145.5	-174.2	-61.7	176.6	0	0	0	111.6	E41 T55 Q57	E41-L43 HydrophobicContact CB-CG 4.37Å; L43-T55 PolarHBondContact N-O 2.99Å; L43-T55 PolarHBondContact O-N 2.92Å; L43-T55 PolarHBondContact O-OG1 3.03Å; L43-Q57 HydrophobicContact CD1-CB 3.97Å
44	S	87.8	Confident	87.8	Confident	78 Å²	78	73.3 Å²	73.3	55%	0.545	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	121	167.9	-62.5	0	0	0	0	110
45	G	83.1	Confident	87.7	Confident	22 Å²	22	72.6 Å²	72.6	23%	0.227	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	175.3	173.8	0	0	0	0	0	111.9	S52 V53	G45-S52 WeakPolarHBondContact O-CA 3.2Å; G45-V53 PolarHBondContact N-O 2.84Å; G45-V53 PolarHBondContact O-N 2.86Å
46	L	82.4	Confident	88.1	Confident	130 Å²	130	70.1 Å²	70.1	68%	0.681	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.4	138	165.5	-64.9	174.9	0	0	0	108.9	N51	L46-N51 WeakPolarHBondContact CA-O 3.37Å
47	D	80.2	Confident	88.4	Confident	27 Å²	27	67 Å²	67	14%	0.144	36%	0.36	C	S	.	.			trans	-80.8	-179	170	69.9	12.7	0	0	0	112.1	K22 D49 S50 N51 V53	K22-D47 WeakPolarHBondContact CE-OD2 3.48Å; K22-D47 IonicContact NZ-OD2 3.66Å; K22-D47 PolarHBondContact NZ-OD2 3.26Å; D47-D49 PolarHBondContact O-N 2.85Å; D47-D49 VanDerWaalsContact OD1-CA 3.3Å; D47-D49 WeakPolarHBondContact OD1-CA 3.28Å; D47-D49 WeakPolarHBondContact OD1-CB 3.44Å; D47-D49 PolarHBondContact OD1-N 2.92Å; D47-S50 PolarHBondContact O-N 2.84Å; D47-S50 VanDerWaalsContact O-N 3.11Å; D47-S50 PolarHBondContact OD1-N 2.81Å; D47-N51 PolarHBondContact N-O 3.11Å; D47-N51 PolarHBondContact OD1-N 3.26Å; D47-N51 PolarHBondContact OD1-ND2 3.5Å; D47-N51 WeakPolarHBondContact OD2-CB 3.32Å; D47-N51 PolarHBondContact OD2-ND2 2.8Å; D47-V53 HydrophobicContact CB-CG1 4.02Å; D47-V53 HydrophobicContact CB-CG2 4.17Å
48	E	80.5	Confident	88.7	Confident	137 Å²	137	64.3 Å²	64.3	64%	0.64	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-23	177.2	-67.5	163.9	173.8	0	0	113	R87 S150	E48-R87 IonicContact OE2-NH1 2.74Å; E48-S150 PolarHBondContact OE1-OG 3.11Å
49	D	82.3	Confident	89	Confident	105 Å²	105	61.8 Å²	61.8	56%	0.561	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	5.7	-180	-54.7	-64.7	0	0	0	112.1	K22 D47 N51	K22-D49 IonicContact NZ-OD2 2.87Å; K22-D49 PolarHBondContact NZ-OD2 2.91Å; D47-D49 PolarHBondContact O-N 2.85Å; D47-D49 VanDerWaalsContact OD1-CA 3.3Å; D47-D49 WeakPolarHBondContact OD1-CA 3.28Å; D47-D49 WeakPolarHBondContact OD1-CB 3.44Å; D47-D49 PolarHBondContact OD1-N 2.92Å; D49-N51 VanDerWaalsContact C-N 3.31Å; D49-N51 WeakPolarHBondContact CB-ND2 3.42Å; D49-N51 PolarHBondContact O-N 2.95Å
50	S	82.4	Confident	88.9	Confident	91 Å²	91	58.9 Å²	58.9	64%	0.636	33%	0.327	S	S	*	.			trans	62.7	22.5	-174.2	-53.4	0	0	0	0	116.3	D47	D47-S50 PolarHBondContact O-N 2.84Å; D47-S50 VanDerWaalsContact O-N 3.11Å; D47-S50 PolarHBondContact OD1-N 2.81Å
51	N	85.4	Confident	88.7	Confident	89 Å²	89	59.5 Å²	59.5	48%	0.476	33%	0.331	S	S	.	.			trans	-79.7	147.1	168.4	-50.6	-69.9	0	0	0	111	L46 D47 D49 V53	L46-N51 WeakPolarHBondContact CA-O 3.37Å; D47-N51 PolarHBondContact N-O 3.11Å; D47-N51 PolarHBondContact OD1-N 3.26Å; D47-N51 PolarHBondContact OD1-ND2 3.5Å; D47-N51 WeakPolarHBondContact OD2-CB 3.32Å; D47-N51 PolarHBondContact OD2-ND2 2.8Å; D49-N51 VanDerWaalsContact C-N 3.31Å; D49-N51 WeakPolarHBondContact CB-ND2 3.42Å; D49-N51 PolarHBondContact O-N 2.95Å; N51-V53 PolarHBondContact O-N 2.86Å
52	S	87.2	Confident	88.3	Confident	85 Å²	85	57.7 Å²	57.7	59%	0.594	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	121.8	170.1	-173.8	0	0	0	0	110.3	G45	G45-S52 WeakPolarHBondContact O-CA 3.2Å
53	V	89.9	Confident	88.1	Confident	6 Å²	6	56.3 Å²	56.3	4%	0.036	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	152.6	-178.3	-65.7	0	0	0	0	111.1	K22 G45 D47 N51 T55	K22-V53 HydrophobicContact CG-CG1 3.98Å; G45-V53 PolarHBondContact N-O 2.84Å; G45-V53 PolarHBondContact O-N 2.86Å; D47-V53 HydrophobicContact CB-CG1 4.02Å; D47-V53 HydrophobicContact CB-CG2 4.17Å; N51-V53 PolarHBondContact O-N 2.86Å; V53-T55 HydrophobicContact CG2-CG2 4.11Å
54	R	90.5	Very high	87.9	Confident	51 Å²	51	57.6 Å²	57.6	19%	0.192	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	129.4	173.4	-60.7	-54.4	-177.3	124.6	12.8	111	D27 L28	D27-R54 IonicContact OD1-CZ 3.73Å; D27-R54 IonicContact OD1-NH1 3.24Å; D27-R54 PolarHBondContact OD1-NH1 2.97Å; D27-R54 IonicContact OD1-NH2 3.91Å; D27-R54 PolarHBondContact OD1-NH2 3Å; L28-R54 HydrophobicContact CD1-CB 3.7Å; L28-R54 HydrophobicContact CG-CB 3.93Å; L28-R54 HydrophobicContact CG-CG 4.47Å
55	T	91.7	Very high	88	Confident	15 Å²	15	55.8 Å²	55.8	9%	0.092	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	156.1	-176	63.4	0	0	0	0	109.7	L43 V53 L178 L179	L43-T55 PolarHBondContact N-O 2.99Å; L43-T55 PolarHBondContact O-N 2.92Å; L43-T55 PolarHBondContact O-OG1 3.03Å; V53-T55 HydrophobicContact CG2-CG2 4.11Å; T55-L178 VanDerWaalsContact CA-O 3.31Å; T55-L178 WeakPolarHBondContact CA-O 3.48Å; T55-L178 WeakPolarHBondContact CB-O 3.41Å; T55-L179 HydrophobicContact CG2-CD2 4.33Å
56	F	94.9	Very high	88.5	Confident	6 Å²	6	56.3 Å²	56.3	3%	0.026	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	126.7	175.3	-76.1	-83.2	0	0	0	110.7	L28 W30 W40 E41 E42 L69 A177 L178	L28-F56 HydrophobicContact CB-CE2 4.03Å; L28-F56 HydrophobicContact CB-CZ 4.05Å; L28-F56 HydrophobicContact CD1-CD2 4.35Å; L28-F56 HydrophobicContact CD1-CE2 3.58Å; L28-F56 HydrophobicContact CD1-CZ 4.37Å; L28-F56 HydrophobicContact CG-CE2 4.45Å; W30-F56 HydrophobicContact CB-CE1 4.28Å; W30-F56 HydrophobicContact CB-CE2 4.17Å; W30-F56 HydrophobicContact CB-CZ 3.66Å; W30-F56 HydrophobicContact CD2-CD2 4.41Å; W30-F56 AromaticContact CD2-CE2 3.6Å; W30-F56 HydrophobicContact CD2-CE2 3.6Å; W30-F56 HydrophobicContact CD2-CZ 4.04Å; W30-F56 AromaticContact CE3-CD2 3.85Å; W30-F56 HydrophobicContact CE3-CD2 3.85Å; W30-F56 AromaticContact CE3-CE2 3.49Å; W30-F56 HydrophobicContact CE3-CE2 3.49Å; W30-F56 VanDerWaalsContact CE3-CE2 3.49Å; W30-F56 HydrophobicContact CE3-CZ 4.16Å; W30-F56 AromaticContact CG-CE2 3.92Å; W30-F56 HydrophobicContact CG-CE2 3.92Å; W30-F56 AromaticContact CG-CZ 3.86Å; W30-F56 HydrophobicContact CG-CZ 3.86Å; W30-F56 HydrophobicContact CZ3-CD2 4.1Å; W30-F56 HydrophobicContact CZ3-CE2 4.07Å; W40-F56 HydrophobicContact CE3-CB 4.06Å; W40-F56 HydrophobicContact CZ3-CB 4.32Å; E41-F56 CarbonylContact O-C 3.48Å; E41-F56 VanDerWaalsContact O-CA 3.31Å; E41-F56 WeakPolarHBondContact O-CA 3.5Å; E42-F56 HydrophobicContact CB-CD1 3.98Å; E42-F56 HydrophobicContact CB-CE1 3.52Å; E42-F56 HydrophobicContact CB-CZ 4.08Å; E42-F56 HydrophobicContact CG-CD1 4.25Å; E42-F56 HydrophobicContact CG-CE1 3.69Å; E42-F56 HydrophobicContact CG-CE2 4.33Å; E42-F56 HydrophobicContact CG-CZ 3.71Å; E42-F56 WeakPolarHBondContact OE2-CZ 3.38Å; F56-L69 HydrophobicContact CB-CD2 3.76Å; F56-L69 HydrophobicContact CD1-CD1 3.92Å; F56-L69 HydrophobicContact CD1-CD2 3.82Å; F56-L69 HydrophobicContact CD2-CD2 4Å; F56-L69 HydrophobicContact CE1-CD1 3.81Å; F56-L69 HydrophobicContact CE1-CD2 4.39Å; F56-L69 HydrophobicContact CG-CD1 4.49Å; F56-L69 HydrophobicContact CG-CD2 3.6Å; F56-L69 HydrophobicContact CZ-CD1 4.3Å; F56-A177 CarbonylContact O-C 3.46Å; F56-A177 VanDerWaalsContact O-CA 3.28Å; F56-A177 WeakPolarHBondContact O-CA 3.36Å; F56-L178 HydrophobicContact CB-CB 4.32Å; F56-L178 HydrophobicContact CB-CD1 4.44Å; F56-L178 PolarHBondContact N-O 2.8Å; F56-L178 PolarHBondContact O-N 3.42Å
57	Q	95.1	Very high	89.2	Confident	86 Å²	86	50.8 Å²	50.8	40%	0.402	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	145.7	179.8	-175.6	174.2	-45.7	0	0	111.5	W40 E41 L43 A177	W40-Q57 WeakPolarHBondContact CA-O 3.42Å; E41-Q57 PolarHBondContact N-O 3.33Å; E41-Q57 PolarHBondContact O-N 2.68Å; L43-Q57 HydrophobicContact CD1-CB 3.97Å; Q57-A177 HydrophobicContact CB-CB 4.23Å; Q57-A177 HydrophobicContact CG-CB 4.32Å
58	I	95.6	Very high	89.9	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	142.7	168.6	-176.5	157.1	0	0	0	109.9	Q39 W40 T60 Y67 C175 M176	Q39-I58 HydrophobicContact CB-CD1 3.73Å; Q39-I58 HydrophobicContact CB-CG1 4.12Å; Q39-I58 WeakPolarHBondContact O-CB 3.44Å; Q39-I58 VanDerWaalsContact O-CG1 3.31Å; Q39-I58 WeakPolarHBondContact O-CG1 3.31Å; W40-I58 HydrophobicContact CD2-CB 3.79Å; W40-I58 HydrophobicContact CD2-CD1 4.05Å; W40-I58 HydrophobicContact CD2-CG2 3.86Å; W40-I58 HydrophobicContact CE3-CB 3.75Å; W40-I58 HydrophobicContact CE3-CG2 3.66Å; W40-I58 HydrophobicContact CG-CB 4.3Å; W40-I58 HydrophobicContact CG-CD1 3.98Å; W40-I58 HydrophobicContact CH2-CG2 3.58Å; W40-I58 HydrophobicContact CZ2-CG2 3.76Å; W40-I58 HydrophobicContact CZ3-CB 4.15Å; W40-I58 HydrophobicContact CZ3-CG2 3.52Å; I58-T60 HydrophobicContact CD1-CG2 4.31Å; I58-T60 HydrophobicContact CG1-CG2 4.02Å; I58-Y67 HydrophobicContact CD1-CD2 4.21Å; I58-Y67 HydrophobicContact CD1-CG 3.99Å; I58-C175 CarbonylContact O-C 3.57Å; I58-C175 WeakPolarHBondContact O-CA 3.47Å; I58-M176 HydrophobicContact CG2-CG 3.65Å; I58-M176 HydrophobicContact CG2-SD 4.47Å; I58-M176 PolarHBondContact N-O 2.87Å; I58-M176 PolarHBondContact O-N 2.05Å; I58-M176 VanDerWaalsContact O-O 3.07Å
59	C	93.4	Very high	90.7	Very high	60 Å²	60	43.4 Å²	43.4	41%	0.405	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	86.1	175.8	-165.2	0	0	0	0	112.3	P61 C175	C59-P61 WeakPolarHBondContact O-CD 3.34Å; C59-C175 HydrophobicContact CB-CB 3.93Å; C59-C175 WeakPolarHBondContact CB-SG 3.25Å; C59-C175 WeakPolarHBondContact SG-CB 3.08Å; C59-C175 CovalentContact SG-SG 2.05Å; C59-C175 PolarHBondContact SG-SG 2.91Å
60	T	92.8	Very high	91.4	Very high	7 Å²	7	38.7 Å²	38.7	4%	0.043	24%	0.239	C	C	.	.			trans	-119.4	40.6	-174.2	53.2	0	0	0	0	114.7	Q39 I58 S62 S63 Y67 G173 A174	Q39-T60 HydrophobicContact CB-CG2 3.78Å; Q39-T60 HydrophobicContact CG-CG2 3.75Å; I58-T60 HydrophobicContact CD1-CG2 4.31Å; I58-T60 HydrophobicContact CG1-CG2 4.02Å; T60-S62 PolarHBondContact O-N 3.11Å; T60-S63 PolarHBondContact O-N 2.89Å; T60-Y67 HydrophobicContact CG2-CD2 4.2Å; T60-Y67 HydrophobicContact CG2-CE2 3.93Å; T60-G173 WeakPolarHBondContact O-CA 3.24Å; T60-A174 PolarHBondContact N-O 2.88Å; T60-A174 VanDerWaalsContact N-O 3.13Å
61	P	88.6	Confident	92.1	Very high	18 Å²	18	34.4 Å²	34.4	12%	0.117	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-14.7	-166.7	30.3	-39.4	0	0	0	115.8	C59 M96 Q98 H100 C101 G173	C59-P61 WeakPolarHBondContact O-CD 3.34Å; P61-M96 HydrophobicContact CB-SD 4Å; P61-M96 HydrophobicContact CG-SD 3.87Å; P61-Q98 HydrophobicContact CB-CB 4.14Å; P61-Q98 HydrophobicContact CB-CG 4.18Å; P61-Q98 HydrophobicContact CG-CG 4.33Å; P61-Q98 WeakPolarHBondContact O-CB 3.47Å; P61-H100 CarbonylContact O-C 3.51Å; P61-H100 VanDerWaalsContact O-C 3.29Å; P61-C101 HydrophobicContact CB-CB 4.03Å; P61-C101 PolarHBondContact O-N 3.02Å; P61-C101 VanDerWaalsContact O-N 3.13Å; P61-G173 WeakPolarHBondContact CA-O 3.38Å
62	S	86.6	Confident	92.5	Very high	75 Å²	75	36.3 Å²	36.3	52%	0.524	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-14.1	175.3	51.1	0	0	0	0	114	T60 H100	T60-S62 PolarHBondContact O-N 3.11Å; S62-H100 PolarHBondContact O-CD2 3.04Å
63	S	88.1	Confident	92.9	Very high	27 Å²	27	35.3 Å²	35.3	19%	0.189	19%	0.193	C	C	.	.			trans	-99.6	130.9	-173.9	-173.6	0	0	0	0	112	T60 A65	T60-S63 PolarHBondContact O-N 2.89Å; S63-A65 VanDerWaalsContact C-N 3.26Å; S63-A65 WeakPolarHBondContact OG-CB 3.28Å; S63-A65 PolarHBondContact OG-N 2.7Å
64	P	86.4	Confident	93.3	Very high	93 Å²	93	35.2 Å²	35.2	60%	0.604	19%	0.192	S	C	*	.			trans	-81.9	-1.6	169.7	34.8	-35.3	0	0	0	113.3
65	A	91.5	Very high	93.5	Very high	39 Å²	39	35 Å²	35	32%	0.322	20%	0.197	S	C	.	.			trans	-68.5	158.5	-177.7	0	0	0	0	0	112.8	S63 Y67	S63-A65 VanDerWaalsContact C-N 3.26Å; S63-A65 WeakPolarHBondContact OG-CB 3.28Å; S63-A65 PolarHBondContact OG-N 2.7Å; A65-Y67 HydrophobicContact CB-CE2 3.76Å
66	S	93.3	Very high	93.6	Very high	34 Å²	34	35.9 Å²	35.9	24%	0.238	20%	0.199	C	C	.	.			trans	-105.5	107.6	-176.2	-176.8	0	0	0	0	110.9	W68 Q170	S66-W68 PolarHBondContact OG-NE1 2.8Å; S66-W68 VanDerWaalsContact OG-NE1 3.12Å; S66-Q170 WeakPolarHBondContact OG-CG 3.45Å; S66-Q170 PolarHBondContact OG-NE2 2.87Å
67	Y	95.8	Very high	93.4	Very high	13 Å²	13	43.1 Å²	43.1	5%	0.051	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	123.3	-179.4	-62.3	-78.4	0	0	0	110.7	H33 D37 Q39 W40 I58 T60 A65 Q170 S171	H33-Y67 CarbonylContact O-C 3.52Å; H33-Y67 WeakPolarHBondContact O-CA 3.38Å; D37-Y67 HydrophobicContact CB-CE1 4.39Å; D37-Y67 WeakPolarHBondContact O-CE1 3.39Å; D37-Y67 WeakPolarHBondContact OD2-CE1 3.44Å; D37-Y67 PolarHBondContact OD2-OH 3.18Å; Q39-Y67 HydrophobicContact CB-CD1 3.69Å; Q39-Y67 HydrophobicContact CB-CD2 4.38Å; Q39-Y67 HydrophobicContact CB-CE1 3.89Å; Q39-Y67 HydrophobicContact CB-CG 3.95Å; Q39-Y67 HydrophobicContact CG-CD1 3.64Å; Q39-Y67 HydrophobicContact CG-CD2 4.42Å; Q39-Y67 HydrophobicContact CG-CE1 3.26Å; Q39-Y67 HydrophobicContact CG-CE2 4.09Å; Q39-Y67 HydrophobicContact CG-CG 4.2Å; Q39-Y67 VanDerWaalsContact CG-CZ 3.5Å; W40-Y67 PolarHBondContact NE1-O 3.11Å; I58-Y67 HydrophobicContact CD1-CD2 4.21Å; I58-Y67 HydrophobicContact CD1-CG 3.99Å; T60-Y67 HydrophobicContact CG2-CD2 4.2Å; T60-Y67 HydrophobicContact CG2-CE2 3.93Å; A65-Y67 HydrophobicContact CB-CE2 3.76Å; Y67-Q170 WeakPolarHBondContact O-CA 3.5Å; Y67-S171 PolarHBondContact N-O 3.36Å; Y67-S171 PolarHBondContact O-N 2.84Å
68	W	96.6	Very high	93.1	Very high	9 Å²	9	41.7 Å²	41.7	3%	0.034	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	146	-177.4	-60.4	76.7	0	0	0	111.7	H33 S66 Y108 W124 A168 F169 Q170	H33-W68 HydrophobicContact CB-CB 4.29Å; H33-W68 PolarHBondContact N-O 3.47Å; H33-W68 PolarHBondContact O-N 2.77Å; S66-W68 PolarHBondContact OG-NE1 2.8Å; S66-W68 VanDerWaalsContact OG-NE1 3.12Å; W68-Y108 HydrophobicContact CE3-CD2 4.32Å; W68-Y108 HydrophobicContact CH2-CD1 4.28Å; W68-Y108 AromaticContact CH2-CD2 3.73Å; W68-Y108 HydrophobicContact CH2-CD2 3.73Å; W68-Y108 HydrophobicContact CH2-CE1 4.25Å; W68-Y108 AromaticContact CH2-CE2 3.66Å; W68-Y108 HydrophobicContact CH2-CE2 3.66Å; W68-Y108 HydrophobicContact CH2-CG 4.07Å; W68-Y108 AromaticContact CH2-CZ 3.97Å; W68-Y108 HydrophobicContact CZ3-CD1 4.39Å; W68-Y108 AromaticContact CZ3-CD2 3.37Å; W68-Y108 HydrophobicContact CZ3-CD2 3.37Å; W68-Y108 AromaticContact CZ3-CE2 3.76Å; W68-Y108 HydrophobicContact CZ3-CE2 3.76Å; W68-Y108 AromaticContact CZ3-CG 3.76Å; W68-Y108 HydrophobicContact CZ3-CG 3.76Å; W68-W124 HydrophobicContact CB-CD2 4.41Å; W68-W124 HydrophobicContact CB-CE3 3.41Å; W68-W124 VanDerWaalsContact CB-CE3 3.41Å; W68-W124 HydrophobicContact CB-CZ3 3.51Å; W68-W124 HydrophobicContact CD2-CE3 4.2Å; W68-W124 HydrophobicContact CE3-CE3 4.35Å; W68-W124 AromaticContact CG-CE3 3.86Å; W68-W124 HydrophobicContact CG-CE3 3.86Å; W68-W124 HydrophobicContact CG-CZ3 4.4Å; W68-A168 HydrophobicContact CE3-CB 4.06Å; W68-A168 HydrophobicContact CZ3-CB 4.32Å; W68-F169 CarbonylContact C-O 3.54Å; W68-F169 VanDerWaalsContact CA-O 3.29Å; W68-F169 WeakPolarHBondContact CA-O 3.5Å; W68-Q170 HydrophobicContact CD2-CB 3.96Å; W68-Q170 HydrophobicContact CD2-CG 4Å; W68-Q170 HydrophobicContact CE3-CB 3.94Å; W68-Q170 HydrophobicContact CE3-CG 4.42Å; W68-Q170 HydrophobicContact CG-CG 4.45Å; W68-Q170 HydrophobicContact CH2-CB 4.41Å; W68-Q170 HydrophobicContact CH2-CG 4.46Å; W68-Q170 HydrophobicContact CZ2-CB 4.43Å; W68-Q170 HydrophobicContact CZ2-CG 4.04Å; W68-Q170 HydrophobicContact CZ3-CB 4.18Å
69	L	97.2	Very high	92.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	119.6	175.1	173.2	71.7	0	0	0	108.4	W30 T31 N32 W40 F56 A168 F169 L178	W30-L69 HydrophobicContact CB-CD1 3.62Å; W30-L69 HydrophobicContact CB-CG 4.31Å; W30-L69 HydrophobicContact CE3-CD1 4.37Å; W30-L69 HydrophobicContact CE3-CD2 3.87Å; W30-L69 HydrophobicContact CE3-CG 3.94Å; W30-L69 HydrophobicContact CZ3-CD2 4.37Å; T31-L69 CarbonylContact O-C 3.47Å; T31-L69 WeakPolarHBondContact O-CA 3.31Å; N32-L69 VanDerWaalsContact OD1-CD1 3.23Å; N32-L69 WeakPolarHBondContact OD1-CD1 3.25Å; W40-L69 HydrophobicContact CB-CB 4.38Å; W40-L69 HydrophobicContact CB-CD1 4.3Å; W40-L69 HydrophobicContact CD2-CB 3.94Å; W40-L69 HydrophobicContact CD2-CD2 3.93Å; W40-L69 HydrophobicContact CD2-CG 4.5Å; W40-L69 HydrophobicContact CE3-CD2 3.82Å; W40-L69 HydrophobicContact CG-CB 3.83Å; W40-L69 HydrophobicContact CG-CD2 4.31Å; W40-L69 HydrophobicContact CG-CG 4.48Å; W40-L69 HydrophobicContact CZ3-CD2 4.22Å; F56-L69 HydrophobicContact CB-CD2 3.76Å; F56-L69 HydrophobicContact CD1-CD1 3.92Å; F56-L69 HydrophobicContact CD1-CD2 3.82Å; F56-L69 HydrophobicContact CD2-CD2 4Å; F56-L69 HydrophobicContact CE1-CD1 3.81Å; F56-L69 HydrophobicContact CE1-CD2 4.39Å; F56-L69 HydrophobicContact CG-CD1 4.49Å; F56-L69 HydrophobicContact CG-CD2 3.6Å; F56-L69 HydrophobicContact CZ-CD1 4.3Å; L69-A168 CarbonylContact O-C 3.58Å; L69-A168 WeakPolarHBondContact O-CA 3.41Å; L69-F169 HydrophobicContact CB-CB 4.39Å; L69-F169 PolarHBondContact N-O 3.44Å; L69-F169 PolarHBondContact O-N 2.97Å; L69-L178 HydrophobicContact CD2-CD1 4.03Å
70	R	96.9	Very high	92.8	Very high	6 Å²	6	40.6 Å²	40.6	2%	0.023	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	136.5	-178	-173	-166.9	68.7	-152.4	-3.7	112.3	W30 T31 T118 H121 W124 Y129 Y166 L167 A168	W30-R70 CarbonylContact C-O 3.57Å; W30-R70 WeakPolarHBondContact CA-O 3.48Å; W30-R70 WeakPolarHBondContact CB-O 3.04Å; T31-R70 PolarHBondContact N-O 3.48Å; T31-R70 PolarHBondContact O-N 3.12Å; T31-R70 PolarHBondContact OG1-NH2 3.25Å; T31-R70 VanDerWaalsContact OG1-NH2 3.14Å; R70-T118 PolarHBondContact NH1-O 2.97Å; R70-T118 PolarHBondContact NH2-O 3.29Å; R70-H121 PolarHBondContact NH1-O 3.23Å; R70-W124 HydrophobicContact CB-CH2 3.39Å; R70-W124 HydrophobicContact CB-CZ2 4.48Å; R70-W124 HydrophobicContact CB-CZ3 3.67Å; R70-W124 HydrophobicContact CG-CH2 4.48Å; R70-Y129 WeakPolarHBondContact CD-OH 3.46Å; R70-Y166 HydrophobicContact CG-CD1 4.36Å; R70-Y166 HydrophobicContact CG-CG 4.46Å; R70-L167 WeakPolarHBondContact CA-O 3.31Å; R70-L167 WeakPolarHBondContact CG-O 3.3Å; R70-A168 HydrophobicContact CB-CB 4.4Å; R70-A168 HydrophobicContact CG-CB 4.44Å
71	T	96.4	Very high	92.8	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.006	23%	0.225	C	C	.	.			trans	-64.1	174.8	173.3	67.8	0	0	0	0	112.4	M19 W30 L167 F169	M19-T71 HydrophobicContact CE-CG2 4.09Å; M19-T71 HydrophobicContact SD-CG2 4.37Å; W30-T71 HydrophobicContact CD2-CG2 4Å; W30-T71 HydrophobicContact CE3-CG2 4.07Å; W30-T71 HydrophobicContact CH2-CG2 3.75Å; W30-T71 HydrophobicContact CZ2-CG2 3.64Å; W30-T71 HydrophobicContact CZ3-CG2 3.96Å; T71-L167 HydrophobicContact CG2-CB 3.77Å; T71-L167 PolarHBondContact N-O 3.14Å; T71-L167 PolarHBondContact OG1-N 3.11Å; T71-L167 PolarHBondContact OG1-O 3.48Å; T71-F169 HydrophobicContact CG2-CE2 4.14Å
72	R	94.4	Very high	93.1	Very high	129 Å²	129	40.5 Å²	40.5	49%	0.487	22%	0.22	S	C	.	.			trans	-74	172.8	158	-55.8	-167.6	-165	174	12.3	110.3	D27 L28 I74	D27-R72 PolarHBondContact O-NH2 2.95Å; L28-R72 PolarHBondContact O-NE 2.8Å; L28-R72 PolarHBondContact O-NH2 3.14Å; R72-I74 PolarHBondContact O-N 3.01Å
73	W	95.9	Very high	93.5	Very high	64 Å²	64	38 Å²	38	24%	0.242	20%	0.199	C	C	.	.			trans	-65.6	130.3	177.2	-174.7	81.2	0	0	0	111.2	P75 A112 A114 D115 A163 Y166	W73-P75 HydrophobicContact CE3-CB 4.3Å; W73-P75 HydrophobicContact CH2-CB 3.93Å; W73-P75 HydrophobicContact CZ3-CB 3.66Å; W73-P75 HydrophobicContact CZ3-CG 4.35Å; W73-A112 PolarHBondContact NE1-O 3.11Å; W73-A114 PolarHBondContact NE1-O 3.14Å; W73-D115 HydrophobicContact CB-CB 3.69Å; W73-D115 VanDerWaalsContact CB-CG 3.48Å; W73-D115 WeakPolarHBondContact CB-OD1 3.49Å; W73-D115 HydrophobicContact CD2-CB 4.35Å; W73-D115 HydrophobicContact CG-CB 4.03Å; W73-A163 HydrophobicContact CZ2-CB 4.3Å; W73-Y166 HydrophobicContact CB-CD1 4.28Å; W73-Y166 HydrophobicContact CB-CE1 3.59Å; W73-Y166 HydrophobicContact CB-CE2 4.41Å; W73-Y166 AromaticContact CD1-CE2 3.67Å; W73-Y166 AromaticContact CD1-CZ 3.74Å; W73-Y166 HydrophobicContact CG-CE1 4.44Å; W73-Y166 HydrophobicContact CG-CE2 4.45Å; W73-Y166 VanDerWaalsContact N-CE1 3.28Å
74	I	96.4	Very high	93.9	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	112.2	-179.6	-53.2	177.5	0	0	0	107.7	L18 M19 R72 R76 G164 L165 L167 V183	L18-I74 HydrophobicContact CB-CG2 3.73Å; L18-I74 HydrophobicContact CD1-CG2 4.39Å; M19-I74 HydrophobicContact CB-CD1 4.3Å; M19-I74 HydrophobicContact CE-CD1 3.81Å; M19-I74 HydrophobicContact SD-CD1 3.85Å; M19-I74 HydrophobicContact SD-CG1 4.27Å; R72-I74 PolarHBondContact O-N 3.01Å; I74-R76 PolarHBondContact O-N 3.13Å; I74-G164 CarbonylContact O-C 3.6Å; I74-G164 WeakPolarHBondContact O-CA 3.31Å; I74-L165 WeakPolarHBondContact CB-O 3.03Å; I74-L165 PolarHBondContact N-O 3.45Å; I74-L165 PolarHBondContact O-N 3.05Å; I74-L167 HydrophobicContact CD1-CD1 4.18Å; I74-L167 HydrophobicContact CD1-CG 4.14Å; I74-V183 HydrophobicContact CD1-CB 4.47Å; I74-V183 HydrophobicContact CD1-CG2 3.96Å; I74-V183 HydrophobicContact CG2-CG1 4.33Å
75	P	95.7	Very high	94.4	Very high	47 Å²	47	33.9 Å²	33.9	31%	0.305	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	124.2	178.9	25.5	-32.6	0	0	0	110.2	L18 W73 R77	L18-P75 WeakPolarHBondContact CD1-O 3.37Å; L18-P75 WeakPolarHBondContact CD2-O 3.35Å; W73-P75 HydrophobicContact CE3-CB 4.3Å; W73-P75 HydrophobicContact CH2-CB 3.93Å; W73-P75 HydrophobicContact CZ3-CB 3.66Å; W73-P75 HydrophobicContact CZ3-CG 4.35Å; P75-R77 VanDerWaalsContact C-N 3.31Å; P75-R77 PolarHBondContact O-N 3.37Å
76	R	93.4	Very high	94.6	Very high	34 Å²	34	32 Å²	32	13%	0.128	15%	0.153	C	C	.	.			trans	-70.9	-27.9	-178	-178	177.1	68.7	77.2	-6.8	112.7	I74 A78 A79 L160 Q161 G162 A163	I74-R76 PolarHBondContact O-N 3.13Å; R76-A78 PolarHBondContact NH1-O 2.98Å; R76-A78 VanDerWaalsContact NH1-O 3.1Å; R76-A79 WeakPolarHBondContact CD-O 3.41Å; R76-A79 WeakPolarHBondContact CG-O 3.23Å; R76-A79 VanDerWaalsContact NH1-C 3.25Å; R76-A79 PolarHBondContact NH1-O 2.84Å; R76-A79 PolarHBondContact O-N 2.97Å; R76-L160 VanDerWaalsContact CD-CB 3.47Å; R76-Q161 PolarHBondContact NH2-O 3.1Å; R76-Q161 VanDerWaalsContact NH2-O 3.09Å; R76-G162 PolarHBondContact NE-O 3.45Å; R76-A163 WeakPolarHBondContact CB-O 3.43Å; R76-A163 PolarHBondContact N-O 2.9Å
77	R	92.1	Very high	94.7	Very high	157 Å²	157	34 Å²	34	59%	0.592	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	-142.1	-168.1	-55	-176.8	171.2	-137.4	-10.4	109.6	E16 L18 P75 A79 F185	E16-R77 WeakPolarHBondContact OE1-CD 3.36Å; E16-R77 IonicContact OE1-CZ 2.66Å; E16-R77 VanDerWaalsContact OE1-CZ 3.27Å; E16-R77 IonicContact OE1-NE 3.54Å; E16-R77 PolarHBondContact OE1-NE 2.94Å; E16-R77 IonicContact OE1-NH1 3.44Å; E16-R77 PolarHBondContact OE1-NH1 2.78Å; L18-R77 HydrophobicContact CD2-CG 4.01Å; P75-R77 VanDerWaalsContact C-N 3.31Å; P75-R77 PolarHBondContact O-N 3.37Å; R77-A79 VanDerWaalsContact C-N 3.34Å; R77-A79 PolarHBondContact O-N 3.26Å; R77-F185 HydrophobicContact CB-CE1 4.44Å
78	A	87.5	Confident	94.6	Very high	56 Å²	56	33.4 Å²	33.4	46%	0.463	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-24.4	-179.1	0	0	0	0	0	113.9	R76 T80 V202 H204	R76-A78 PolarHBondContact NH1-O 2.98Å; R76-A78 VanDerWaalsContact NH1-O 3.1Å; A78-T80 PolarHBondContact O-N 2.86Å; A78-V202 HydrophobicContact CB-CG2 4.39Å; A78-H204 PolarHBondContact O-CE1 2.83Å; A78-H204 VanDerWaalsContact O-CE1 3.3Å
79	A	91.8	Very high	94.5	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.008	16%	0.158	C	C	.	.			trans	-68.6	121.3	-163.7	0	0	0	0	0	114.1	R76 R77 T81 L82 F185 V202	R76-A79 WeakPolarHBondContact CD-O 3.41Å; R76-A79 WeakPolarHBondContact CG-O 3.23Å; R76-A79 VanDerWaalsContact NH1-C 3.25Å; R76-A79 PolarHBondContact NH1-O 2.84Å; R76-A79 PolarHBondContact O-N 2.97Å; R77-A79 VanDerWaalsContact C-N 3.34Å; R77-A79 PolarHBondContact O-N 3.26Å; A79-T81 VanDerWaalsContact C-N 3.28Å; A79-L82 HydrophobicContact CB-CD2 3.83Å; A79-F185 HydrophobicContact CB-CB 3.45Å; A79-F185 VanDerWaalsContact CB-CB 3.45Å; A79-F185 HydrophobicContact CB-CD1 3.74Å; A79-F185 HydrophobicContact CB-CD2 3.67Å; A79-F185 HydrophobicContact CB-CE1 4.34Å; A79-F185 HydrophobicContact CB-CE2 4.29Å; A79-F185 HydrophobicContact CB-CG 3.35Å; A79-V202 HydrophobicContact CB-CG1 4.11Å
80	T	91.2	Very high	94.3	Very high	38 Å²	38	34.1 Å²	34.1	23%	0.233	16%	0.158	C	C	.	.	S	Bend	trans	-78.8	-15.3	175	43.2	0	0	0	0	113.2	A78 L160 H204	A78-T80 PolarHBondContact O-N 2.86Å; T80-L160 WeakPolarHBondContact O-CB 3.48Å; T80-L160 PolarHBondContact O-N 3.2Å; T80-L160 VanDerWaalsContact O-N 3.16Å; T80-H204 WeakPolarHBondContact CG2-ND1 3.45Å; T80-H204 WeakPolarHBondContact OG1-CA 3.24Å; T80-H204 PolarHBondContact OG1-ND1 3.39Å; T80-H204 VanDerWaalsContact OG1-ND1 3.12Å
81	T	92.3	Very high	93.9	Very high	23 Å²	23	36.3 Å²	36.3	14%	0.141	17%	0.17	C	C	.	.	S	Bend	trans	-125.6	127	177.4	-58.7	0	0	0	0	109.5	A79 Y83 R156 L157 E158	A79-T81 VanDerWaalsContact C-N 3.28Å; T81-Y83 HydrophobicContact CG2-CE2 4.28Å; T81-R156 HydrophobicContact CG2-CG 3.59Å; T81-L157 CarbonylContact C-O 3.4Å; T81-L157 VanDerWaalsContact CA-O 3.23Å; T81-L157 WeakPolarHBondContact CA-O 3.1Å; T81-E158 HydrophobicContact CG2-CG 4.31Å
82	L	94.6	Very high	93.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	147.8	170.2	-62	-169.9	0	0	0	111.3	L18 A79 L157 L160 L165 V183 F185	L18-L82 HydrophobicContact CD1-CD1 3.75Å; L18-L82 HydrophobicContact CD1-CD2 3.47Å; L18-L82 VanDerWaalsContact CD1-CD2 3.47Å; L18-L82 HydrophobicContact CD1-CG 4.28Å; A79-L82 HydrophobicContact CB-CD2 3.83Å; L82-L157 PolarHBondContact N-O 3.37Å; L82-L157 PolarHBondContact O-N 2.93Å; L82-L160 HydrophobicContact CB-CD1 4Å; L82-L160 HydrophobicContact CD1-CD1 4.13Å; L82-L160 HydrophobicContact CG-CD1 3.64Å; L82-L165 HydrophobicContact CD1-CD2 3.93Å; L82-L165 HydrophobicContact CD1-CG 4.49Å; L82-V183 HydrophobicContact CB-CG1 4.34Å; L82-V183 HydrophobicContact CD1-CG1 3.94Å; L82-F185 HydrophobicContact CD2-CB 3.87Å; L82-F185 HydrophobicContact CD2-CD1 4.28Å; L82-F185 HydrophobicContact CD2-CG 4.5Å
83	Y	95.1	Very high	93.4	Very high	24 Å²	24	32.8 Å²	32.8	9%	0.094	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	130.6	172.7	-64.6	-86.8	0	0	0	109.5	T81 L154 L155 R156 V183 F184 R186	T81-Y83 HydrophobicContact CG2-CE2 4.28Å; Y83-L154 HydrophobicContact CD1-CD2 4.45Å; Y83-L154 HydrophobicContact CD1-CG 4.48Å; Y83-L155 CarbonylContact C-O 3.57Å; Y83-L155 WeakPolarHBondContact CA-O 3.48Å; Y83-R156 HydrophobicContact CD1-CB 4.47Å; Y83-R156 HydrophobicContact CD1-CG 4.38Å; Y83-R156 HydrophobicContact CE1-CB 4.37Å; Y83-R156 HydrophobicContact CE1-CG 3.97Å; Y83-V183 WeakPolarHBondContact O-CA 3.41Å; Y83-F184 HydrophobicContact CD2-CD2 4.45Å; Y83-F184 HydrophobicContact CD2-CE2 4.19Å; Y83-F184 HydrophobicContact CG-CE2 4.15Å; Y83-F184 HydrophobicContact CG-CZ 4.23Å; Y83-F184 PolarHBondContact N-O 3.27Å; Y83-F184 PolarHBondContact O-N 2.87Å; Y83-R186 HydrophobicContact CD2-CG 4.22Å; Y83-R186 HydrophobicContact CE2-CB 4.43Å; Y83-R186 HydrophobicContact CE2-CG 3.83Å
84	V	97.3	Very high	92.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	106.3	177.3	-173.9	0	0	0	0	108.2	I86 L107 L154 L155 L157 L167 V181 V183	V84-I86 HydrophobicContact CG1-CD1 4.27Å; V84-I86 HydrophobicContact CG1-CG1 3.86Å; V84-L107 HydrophobicContact CG1-CD2 4.32Å; V84-L154 WeakPolarHBondContact O-CA 3.46Å; V84-L155 HydrophobicContact CB-CB 4.48Å; V84-L155 PolarHBondContact N-O 3.2Å; V84-L155 PolarHBondContact O-N 3.35Å; V84-L157 HydrophobicContact CG2-CD1 3.75Å; V84-L157 HydrophobicContact CG2-CG 4.09Å; V84-L167 HydrophobicContact CG1-CD1 3.76Å; V84-L167 HydrophobicContact CG2-CD1 4.04Å; V84-L167 HydrophobicContact CG2-CD2 4.23Å; V84-V181 HydrophobicContact CG1-CG1 4.18Å; V84-V183 HydrophobicContact CG1-CG2 4.29Å; V84-V183 HydrophobicContact CG2-CG1 4.5Å; V84-V183 HydrophobicContact CG2-CG2 4.24Å
85	E	96.9	Very high	91.6	Very high	32 Å²	32	35.2 Å²	35.2	15%	0.15	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	120.9	170.3	-179.7	-172.9	142.7	0	0	108.7	R87 L152 K153 L154 V181 R182 F184	E85-R87 IonicContact OE1-CZ 2.75Å; E85-R87 IonicContact OE1-NE 3.3Å; E85-R87 PolarHBondContact OE1-NE 2.81Å; E85-R87 IonicContact OE1-NH2 3.9Å; E85-R87 PolarHBondContact OE1-NH2 3.12Å; E85-L152 HydrophobicContact CG-CD1 3.49Å; E85-L152 VanDerWaalsContact CG-CD1 3.49Å; E85-L152 HydrophobicContact CG-CG 4.48Å; E85-L152 WeakPolarHBondContact OE1-CD1 3.32Å; E85-K153 CarbonylContact C-O 3.29Å; E85-K153 WeakPolarHBondContact CA-O 3.35Å; E85-L154 HydrophobicContact CB-CD1 4.1Å; E85-V181 WeakPolarHBondContact O-CA 3.21Å; E85-R182 HydrophobicContact CB-CB 4.23Å; E85-R182 PolarHBondContact N-O 3.13Å; E85-R182 PolarHBondContact O-N 3.17Å; E85-F184 HydrophobicContact CB-CE1 4.32Å
86	I	96.4	Very high	90.8	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	121.4	179.2	-49.7	170.6	0	0	0	108.5	V84 F88 F105 L107 L152 K153 L155 F169 L178	V84-I86 HydrophobicContact CG1-CD1 4.27Å; V84-I86 HydrophobicContact CG1-CG1 3.86Å; I86-F88 HydrophobicContact CG2-CD1 4.09Å; I86-F105 HydrophobicContact CD1-CE2 4.45Å; I86-F105 HydrophobicContact CD1-CZ 4.36Å; I86-F105 HydrophobicContact CG2-CZ 4.25Å; I86-L107 HydrophobicContact CD1-CD2 4.24Å; I86-L152 WeakPolarHBondContact O-CA 3.46Å; I86-K153 PolarHBondContact N-O 3.48Å; I86-K153 PolarHBondContact O-N 2.85Å; I86-L155 HydrophobicContact CD1-CD1 4.01Å; I86-F169 HydrophobicContact CD1-CE1 4.08Å; I86-F169 HydrophobicContact CG2-CE1 4.49Å; I86-L178 HydrophobicContact CG2-CD2 3.81Å
87	R	94.6	Very high	89.9	Confident	75 Å²	75	40.9 Å²	40.9	28%	0.283	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	127.6	167.7	-66.7	-178.4	-170.5	-144	-1	109.5	E48 E85 N151 L152 L179 A180	E48-R87 IonicContact OE2-NH1 2.74Å; E85-R87 IonicContact OE1-CZ 2.75Å; E85-R87 IonicContact OE1-NE 3.3Å; E85-R87 PolarHBondContact OE1-NE 2.81Å; E85-R87 IonicContact OE1-NH2 3.9Å; E85-R87 PolarHBondContact OE1-NH2 3.12Å; R87-N151 VanDerWaalsContact CA-O 3.26Å; R87-N151 WeakPolarHBondContact CA-O 3.28Å; R87-L152 HydrophobicContact CG-CD1 3.47Å; R87-L152 VanDerWaalsContact CG-CD1 3.47Å; R87-L179 HydrophobicContact CB-CB 4.22Å; R87-L179 PolarHBondContact O-N 2.92Å; R87-A180 HydrophobicContact CB-CB 4.16Å; R87-A180 PolarHBondContact N-O 3.23Å; R87-A180 PolarHBondContact O-N 3.01Å; R87-A180 VanDerWaalsContact O-N 3.16Å
88	F	94.6	Very high	89.5	Confident	1 Å²	1	37.9 Å²	37.9	0%	0.004	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	161.3	-176.4	69.7	-78	0	0	0	113.2	I86 M90 F105 V135 A137 N151 K153 M176 A177 L178	I86-F88 HydrophobicContact CG2-CD1 4.09Å; F88-M90 HydrophobicContact CD2-CB 4.42Å; F88-M90 HydrophobicContact CE2-CB 4.33Å; F88-F105 HydrophobicContact CD1-CE1 4.25Å; F88-F105 HydrophobicContact CD1-CZ 4.5Å; F88-F105 AromaticContact CD2-CE1 3.82Å; F88-F105 HydrophobicContact CD2-CE1 3.82Å; F88-F105 HydrophobicContact CE1-CE1 4.25Å; F88-F105 HydrophobicContact CE2-CD1 4.48Å; F88-F105 AromaticContact CE2-CE1 3.8Å; F88-F105 HydrophobicContact CE2-CE1 3.8Å; F88-F105 HydrophobicContact CG-CE1 4.05Å; F88-F105 HydrophobicContact CZ-CE1 4.03Å; F88-V135 HydrophobicContact CE1-CG1 3.8Å; F88-V135 HydrophobicContact CZ-CG1 3.73Å; F88-A137 HydrophobicContact CE2-CB 3.91Å; F88-A137 HydrophobicContact CZ-CB 4.28Å; F88-N151 HydrophobicContact CD1-CB 3.89Å; F88-N151 HydrophobicContact CD2-CB 4.31Å; F88-N151 HydrophobicContact CE1-CB 3.55Å; F88-N151 HydrophobicContact CE2-CB 4.03Å; F88-N151 HydrophobicContact CG-CB 4.25Å; F88-N151 HydrophobicContact CZ-CB 3.63Å; F88-N151 PolarHBondContact N-O 3.36Å; F88-N151 WeakPolarHBondContact O-CB 3.36Å; F88-N151 PolarHBondContact O-N 3.01Å; F88-N151 PolarHBondContact O-ND2 3.43Å; F88-K153 HydrophobicContact CE1-CB 4.34Å; F88-M176 HydrophobicContact CB-CE 4.36Å; F88-M176 HydrophobicContact CD2-CE 4.35Å; F88-A177 CarbonylContact C-O 3.31Å; F88-A177 WeakPolarHBondContact CA-O 3.23Å; F88-A177 VanDerWaalsContact CB-O 3.31Å; F88-A177 WeakPolarHBondContact CB-O 3.27Å; F88-L178 HydrophobicContact CB-CD2 4.16Å
89	T	93.2	Very high	89.1	Confident	24 Å²	24	46.8 Å²	46.8	15%	0.147	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	153.2	167.7	54.6	0	0	0	0	109.9	L141 M176 A177 L179	T89-L141 HydrophobicContact CG2-CD1 3.97Å; T89-M176 CarbonylContact O-C 3.58Å; T89-M176 WeakPolarHBondContact O-CA 3.15Å; T89-M176 WeakPolarHBondContact O-CB 3.34Å; T89-A177 PolarHBondContact N-O 2.85Å; T89-A177 PolarHBondContact O-N 2.85Å; T89-L179 HydrophobicContact CG2-CD1 3.96Å; T89-L179 HydrophobicContact CG2-CG 4.46Å
90	M	92.6	Very high	88.9	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	138.4	-179.3	-174.1	156.1	-87.2	0	0	109.7	F88 E103 F105 A137 L140 L141 A174 M176	F88-M90 HydrophobicContact CD2-CB 4.42Å; F88-M90 HydrophobicContact CE2-CB 4.33Å; M90-E103 VanDerWaalsContact SD-CA 3.58Å; M90-E103 HydrophobicContact SD-CB 4.39Å; M90-F105 HydrophobicContact CE-CD1 3.92Å; M90-A137 HydrophobicContact CB-CB 3.84Å; M90-A137 HydrophobicContact CG-CB 4.35Å; M90-A137 HydrophobicContact SD-CB 4.11Å; M90-L140 HydrophobicContact CB-CD2 4.18Å; M90-L140 HydrophobicContact CG-CD2 3.94Å; M90-L140 WeakPolarHBondContact O-CA 3.43Å; M90-L141 PolarHBondContact O-N 3.33Å; M90-A174 HydrophobicContact CE-CB 4.15Å; M90-M176 HydrophobicContact CB-CB 4.47Å; M90-M176 HydrophobicContact CE-CB 3.7Å; M90-M176 HydrophobicContact CE-CE 4.49Å; M90-M176 HydrophobicContact CE-CG 4.14Å; M90-M176 HydrophobicContact CE-SD 3.69Å
91	M	90.6	Very high	88.9	Confident	52 Å²	52	50.4 Å²	50.4	26%	0.256	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-90.6	142.6	-177.6	-63.4	-67.3	-57.6	0	0	111.2	M96 L141 C175	M91-M96 HydrophobicContact CB-CE 3.67Å; M91-L141 HydrophobicContact CE-CB 4.44Å; M91-L141 HydrophobicContact SD-CB 3.55Å; M91-L141 VanDerWaalsContact SD-CB 3.55Å; M91-L141 HydrophobicContact SD-CD1 4.2Å; M91-C175 HydrophobicContact CB-CB 4.15Å; M91-C175 HydrophobicContact CG-CB 4.28Å; M91-C175 PolarHBondContact N-O 2.74Å
92	E	90.7	Very high	88.9	Confident	34 Å²	34	53.1 Å²	53.1	16%	0.159	27%	0.265	C	S	.	.			trans	-68.5	128	176	-170.6	-177	-129.6	0	0	111.6	A94 A95 E103 L140 L141 R142	E92-A94 VanDerWaalsContact C-N 3.35Å; E92-A94 HydrophobicContact CG-CB 4.01Å; E92-A94 PolarHBondContact O-N 2.94Å; E92-A95 PolarHBondContact O-N 3.11Å; E92-E103 WeakPolarHBondContact CA-OE1 3.45Å; E92-L140 HydrophobicContact CB-CB 4.04Å; E92-L140 HydrophobicContact CB-CD1 4.48Å; E92-L140 HydrophobicContact CG-CD1 4.31Å; E92-L141 PolarHBondContact N-O 3.43Å; E92-R142 HydrophobicContact CB-CG 4.48Å; E92-R142 VanDerWaalsContact CD-NE 3.34Å; E92-R142 IonicContact OE1-CZ 2.78Å; E92-R142 IonicContact OE1-NE 3.12Å; E92-R142 PolarHBondContact OE1-NE 3.33Å; E92-R142 IonicContact OE1-NH2 3.87Å; E92-R142 PolarHBondContact OE1-NH2 3.24Å; E92-R142 VanDerWaalsContact OE2-CG 3.28Å; E92-R142 WeakPolarHBondContact OE2-CG 3.3Å; E92-R142 IonicContact OE2-CZ 3.42Å; E92-R142 IonicContact OE2-NE 3.39Å; E92-R142 PolarHBondContact OE2-NE 3.24Å; E92-R142 IonicContact OE2-NH2 2.73Å
93	C	89.3	Confident	88.8	Confident	22 Å²	22	56.5 Å²	56.5	15%	0.149	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-70	-29.5	-179.2	-77.4	0	0	0	0	113.2	A95 M96 N97 C101 K102 E103	C93-A95 PolarHBondContact O-N 3.09Å; C93-M96 PolarHBondContact O-N 3.23Å; C93-N97 PolarHBondContact O-N 2.97Å; C93-N97 VanDerWaalsContact O-N 3.12Å; C93-C101 WeakPolarHBondContact CA-SG 3.45Å; C93-C101 HydrophobicContact CB-CB 3.74Å; C93-C101 WeakPolarHBondContact CB-SG 3.37Å; C93-C101 WeakPolarHBondContact SG-CB 3.38Å; C93-C101 CovalentContact SG-SG 2.04Å; C93-C101 PolarHBondContact SG-SG 2.71Å; C93-K102 PolarHBondContact SG-N 2.88Å; C93-K102 VanDerWaalsContact SG-N 3.44Å; C93-E103 HydrophobicContact CB-CG 4.07Å; C93-E103 PolarHBondContact N-OE1 3.44Å
94	A	83.7	Confident	88.8	Confident	80 Å²	80	57.9 Å²	57.9	66%	0.661	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-57.6	-31.7	173.1	0	0	0	0	0	112.4	E92 M96	E92-A94 VanDerWaalsContact C-N 3.35Å; E92-A94 HydrophobicContact CG-CB 4.01Å; E92-A94 PolarHBondContact O-N 2.94Å; A94-M96 VanDerWaalsContact C-N 3.31Å; A94-M96 PolarHBondContact O-N 3.19Å
95	A	70.6	Confident	88.7	Confident	40 Å²	40	58 Å²	58	33%	0.331	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-78.6	-10.2	176.9	0	0	0	0	0	114.1	E92 C93	E92-A95 PolarHBondContact O-N 3.11Å; C93-A95 PolarHBondContact O-N 3.09Å
96	M	78.2	Confident	88.7	Confident	43 Å²	43	57.6 Å²	57.6	21%	0.212	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-24.6	-177	-71.5	-173.2	-86.5	0	0	114.1	P61 M91 C93 A94 Q98 C101 C175	P61-M96 HydrophobicContact CB-SD 4Å; P61-M96 HydrophobicContact CG-SD 3.87Å; M91-M96 HydrophobicContact CB-CE 3.67Å; C93-M96 PolarHBondContact O-N 3.23Å; A94-M96 VanDerWaalsContact C-N 3.31Å; A94-M96 PolarHBondContact O-N 3.19Å; M96-Q98 VanDerWaalsContact C-N 3.28Å; M96-Q98 PolarHBondContact O-N 3Å; M96-C101 VanDerWaalsContact CE-SG 3.52Å; M96-C175 HydrophobicContact CE-CB 3.82Å; M96-C175 HydrophobicContact SD-CB 3.98Å
97	N	75.3	Confident	88.8	Confident	157 Å²	157	57.6 Å²	57.6	84%	0.84	29%	0.291	S	S	*	.			trans	58.1	35.2	174	-141.8	10.7	0	0	0	114	C93	C93-N97 PolarHBondContact O-N 2.97Å; C93-N97 VanDerWaalsContact O-N 3.12Å
98	Q	82.3	Confident	88.9	Confident	94 Å²	94	54.1 Å²	54.1	44%	0.439	28%	0.278	S	S	.	.			trans	-109	138.2	-177.4	-71.8	-67.2	-20.9	0	0	112	P61 M96 H100 C101	P61-Q98 HydrophobicContact CB-CB 4.14Å; P61-Q98 HydrophobicContact CB-CG 4.18Å; P61-Q98 HydrophobicContact CG-CG 4.33Å; P61-Q98 WeakPolarHBondContact O-CB 3.47Å; M96-Q98 VanDerWaalsContact C-N 3.28Å; M96-Q98 PolarHBondContact O-N 3Å; Q98-H100 VanDerWaalsContact C-N 3.35Å; Q98-H100 PolarHBondContact O-N 3.41Å; Q98-C101 HydrophobicContact CB-CB 4.14Å; Q98-C101 WeakPolarHBondContact O-CB 3.48Å; Q98-C101 PolarHBondContact O-N 3.24Å
99	R	80.8	Confident	89	Confident	242 Å²	242	55.4 Å²	55.4	91%	0.913	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-26.2	-175.2	-72	-170.7	179.4	-149.1	0.9	115.2
100	H	87.3	Confident	89.2	Confident	93 Å²	93	56.3 Å²	56.3	43%	0.431	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	5.7	-176.7	-65.4	-59.7	0	0	0	113.2	P61 S62 Q98 G173	P61-H100 CarbonylContact O-C 3.51Å; P61-H100 VanDerWaalsContact O-C 3.29Å; S62-H100 PolarHBondContact O-CD2 3.04Å; Q98-H100 VanDerWaalsContact C-N 3.35Å; Q98-H100 PolarHBondContact O-N 3.41Å; H100-G173 WeakPolarHBondContact O-CA 3.34Å
101	C	90.7	Very high	89.3	Confident	22 Å²	22	59.1 Å²	59.1	15%	0.149	30%	0.298	C	S	.	.			trans	-66.3	134.9	-177.2	-169.4	0	0	0	0	111.8	P61 C93 M96 Q98 G173	P61-C101 HydrophobicContact CB-CB 4.03Å; P61-C101 PolarHBondContact O-N 3.02Å; P61-C101 VanDerWaalsContact O-N 3.13Å; C93-C101 WeakPolarHBondContact CA-SG 3.45Å; C93-C101 HydrophobicContact CB-CB 3.74Å; C93-C101 WeakPolarHBondContact CB-SG 3.37Å; C93-C101 WeakPolarHBondContact SG-CB 3.38Å; C93-C101 CovalentContact SG-SG 2.04Å; C93-C101 PolarHBondContact SG-SG 2.71Å; M96-C101 VanDerWaalsContact CE-SG 3.52Å; Q98-C101 HydrophobicContact CB-CB 4.14Å; Q98-C101 WeakPolarHBondContact O-CB 3.48Å; Q98-C101 PolarHBondContact O-N 3.24Å; C101-G173 CarbonylContact C-O 3.57Å; C101-G173 VanDerWaalsContact CA-O 3.3Å; C101-G173 WeakPolarHBondContact CA-O 3.35Å
102	K	92	Very high	89.4	Confident	81 Å²	81	56.9 Å²	56.9	35%	0.352	29%	0.287	S	S	.	.	B	Isolated β-bridge	trans	-127.6	142.5	174.5	-62.4	-169.9	-164.4	172.4	0	112.2	C93 T104 Q172 G173 A174	C93-K102 PolarHBondContact SG-N 2.88Å; C93-K102 VanDerWaalsContact SG-N 3.44Å; K102-T104 VanDerWaalsContact C-N 3.3Å; K102-Q172 WeakPolarHBondContact CD-O 3.37Å; K102-Q172 VanDerWaalsContact CE-O 3.31Å; K102-Q172 WeakPolarHBondContact CE-O 3.47Å; K102-Q172 WeakPolarHBondContact CG-O 3.49Å; K102-G173 PolarHBondContact N-O 2.84Å; K102-A174 WeakPolarHBondContact O-CA 3.47Å
103	E	93.1	Very high	89.6	Confident	70 Å²	70	61 Å²	61	33%	0.327	31%	0.311	S	S	.	.	S	Bend	trans	-99.6	31	174.5	-60.6	175.4	162	0	0	111	M90 E92 C93 L140	M90-E103 VanDerWaalsContact SD-CA 3.58Å; M90-E103 HydrophobicContact SD-CB 4.39Å; E92-E103 WeakPolarHBondContact CA-OE1 3.45Å; C93-E103 HydrophobicContact CB-CG 4.07Å; C93-E103 PolarHBondContact N-OE1 3.44Å; E103-L140 HydrophobicContact CB-CD2 4.11Å; E103-L140 VanDerWaalsContact CD-CD1 3.49Å; E103-L140 HydrophobicContact CG-CD1 4.35Å; E103-L140 HydrophobicContact CG-CD2 4.14Å; E103-L140 WeakPolarHBondContact OE2-CD1 3.36Å
104	T	94.6	Very high	89.9	Confident	54 Å²	54	62.5 Å²	62.5	33%	0.331	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	150.9	177.9	60.9	0	0	0	0	111.5	K102 V135 A136	K102-T104 VanDerWaalsContact C-N 3.3Å; T104-V135 VanDerWaalsContact CA-O 3.26Å; T104-V135 WeakPolarHBondContact CA-O 3.47Å; T104-A136 HydrophobicContact CG2-CB 3.88Å
105	F	95.9	Very high	90.4	Very high	2 Å²	2	63.7 Å²	63.7	1%	0.009	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	163	164.8	69.5	-85.7	0	0	0	109.6	I86 F88 M90 V135 F169 M176 L178	I86-F105 HydrophobicContact CD1-CE2 4.45Å; I86-F105 HydrophobicContact CD1-CZ 4.36Å; I86-F105 HydrophobicContact CG2-CZ 4.25Å; F88-F105 HydrophobicContact CD1-CE1 4.25Å; F88-F105 HydrophobicContact CD1-CZ 4.5Å; F88-F105 AromaticContact CD2-CE1 3.82Å; F88-F105 HydrophobicContact CD2-CE1 3.82Å; F88-F105 HydrophobicContact CE1-CE1 4.25Å; F88-F105 HydrophobicContact CE2-CD1 4.48Å; F88-F105 AromaticContact CE2-CE1 3.8Å; F88-F105 HydrophobicContact CE2-CE1 3.8Å; F88-F105 HydrophobicContact CG-CE1 4.05Å; F88-F105 HydrophobicContact CZ-CE1 4.03Å; M90-F105 HydrophobicContact CE-CD1 3.92Å; F105-V135 HydrophobicContact CD1-CB 4.03Å; F105-V135 HydrophobicContact CD1-CG1 4.31Å; F105-V135 HydrophobicContact CD2-CB 4.28Å; F105-V135 HydrophobicContact CE1-CB 3.61Å; F105-V135 HydrophobicContact CE1-CG1 3.48Å; F105-V135 VanDerWaalsContact CE1-CG1 3.48Å; F105-V135 HydrophobicContact CE1-CG2 4.49Å; F105-V135 HydrophobicContact CE2-CB 3.85Å; F105-V135 HydrophobicContact CE2-CG1 4.31Å; F105-V135 HydrophobicContact CE2-CG2 3.9Å; F105-V135 HydrophobicContact CG-CB 4.36Å; F105-V135 HydrophobicContact CZ-CB 3.52Å; F105-V135 HydrophobicContact CZ-CG1 3.49Å; F105-V135 VanDerWaalsContact CZ-CG1 3.49Å; F105-V135 HydrophobicContact CZ-CG2 3.91Å; F105-V135 PolarHBondContact N-O 2.88Å; F105-V135 PolarHBondContact O-N 3.45Å; F105-F169 HydrophobicContact CD2-CD1 4.26Å; F105-F169 AromaticContact CE2-CD1 3.77Å; F105-F169 HydrophobicContact CE2-CD1 3.77Å; F105-F169 HydrophobicContact CE2-CE1 4.3Å; F105-M176 HydrophobicContact CB-SD 3.72Å; F105-M176 HydrophobicContact CD1-CE 3.47Å; F105-M176 VanDerWaalsContact CD1-CE 3.47Å; F105-M176 HydrophobicContact CD1-SD 3.55Å; F105-M176 VanDerWaalsContact CD1-SD 3.55Å; F105-M176 HydrophobicContact CD2-CE 4.49Å; F105-M176 HydrophobicContact CE1-CE 3.6Å; F105-M176 HydrophobicContact CE1-SD 4.31Å; F105-M176 HydrophobicContact CG-CE 3.94Å; F105-M176 HydrophobicContact CG-SD 3.74Å; F105-M176 HydrophobicContact CZ-CE 4.19Å; F105-L178 HydrophobicContact CE2-CD2 4.46Å; F105-L178 HydrophobicContact CZ-CD2 4.18Å
106	N	97.1	Very high	91.4	Very high	24 Å²	24	66.2 Å²	66.2	13%	0.128	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	139.9	176.4	-62.3	-58.5	0	0	0	110.6	Y108 K131 A133 A134 Q170	N106-Y108 HydrophobicContact CB-CD2 4.21Å; N106-Y108 HydrophobicContact CB-CE2 3.43Å; N106-Y108 VanDerWaalsContact CB-CE2 3.43Å; N106-K131 VanDerWaalsContact CG-NZ 3.3Å; N106-K131 PolarHBondContact ND2-NZ 2.64Å; N106-K131 WeakPolarHBondContact OD1-CE 3.15Å; N106-K131 PolarHBondContact OD1-NZ 2.8Å; N106-A133 WeakPolarHBondContact CA-O 3.38Å; N106-A134 WeakPolarHBondContact OD1-CB 3.36Å; N106-Q170 HydrophobicContact CB-CB 4.23Å; N106-Q170 PolarHBondContact N-O 3.11Å; N106-Q170 PolarHBondContact ND2-OE1 3.36Å; N106-Q170 PolarHBondContact O-N 3.42Å
107	L	97.8	Very high	92.1	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	134	165.2	-178	72.5	0	0	0	109.6	V84 I86 A132 A133 V135 L155 L167 F169	V84-L107 HydrophobicContact CG1-CD2 4.32Å; I86-L107 HydrophobicContact CD1-CD2 4.24Å; L107-A132 HydrophobicContact CB-CB 4.32Å; L107-A132 HydrophobicContact CD2-CB 3.94Å; L107-A132 HydrophobicContact CG-CB 4.1Å; L107-A132 PolarHBondContact O-N 2.95Å; L107-A133 PolarHBondContact N-O 2.61Å; L107-A133 PolarHBondContact O-N 2.73Å; L107-V135 HydrophobicContact CB-CG2 4.45Å; L107-L155 HydrophobicContact CB-CD1 4.35Å; L107-L155 HydrophobicContact CD2-CD1 3.54Å; L107-L167 HydrophobicContact CD1-CB 4.26Å; L107-L167 HydrophobicContact CD1-CD2 4.48Å; L107-F169 HydrophobicContact CD1-CD1 4.01Å; L107-F169 HydrophobicContact CD1-CE1 3.76Å; L107-F169 HydrophobicContact CD1-CE2 4.39Å; L107-F169 HydrophobicContact CD1-CG 4.42Å; L107-F169 HydrophobicContact CD1-CZ 3.94Å
108	Y	97.3	Very high	92.9	Very high	1 Å²	1	60.6 Å²	60.6	0%	0.004	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	166	169.3	-59.4	-101.5	0	0	0	110.8	W68 N106 E126 T130 K131 A168 Q170	W68-Y108 HydrophobicContact CE3-CD2 4.32Å; W68-Y108 HydrophobicContact CH2-CD1 4.28Å; W68-Y108 AromaticContact CH2-CD2 3.73Å; W68-Y108 HydrophobicContact CH2-CD2 3.73Å; W68-Y108 HydrophobicContact CH2-CE1 4.25Å; W68-Y108 AromaticContact CH2-CE2 3.66Å; W68-Y108 HydrophobicContact CH2-CE2 3.66Å; W68-Y108 HydrophobicContact CH2-CG 4.07Å; W68-Y108 AromaticContact CH2-CZ 3.97Å; W68-Y108 HydrophobicContact CZ3-CD1 4.39Å; W68-Y108 AromaticContact CZ3-CD2 3.37Å; W68-Y108 HydrophobicContact CZ3-CD2 3.37Å; W68-Y108 AromaticContact CZ3-CE2 3.76Å; W68-Y108 HydrophobicContact CZ3-CE2 3.76Å; W68-Y108 AromaticContact CZ3-CG 3.76Å; W68-Y108 HydrophobicContact CZ3-CG 3.76Å; N106-Y108 HydrophobicContact CB-CD2 4.21Å; N106-Y108 HydrophobicContact CB-CE2 3.43Å; N106-Y108 VanDerWaalsContact CB-CE2 3.43Å; Y108-E126 HydrophobicContact CE1-CB 4.36Å; Y108-E126 HydrophobicContact CE1-CG 3.9Å; Y108-E126 PolarHBondContact OH-OE1 3.41Å; Y108-E126 VanDerWaalsContact OH-OE1 3.1Å; Y108-T130 CarbonylContact C-O 3.48Å; Y108-T130 WeakPolarHBondContact CA-O 3.36Å; Y108-T130 WeakPolarHBondContact CB-O 3.47Å; Y108-K131 VanDerWaalsContact CD1-CA 3.4Å; Y108-K131 HydrophobicContact CD1-CB 3.69Å; Y108-K131 HydrophobicContact CD1-CG 4.03Å; Y108-K131 HydrophobicContact CE1-CB 3.48Å; Y108-K131 VanDerWaalsContact CE1-CB 3.48Å; Y108-K131 HydrophobicContact CE1-CD 3.85Å; Y108-K131 HydrophobicContact CE1-CG 3.59Å; Y108-K131 PolarHBondContact OH-NZ 2.91Å; Y108-A168 PolarHBondContact N-O 2.75Å; Y108-A168 PolarHBondContact O-N 2.8Å; Y108-Q170 HydrophobicContact CD2-CB 4.17Å; Y108-Q170 HydrophobicContact CE2-CB 3.72Å; Y108-Q170 HydrophobicContact CE2-CG 4.37Å; Y108-Q170 VanDerWaalsContact CE2-OE1 3.26Å; Y108-Q170 PolarHBondContact OH-OE1 3.29Å
109	Y	96.9	Very high	93.3	Very high	29 Å²	29	60.2 Å²	60.2	11%	0.114	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	152.2	169.2	67.7	-74.2	0	0	0	111.7	Q111 Y129 T130 A132 L157 L160 Y166	Y109-Q111 HydrophobicContact CD2-CG 4.05Å; Y109-Q111 HydrophobicContact CE2-CG 4.04Å; Y109-Y129 CarbonylContact O-C 3.55Å; Y109-T130 HydrophobicContact CD1-CG2 4.47Å; Y109-T130 VanDerWaalsContact CD1-O 3.32Å; Y109-T130 WeakPolarHBondContact CD1-O 3.31Å; Y109-T130 HydrophobicContact CE1-CG2 3.6Å; Y109-T130 PolarHBondContact N-O 2.65Å; Y109-T130 PolarHBondContact O-N 2.93Å; Y109-A132 HydrophobicContact CD1-CB 4.11Å; Y109-A132 HydrophobicContact CE1-CB 4.42Å; Y109-L157 HydrophobicContact CD1-CD2 4.04Å; Y109-L157 HydrophobicContact CE1-CD2 4.16Å; Y109-L157 HydrophobicContact CG-CD1 4.35Å; Y109-L160 HydrophobicContact CD2-CD2 4.01Å; Y109-L160 HydrophobicContact CE2-CD2 3.56Å; Y109-Y166 CarbonylContact C-O 3.6Å; Y109-Y166 WeakPolarHBondContact CA-O 3.36Å
110	Y	95.7	Very high	93.7	Very high	43 Å²	43	53.9 Å²	53.9	17%	0.169	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	126.8	171	173.8	-105.7	0	0	0	108.7	A112 P122 P128 L165 Y166	Y110-A112 HydrophobicContact CD1-CB 4.26Å; Y110-A112 HydrophobicContact CE1-CB 3.92Å; Y110-P122 HydrophobicContact CD1-CB 4.22Å; Y110-P122 HydrophobicContact CD1-CG 3.54Å; Y110-P122 HydrophobicContact CD2-CB 4.32Å; Y110-P122 HydrophobicContact CD2-CG 4.26Å; Y110-P122 HydrophobicContact CE1-CB 4.02Å; Y110-P122 HydrophobicContact CE1-CG 3.74Å; Y110-P122 HydrophobicContact CE2-CB 4.17Å; Y110-P122 HydrophobicContact CE2-CG 4.47Å; Y110-P122 HydrophobicContact CG-CB 4.34Å; Y110-P122 HydrophobicContact CG-CG 3.79Å; Y110-P128 HydrophobicContact CD2-CB 3.91Å; Y110-P128 HydrophobicContact CD2-CG 3.9Å; Y110-P128 HydrophobicContact CE2-CB 3.74Å; Y110-P128 HydrophobicContact CE2-CG 3.78Å; Y110-L165 CarbonylContact O-C 3.53Å; Y110-L165 WeakPolarHBondContact O-CA 3.28Å; Y110-L165 VanDerWaalsContact O-CB 3.3Å; Y110-L165 WeakPolarHBondContact O-CB 3.48Å; Y110-Y166 AromaticContact CD1-CD2 3.92Å; Y110-Y166 HydrophobicContact CD1-CD2 3.92Å; Y110-Y166 HydrophobicContact CD1-CE2 4.33Å; Y110-Y166 PolarHBondContact N-O 3.28Å; Y110-Y166 PolarHBondContact O-N 3.1Å
111	Q	95.1	Very high	93.9	Very high	59 Å²	59	53.4 Å²	53.4	28%	0.276	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	136.3	179	-61.1	-176.5	65.5	0	0	109.7	Y109 L160 L165	Y109-Q111 HydrophobicContact CD2-CG 4.05Å; Y109-Q111 HydrophobicContact CE2-CG 4.04Å; Q111-L160 HydrophobicContact CG-CD2 4.09Å; Q111-L165 HydrophobicContact CG-CB 4.5Å
112	A	94.1	Very high	94	Very high	5 Å²	5	52.4 Å²	52.4	4%	0.041	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	144.1	-179.9	0	0	0	0	0	110.6	W73 Y110 A114 E116 G164 Y166	W73-A112 PolarHBondContact NE1-O 3.11Å; Y110-A112 HydrophobicContact CD1-CB 4.26Å; Y110-A112 HydrophobicContact CE1-CB 3.92Å; A112-A114 VanDerWaalsContact C-N 3.32Å; A112-E116 HydrophobicContact CB-CG 4.42Å; A112-G164 PolarHBondContact N-O 2.7Å; A112-G164 CarbonylContact O-C 3.46Å; A112-G164 PolarHBondContact O-N 3.16Å; A112-G164 VanDerWaalsContact O-O 3.04Å; A112-Y166 HydrophobicContact CB-CD2 4.43Å; A112-Y166 HydrophobicContact CB-CE2 3.88Å
113	D	94.5	Very high	94	Very high	121 Å²	121	50.7 Å²	50.7	65%	0.647	29%	0.286	S	S	*	.	S	Bend	trans	-81.3	-11.9	-178.2	-69.3	-38.6	0	0	0	113.9	G162 A163	D113-G162 VanDerWaalsContact OD1-CA 3.24Å; D113-G162 WeakPolarHBondContact OD1-CA 3.16Å; D113-A163 HydrophobicContact CB-CB 4.37Å; D113-A163 PolarHBondContact OD1-N 3.18Å
114	A	94.1	Very high	94	Very high	52 Å²	52	48.6 Å²	48.6	43%	0.43	28%	0.275	S	S	.	.	S	Bend	trans	-149.2	172.5	174.7	0	0	0	0	0	111.2	W73 A112 E116	W73-A114 PolarHBondContact NE1-O 3.14Å; A112-A114 VanDerWaalsContact C-N 3.32Å; A114-E116 VanDerWaalsContact C-N 3.3Å; A114-E116 PolarHBondContact O-N 2.87Å
115	D	94.2	Very high	93.8	Very high	105 Å²	105	51 Å²	51	56%	0.561	28%	0.284	S	S	*	.	S	Bend	trans	-78.3	78	172.3	-164.3	9.9	0	0	0	110.8	W73 Y166	W73-D115 HydrophobicContact CB-CB 3.69Å; W73-D115 VanDerWaalsContact CB-CG 3.48Å; W73-D115 WeakPolarHBondContact CB-OD1 3.49Å; W73-D115 HydrophobicContact CD2-CB 4.35Å; W73-D115 HydrophobicContact CG-CB 4.03Å; D115-Y166 VanDerWaalsContact CA-OH 3.23Å; D115-Y166 WeakPolarHBondContact CA-OH 3.45Å; D115-Y166 WeakPolarHBondContact OD1-CE1 3.48Å; D115-Y166 PolarHBondContact OD1-OH 2.74Å
116	E	92.8	Very high	93.4	Very high	94 Å²	94	56.1 Å²	56.1	44%	0.439	31%	0.308	S	S	.	.			trans	-100	-6.9	-175.6	68.2	-174.2	171.2	0	0	114.4	A112 A114 Y166	A112-E116 HydrophobicContact CB-CG 4.42Å; A114-E116 VanDerWaalsContact C-N 3.3Å; A114-E116 PolarHBondContact O-N 2.87Å; E116-Y166 PolarHBondContact N-OH 2.75Å
117	A	92.4	Very high	92.9	Very high	21 Å²	21	61.2 Å²	61.2	17%	0.174	34%	0.335	C	S	.	.			trans	-76.8	135.8	-168.8	0	0	0	0	0	113.8	H121 Y166	A117-H121 CarbonylContact C-O 3.59Å; A117-H121 WeakPolarHBondContact CA-O 3.48Å; A117-H121 WeakPolarHBondContact CB-O 3.43Å; A117-Y166 HydrophobicContact CB-CD1 4.3Å; A117-Y166 HydrophobicContact CB-CD2 4.48Å; A117-Y166 HydrophobicContact CB-CE1 3.57Å; A117-Y166 HydrophobicContact CB-CE2 3.76Å; A117-Y166 WeakPolarHBondContact CB-OH 3.44Å; A117-Y166 PolarHBondContact N-OH 3.43Å
118	T	92.6	Very high	92.6	Very high	60 Å²	60	63.9 Å²	63.9	37%	0.368	35%	0.352	S	S	.	.			trans	-111.3	-178.4	178.7	78.2	0	0	0	0	110.2	R70 T120 H121	R70-T118 PolarHBondContact NH1-O 2.97Å; R70-T118 PolarHBondContact NH2-O 3.29Å; T118-T120 PolarHBondContact O-N 3.45Å; T118-T120 PolarHBondContact OG1-N 3.3Å; T118-T120 PolarHBondContact OG1-OG1 2.92Å; T118-H121 HydrophobicContact CG2-CB 4.41Å; T118-H121 PolarHBondContact N-O 2.96Å; T118-H121 WeakPolarHBondContact OG1-CB 3.3Å; T118-H121 PolarHBondContact OG1-N 3.24Å
119	P	90.1	Very high	92.5	Very high	86 Å²	86	63.8 Å²	63.8	56%	0.558	35%	0.352	S	S	*	.	S	Bend	trans	-61.8	-17.4	171.7	-26.3	37.3	0	0	0	115.1	T31 W124	T31-P119 HydrophobicContact CG2-CB 4.44Å; P119-W124 PolarHBondContact O-NE1 2.69Å
120	T	89.1	Confident	92.4	Very high	109 Å²	109	65.7 Å²	65.7	67%	0.669	37%	0.367	S	S	*	.	S	Bend	trans	-122.2	-12.7	-177.9	53.8	0	0	0	0	114.2	T118	T118-T120 PolarHBondContact O-N 3.45Å; T118-T120 PolarHBondContact OG1-N 3.3Å; T118-T120 PolarHBondContact OG1-OG1 2.92Å
121	H	91.4	Very high	92.5	Very high	83 Å²	83	68.2 Å²	68.2	38%	0.384	38%	0.379	S	S	.	.	S	Bend	trans	-121.3	139.5	179.4	-178.2	82	0	0	0	111.2	R70 A117 T118	R70-H121 PolarHBondContact NH1-O 3.23Å; A117-H121 CarbonylContact C-O 3.59Å; A117-H121 WeakPolarHBondContact CA-O 3.48Å; A117-H121 WeakPolarHBondContact CB-O 3.43Å; T118-H121 HydrophobicContact CG2-CB 4.41Å; T118-H121 PolarHBondContact N-O 2.96Å; T118-H121 WeakPolarHBondContact OG1-CB 3.3Å; T118-H121 PolarHBondContact OG1-N 3.24Å
122	P	92.7	Very high	92.5	Very high	1 Å²	1	67.2 Å²	67.2	1%	0.006	38%	0.381	C	S	.	.	S	Bend	cis	-61.6	156.7	-15.9	31.1	-40.1	0	0	0	111.7	Y110 P128 Y129	Y110-P122 HydrophobicContact CD1-CB 4.22Å; Y110-P122 HydrophobicContact CD1-CG 3.54Å; Y110-P122 HydrophobicContact CD2-CB 4.32Å; Y110-P122 HydrophobicContact CD2-CG 4.26Å; Y110-P122 HydrophobicContact CE1-CB 4.02Å; Y110-P122 HydrophobicContact CE1-CG 3.74Å; Y110-P122 HydrophobicContact CE2-CB 4.17Å; Y110-P122 HydrophobicContact CE2-CG 4.47Å; Y110-P122 HydrophobicContact CG-CB 4.34Å; Y110-P122 HydrophobicContact CG-CG 3.79Å; P122-P128 HydrophobicContact CB-CG 3.7Å; P122-Y129 HydrophobicContact CB-CE2 4.3Å; P122-Y129 HydrophobicContact CG-CE1 4.42Å; P122-Y129 HydrophobicContact CG-CE2 3.81Å; P122-Y129 WeakPolarHBondContact CG-OH 3.48Å
123	A	92.7	Very high	92.6	Very high	45 Å²	45	68 Å²	68	37%	0.372	39%	0.387	S	S	.	.			trans	-62	137.7	-173.5	0	0	0	0	0	112.7	M125 Y129	A123-M125 VanDerWaalsContact C-N 3.29Å; A123-M125 HydrophobicContact CB-CG 4.08Å; A123-M125 HydrophobicContact CB-SD 4.22Å; A123-M125 PolarHBondContact O-N 3.4Å; A123-Y129 WeakPolarHBondContact O-CD2 3.25Å; A123-Y129 VanDerWaalsContact O-CE2 3.22Å; A123-Y129 WeakPolarHBondContact O-CE2 3.23Å
124	W	92.7	Very high	92.6	Very high	26 Å²	26	65.4 Å²	65.4	10%	0.098	38%	0.382	C	S	.	.	S	Bend	trans	-74.5	67.7	-172.7	-63.8	100.6	0	0	0	114.1	T31 H33 W68 R70 P119	T31-W124 HydrophobicContact CG2-CH2 4.24Å; T31-W124 HydrophobicContact CG2-CZ2 3.75Å; T31-W124 WeakPolarHBondContact O-CH2 3.19Å; H33-W124 HydrophobicContact CB-CB 4.43Å; H33-W124 HydrophobicContact CB-CD2 3.48Å; H33-W124 VanDerWaalsContact CB-CD2 3.48Å; H33-W124 VanDerWaalsContact CB-CE2 3.49Å; H33-W124 HydrophobicContact CB-CE3 3.94Å; H33-W124 HydrophobicContact CB-CG 3.72Å; H33-W124 HydrophobicContact CB-CH2 4.28Å; H33-W124 HydrophobicContact CB-CZ2 3.92Å; H33-W124 HydrophobicContact CB-CZ3 4.31Å; H33-W124 AromaticContact CD2-CG 3.73Å; H33-W124 AromaticContact CE1-CD1 3.74Å; H33-W124 AromaticContact CG-CD1 3.46Å; H33-W124 VanDerWaalsContact CG-CD1 3.46Å; H33-W124 AromaticContact CG-CD2 3.78Å; H33-W124 AromaticContact CG-CE2 3.99Å; H33-W124 AromaticContact CG-CG 3.41Å; H33-W124 VanDerWaalsContact CG-CG 3.41Å; H33-W124 AromaticContact CG-NE1 3.81Å; H33-W124 AromaticContact ND1-CD1 3.23Å; H33-W124 AromaticContact ND1-CG 3.67Å; H33-W124 AromaticContact ND1-NE1 3.63Å; W68-W124 HydrophobicContact CB-CD2 4.41Å; W68-W124 HydrophobicContact CB-CE3 3.41Å; W68-W124 VanDerWaalsContact CB-CE3 3.41Å; W68-W124 HydrophobicContact CB-CZ3 3.51Å; W68-W124 HydrophobicContact CD2-CE3 4.2Å; W68-W124 HydrophobicContact CE3-CE3 4.35Å; W68-W124 AromaticContact CG-CE3 3.86Å; W68-W124 HydrophobicContact CG-CE3 3.86Å; W68-W124 HydrophobicContact CG-CZ3 4.4Å; R70-W124 HydrophobicContact CB-CH2 3.39Å; R70-W124 HydrophobicContact CB-CZ2 4.48Å; R70-W124 HydrophobicContact CB-CZ3 3.67Å; R70-W124 HydrophobicContact CG-CH2 4.48Å; P119-W124 PolarHBondContact O-NE1 2.69Å
125	M	91.3	Very high	92.7	Very high	105 Å²	105	63 Å²	63	52%	0.517	36%	0.363	S	S	.	.	S	Bend	trans	-156.7	162	-174.8	51.3	179.7	-66.7	0	0	111.7	A123 N127 Y129	A123-M125 VanDerWaalsContact C-N 3.29Å; A123-M125 HydrophobicContact CB-CG 4.08Å; A123-M125 HydrophobicContact CB-SD 4.22Å; A123-M125 PolarHBondContact O-N 3.4Å; M125-N127 WeakPolarHBondContact CE-O 3.18Å; M125-N127 VanDerWaalsContact CG-O 3.29Å; M125-N127 WeakPolarHBondContact CG-O 3.47Å; M125-N127 PolarHBondContact O-N 3.44Å; M125-Y129 WeakPolarHBondContact O-CD2 3.38Å
126	E	85.9	Confident	92.7	Very high	110 Å²	110	60.1 Å²	60.1	51%	0.514	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-0.2	-175.2	-55.5	-172.9	165.1	0	0	115.3	Y108 Y129	Y108-E126 HydrophobicContact CE1-CB 4.36Å; Y108-E126 HydrophobicContact CE1-CG 3.9Å; Y108-E126 PolarHBondContact OH-OE1 3.41Å; Y108-E126 VanDerWaalsContact OH-OE1 3.1Å; E126-Y129 CarbonylContact C-O 3.56Å
127	N	87.1	Confident	92.6	Very high	131 Å²	131	56.5 Å²	56.5	70%	0.701	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.6	109.3	164.5	-81.6	-58.8	0	0	0	107.1	M125	M125-N127 WeakPolarHBondContact CE-O 3.18Å; M125-N127 VanDerWaalsContact CG-O 3.29Å; M125-N127 WeakPolarHBondContact CG-O 3.47Å; M125-N127 PolarHBondContact O-N 3.44Å
128	P	92.3	Very high	92.4	Very high	55 Å²	55	60.5 Å²	60.5	36%	0.357	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	cis	-100.9	5.2	32.7	38.9	-39.1	0	0	0	116	Y110 P122 T130	Y110-P128 HydrophobicContact CD2-CB 3.91Å; Y110-P128 HydrophobicContact CD2-CG 3.9Å; Y110-P128 HydrophobicContact CE2-CB 3.74Å; Y110-P128 HydrophobicContact CE2-CG 3.78Å; P122-P128 HydrophobicContact CB-CG 3.7Å; P128-T130 PolarHBondContact O-N 2.04Å
129	Y	95.1	Very high	92.3	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	36%	0.359	C	S	.	.	S	Bend	trans	-77.8	114.2	179.9	-75.8	-89.4	0	0	0	112.3	R70 Y109 P122 A123 M125 E126 A168	R70-Y129 WeakPolarHBondContact CD-OH 3.46Å; Y109-Y129 CarbonylContact O-C 3.55Å; P122-Y129 HydrophobicContact CB-CE2 4.3Å; P122-Y129 HydrophobicContact CG-CE1 4.42Å; P122-Y129 HydrophobicContact CG-CE2 3.81Å; P122-Y129 WeakPolarHBondContact CG-OH 3.48Å; A123-Y129 WeakPolarHBondContact O-CD2 3.25Å; A123-Y129 VanDerWaalsContact O-CE2 3.22Å; A123-Y129 WeakPolarHBondContact O-CE2 3.23Å; M125-Y129 WeakPolarHBondContact O-CD2 3.38Å; E126-Y129 CarbonylContact C-O 3.56Å; Y129-A168 HydrophobicContact CD1-CB 3.93Å; Y129-A168 HydrophobicContact CE1-CB 3.66Å
130	T	95.4	Very high	92.2	Very high	69 Å²	69	60.6 Å²	60.6	42%	0.423	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	130.3	174.7	-55.3	0	0	0	0	110.8	Y108 Y109 P128 A132	Y108-T130 CarbonylContact C-O 3.48Å; Y108-T130 WeakPolarHBondContact CA-O 3.36Å; Y108-T130 WeakPolarHBondContact CB-O 3.47Å; Y109-T130 HydrophobicContact CD1-CG2 4.47Å; Y109-T130 VanDerWaalsContact CD1-O 3.32Å; Y109-T130 WeakPolarHBondContact CD1-O 3.31Å; Y109-T130 HydrophobicContact CE1-CG2 3.6Å; Y109-T130 PolarHBondContact N-O 2.65Å; Y109-T130 PolarHBondContact O-N 2.93Å; P128-T130 PolarHBondContact O-N 2.04Å; T130-A132 PolarHBondContact O-N 3.23Å
131	K	96.1	Very high	92.1	Very high	96 Å²	96	56.7 Å²	56.7	42%	0.417	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	122.2	177	-165.8	167.7	-173.5	157	0	111	N106 Y108	N106-K131 VanDerWaalsContact CG-NZ 3.3Å; N106-K131 PolarHBondContact ND2-NZ 2.64Å; N106-K131 WeakPolarHBondContact OD1-CE 3.15Å; N106-K131 PolarHBondContact OD1-NZ 2.8Å; Y108-K131 VanDerWaalsContact CD1-CA 3.4Å; Y108-K131 HydrophobicContact CD1-CB 3.69Å; Y108-K131 HydrophobicContact CD1-CG 4.03Å; Y108-K131 HydrophobicContact CE1-CB 3.48Å; Y108-K131 VanDerWaalsContact CE1-CB 3.48Å; Y108-K131 HydrophobicContact CE1-CD 3.85Å; Y108-K131 HydrophobicContact CE1-CG 3.59Å; Y108-K131 PolarHBondContact OH-NZ 2.91Å
132	A	95.3	Very high	91.6	Very high	38 Å²	38	60.6 Å²	60.6	31%	0.314	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-50.5	175.8	0	0	0	0	0	111.8	L107 Y109 T130 L157	L107-A132 HydrophobicContact CB-CB 4.32Å; L107-A132 HydrophobicContact CD2-CB 3.94Å; L107-A132 HydrophobicContact CG-CB 4.1Å; L107-A132 PolarHBondContact O-N 2.95Å; Y109-A132 HydrophobicContact CD1-CB 4.11Å; Y109-A132 HydrophobicContact CE1-CB 4.42Å; T130-A132 PolarHBondContact O-N 3.23Å; A132-L157 HydrophobicContact CB-CD2 3.56Å
133	A	96	Very high	90.4	Very high	22 Å²	22	70.9 Å²	70.9	18%	0.182	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	155.8	-179.3	0	0	0	0	0	112.5	N106 L107 V135 L155	N106-A133 WeakPolarHBondContact CA-O 3.38Å; L107-A133 PolarHBondContact N-O 2.61Å; L107-A133 PolarHBondContact O-N 2.73Å; A133-V135 HydrophobicContact CB-CG2 4.27Å; A133-L155 HydrophobicContact CB-CD1 3.95Å; A133-L155 HydrophobicContact CB-CD2 3.8Å
134	A	96.1	Very high	89	Confident	66 Å²	66	72.8 Å²	72.8	55%	0.545	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	117.8	151.8	0	0	0	0	0	107.8	N106	N106-A134 WeakPolarHBondContact OD1-CB 3.36Å
135	V	96.3	Very high	87.4	Confident	2 Å²	2	74 Å²	74	1%	0.012	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	114.3	-177.3	-174.8	0	0	0	0	109.1	F88 T104 F105 L107 A133 K153 L155	F88-V135 HydrophobicContact CE1-CG1 3.8Å; F88-V135 HydrophobicContact CZ-CG1 3.73Å; T104-V135 VanDerWaalsContact CA-O 3.26Å; T104-V135 WeakPolarHBondContact CA-O 3.47Å; F105-V135 HydrophobicContact CD1-CB 4.03Å; F105-V135 HydrophobicContact CD1-CG1 4.31Å; F105-V135 HydrophobicContact CD2-CB 4.28Å; F105-V135 HydrophobicContact CE1-CB 3.61Å; F105-V135 HydrophobicContact CE1-CG1 3.48Å; F105-V135 VanDerWaalsContact CE1-CG1 3.48Å; F105-V135 HydrophobicContact CE1-CG2 4.49Å; F105-V135 HydrophobicContact CE2-CB 3.85Å; F105-V135 HydrophobicContact CE2-CG1 4.31Å; F105-V135 HydrophobicContact CE2-CG2 3.9Å; F105-V135 HydrophobicContact CG-CB 4.36Å; F105-V135 HydrophobicContact CZ-CB 3.52Å; F105-V135 HydrophobicContact CZ-CG1 3.49Å; F105-V135 VanDerWaalsContact CZ-CG1 3.49Å; F105-V135 HydrophobicContact CZ-CG2 3.91Å; F105-V135 PolarHBondContact N-O 2.88Å; F105-V135 PolarHBondContact O-N 3.45Å; L107-V135 HydrophobicContact CB-CG2 4.45Å; A133-V135 HydrophobicContact CB-CG2 4.27Å; V135-K153 HydrophobicContact CG1-CB 4.14Å; V135-K153 HydrophobicContact CG1-CG 4.16Å; V135-L155 HydrophobicContact CG2-CD1 3.92Å
136	A	93.6	Very high	85.6	Confident	43 Å²	43	74.3 Å²	74.3	36%	0.355	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	152.8	171	0	0	0	0	0	110.8	T104	T104-A136 HydrophobicContact CG2-CB 3.88Å
137	A	90.9	Very high	84.3	Confident	19 Å²	19	74.9 Å²	74.9	16%	0.157	44%	0.44	C	S	.	.			trans	-82.3	137.8	170.2	0	0	0	0	0	111.2	F88 M90 L140 N151	F88-A137 HydrophobicContact CE2-CB 3.91Å; F88-A137 HydrophobicContact CZ-CB 4.28Å; M90-A137 HydrophobicContact CB-CB 3.84Å; M90-A137 HydrophobicContact CG-CB 4.35Å; M90-A137 HydrophobicContact SD-CB 4.11Å; A137-L140 HydrophobicContact CB-CD2 3.85Å; A137-N151 WeakPolarHBondContact CA-OD1 3.41Å
138	D	88.2	Confident	83.3	Confident	105 Å²	105	79.8 Å²	79.8	56%	0.561	45%	0.448	S	S	*	.	S	Bend	trans	-83.2	-20.7	169	-54.4	-52.5	0	0	0	110.7	N151 K153	D138-N151 PolarHBondContact N-OD1 3Å; D138-K153 IonicContact OD1-NZ 2.92Å
139	H	89.6	Confident	82.7	Confident	87 Å²	87	83.2 Å²	83.2	40%	0.403	45%	0.454	S	S	.	.	S	Bend	trans	-134.1	121.2	179.8	-65.2	-18.3	0	0	0	111.3	R149 N151	H139-R149 HydrophobicContact CB-CB 4.39Å; H139-N151 PolarHBondContact N-OD1 3.04Å; H139-N151 PolarHBondContact O-ND2 3.12Å; H139-N151 PolarHBondContact O-OD1 2.82Å
140	L	89.3	Confident	82.3	Confident	61 Å²	61	85 Å²	85	32%	0.319	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-103.8	137.2	179.5	-63.6	168	0	0	0	111.4	M90 E92 E103 A137	M90-L140 HydrophobicContact CB-CD2 4.18Å; M90-L140 HydrophobicContact CG-CD2 3.94Å; M90-L140 WeakPolarHBondContact O-CA 3.43Å; E92-L140 HydrophobicContact CB-CB 4.04Å; E92-L140 HydrophobicContact CB-CD1 4.48Å; E92-L140 HydrophobicContact CG-CD1 4.31Å; E103-L140 HydrophobicContact CB-CD2 4.11Å; E103-L140 VanDerWaalsContact CD-CD1 3.49Å; E103-L140 HydrophobicContact CG-CD1 4.35Å; E103-L140 HydrophobicContact CG-CD2 4.14Å; E103-L140 WeakPolarHBondContact OE2-CD1 3.36Å; A137-L140 HydrophobicContact CB-CD2 3.85Å
141	L	85.6	Confident	82.2	Confident	26 Å²	26	81.9 Å²	81.9	14%	0.136	45%	0.447	C	S	.	.	B	Isolated β-bridge	trans	-83.4	130.7	177.4	-66	-176.3	0	0	0	111.2	T89 M90 M91 E92	T89-L141 HydrophobicContact CG2-CD1 3.97Å; M90-L141 PolarHBondContact O-N 3.33Å; M91-L141 HydrophobicContact CE-CB 4.44Å; M91-L141 HydrophobicContact SD-CB 3.55Å; M91-L141 VanDerWaalsContact SD-CB 3.55Å; M91-L141 HydrophobicContact SD-CD1 4.2Å; E92-L141 PolarHBondContact N-O 3.43Å
142	R	82.2	Confident	82.1	Confident	165 Å²	165	81.9 Å²	81.9	62%	0.623	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-99.6	143.3	175.4	-75.8	-175.5	170.1	150.4	5.7	111.9	E92 G144 G145	E92-R142 HydrophobicContact CB-CG 4.48Å; E92-R142 VanDerWaalsContact CD-NE 3.34Å; E92-R142 IonicContact OE1-CZ 2.78Å; E92-R142 IonicContact OE1-NE 3.12Å; E92-R142 PolarHBondContact OE1-NE 3.33Å; E92-R142 IonicContact OE1-NH2 3.87Å; E92-R142 PolarHBondContact OE1-NH2 3.24Å; E92-R142 VanDerWaalsContact OE2-CG 3.28Å; E92-R142 WeakPolarHBondContact OE2-CG 3.3Å; E92-R142 IonicContact OE2-CZ 3.42Å; E92-R142 IonicContact OE2-NE 3.39Å; E92-R142 PolarHBondContact OE2-NE 3.24Å; E92-R142 IonicContact OE2-NH2 2.73Å; R142-G144 PolarHBondContact O-N 3.01Å; R142-G144 VanDerWaalsContact O-N 3.14Å; R142-G145 PolarHBondContact O-N 2.96Å; R142-G145 VanDerWaalsContact O-N 3.11Å
143	R	67.7	Low	82.1	Confident	217 Å²	217	83.3 Å²	83.3	82%	0.819	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	111.5	178.2	-158.8	176	-168.2	178.8	3.4	109.7
144	G	61.6	Low	82.1	Confident	86 Å²	86	86.5 Å²	86.5	89%	0.887	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.1	4.2	-176.8	0	0	0	0	0	115.7	R142	R142-G144 PolarHBondContact O-N 3.01Å; R142-G144 VanDerWaalsContact O-N 3.14Å
145	G	59.6	Low	82.1	Confident	52 Å²	52	84.7 Å²	84.7	54%	0.536	45%	0.445	S	S	.	.			trans	-73.2	139.9	172.3	0	0	0	0	0	112.6	R142	R142-G145 PolarHBondContact O-N 2.96Å; R142-G145 VanDerWaalsContact O-N 3.11Å
146	A	53.2	Low	81.9	Confident	110 Å²	110	89.4 Å²	89.4	91%	0.909	46%	0.463	S	S	*	.	S	Bend	trans	-79.4	-24.3	-178.5	0	0	0	0	0	114.2
147	E	58.5	Low	82	Confident	123 Å²	123	87.6 Å²	87.6	58%	0.575	45%	0.447	S	S	*	.			trans	-91.8	117.5	177.5	-72.3	-171.6	153.3	0	0	111.8	R149	E147-R149 HydrophobicContact CB-CG 4.39Å; E147-R149 PolarHBondContact O-N 3.03Å; E147-R149 IonicContact OE1-NH2 3.6Å; E147-R149 PolarHBondContact OE1-NH2 3.4Å; E147-R149 IonicContact OE2-CZ 2.85Å; E147-R149 IonicContact OE2-NE 2.69Å; E147-R149 PolarHBondContact OE2-NE 3.18Å; E147-R149 IonicContact OE2-NH2 3.93Å; E147-R149 PolarHBondContact OE2-NH2 3.47Å
148	R	67.8	Low	82	Confident	234 Å²	234	91.6 Å²	91.6	88%	0.883	46%	0.462	S	S	*	.			trans	-89.4	88.5	164.2	-77.9	178.5	170.2	171.5	-4.7	109.6
149	R	78.4	Confident	82	Confident	127 Å²	127	89.3 Å²	89.3	48%	0.479	46%	0.463	S	S	.	.			trans	-82.7	135	171	-61.8	-173.2	-175.4	-146.2	-4.5	110.4	H139 E147	H139-R149 HydrophobicContact CB-CB 4.39Å; E147-R149 HydrophobicContact CB-CG 4.39Å; E147-R149 PolarHBondContact O-N 3.03Å; E147-R149 IonicContact OE1-NH2 3.6Å; E147-R149 PolarHBondContact OE1-NH2 3.4Å; E147-R149 IonicContact OE2-CZ 2.85Å; E147-R149 IonicContact OE2-NE 2.69Å; E147-R149 PolarHBondContact OE2-NE 3.18Å; E147-R149 IonicContact OE2-NH2 3.93Å; E147-R149 PolarHBondContact OE2-NH2 3.47Å
150	S	87.9	Confident	82	Confident	37 Å²	37	85.3 Å²	85.3	26%	0.259	45%	0.445	S	S	.	.			trans	-91.6	155.8	171.5	62	0	0	0	0	110.4	E48	E48-S150 PolarHBondContact OE1-OG 3.11Å
151	N	92.5	Very high	82	Confident	3 Å²	3	90.3 Å²	90.3	2%	0.016	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	146.7	171.8	-64.8	-91.9	0	0	0	109.1	R87 F88 A137 D138 H139	R87-N151 VanDerWaalsContact CA-O 3.26Å; R87-N151 WeakPolarHBondContact CA-O 3.28Å; F88-N151 HydrophobicContact CD1-CB 3.89Å; F88-N151 HydrophobicContact CD2-CB 4.31Å; F88-N151 HydrophobicContact CE1-CB 3.55Å; F88-N151 HydrophobicContact CE2-CB 4.03Å; F88-N151 HydrophobicContact CG-CB 4.25Å; F88-N151 HydrophobicContact CZ-CB 3.63Å; F88-N151 PolarHBondContact N-O 3.36Å; F88-N151 WeakPolarHBondContact O-CB 3.36Å; F88-N151 PolarHBondContact O-N 3.01Å; F88-N151 PolarHBondContact O-ND2 3.43Å; A137-N151 WeakPolarHBondContact CA-OD1 3.41Å; D138-N151 PolarHBondContact N-OD1 3Å; H139-N151 PolarHBondContact N-OD1 3.04Å; H139-N151 PolarHBondContact O-ND2 3.12Å; H139-N151 PolarHBondContact O-OD1 2.82Å
152	L	94	Very high	82.1	Confident	96 Å²	96	89.6 Å²	89.6	50%	0.503	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	115.7	176.8	-176.8	73.4	0	0	0	109.3	E85 I86 R87	E85-L152 HydrophobicContact CG-CD1 3.49Å; E85-L152 VanDerWaalsContact CG-CD1 3.49Å; E85-L152 HydrophobicContact CG-CG 4.48Å; E85-L152 WeakPolarHBondContact OE1-CD1 3.32Å; I86-L152 WeakPolarHBondContact O-CA 3.46Å; R87-L152 HydrophobicContact CG-CD1 3.47Å; R87-L152 VanDerWaalsContact CG-CD1 3.47Å
153	K	95.4	Very high	82.6	Confident	68 Å²	68	83.9 Å²	83.9	30%	0.296	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126.9	172.1	-147.8	72.9	175.4	-177.8	0	110.9	E85 I86 F88 V135 D138 L155	E85-K153 CarbonylContact C-O 3.29Å; E85-K153 WeakPolarHBondContact CA-O 3.35Å; I86-K153 PolarHBondContact N-O 3.48Å; I86-K153 PolarHBondContact O-N 2.85Å; F88-K153 HydrophobicContact CE1-CB 4.34Å; V135-K153 HydrophobicContact CG1-CB 4.14Å; V135-K153 HydrophobicContact CG1-CG 4.16Å; D138-K153 IonicContact OD1-NZ 2.92Å; K153-L155 HydrophobicContact CG-CD2 4.18Å; K153-L155 HydrophobicContact CG-CG 4.38Å
154	L	95.4	Very high	83.9	Confident	89 Å²	89	73.6 Å²	73.6	47%	0.466	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	123.5	168.5	-172.6	67.7	0	0	0	108.5	Y83 V84 E85 F184	Y83-L154 HydrophobicContact CD1-CD2 4.45Å; Y83-L154 HydrophobicContact CD1-CG 4.48Å; V84-L154 WeakPolarHBondContact O-CA 3.46Å; E85-L154 HydrophobicContact CB-CD1 4.1Å; L154-F184 HydrophobicContact CD1-CE1 4.01Å; L154-F184 HydrophobicContact CD1-CZ 4.06Å
155	L	95.9	Very high	85.6	Confident	28 Å²	28	69.5 Å²	69.5	15%	0.147	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	145.4	177	-61.6	173.1	0	0	0	109.7	Y83 V84 I86 L107 A133 V135 K153	Y83-L155 CarbonylContact C-O 3.57Å; Y83-L155 WeakPolarHBondContact CA-O 3.48Å; V84-L155 HydrophobicContact CB-CB 4.48Å; V84-L155 PolarHBondContact N-O 3.2Å; V84-L155 PolarHBondContact O-N 3.35Å; I86-L155 HydrophobicContact CD1-CD1 4.01Å; L107-L155 HydrophobicContact CB-CD1 4.35Å; L107-L155 HydrophobicContact CD2-CD1 3.54Å; A133-L155 HydrophobicContact CB-CD1 3.95Å; A133-L155 HydrophobicContact CB-CD2 3.8Å; V135-L155 HydrophobicContact CG2-CD1 3.92Å; K153-L155 HydrophobicContact CG-CD2 4.18Å; K153-L155 HydrophobicContact CG-CG 4.38Å
156	R	93.5	Very high	87.4	Confident	102 Å²	102	67.1 Å²	67.1	39%	0.385	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127	178.1	-168.5	-180	-175.5	-158.1	10.4	108.7	T81 Y83 E158 E235	T81-R156 HydrophobicContact CG2-CG 3.59Å; Y83-R156 HydrophobicContact CD1-CB 4.47Å; Y83-R156 HydrophobicContact CD1-CG 4.38Å; Y83-R156 HydrophobicContact CE1-CB 4.37Å; Y83-R156 HydrophobicContact CE1-CG 3.97Å; R156-E158 WeakPolarHBondContact CD-OE1 3.14Å; R156-E158 HydrophobicContact CG-CG 3.93Å; R156-E158 IonicContact CZ-OE1 3.27Å; R156-E158 IonicContact NE-OE1 3.34Å; R156-E158 PolarHBondContact NE-OE1 2.97Å; R156-E158 IonicContact NH1-OE1 3.16Å; R156-E158 PolarHBondContact NH1-OE1 3.46Å; R156-E235 IonicContact CZ-OE2 2.67Å; R156-E235 IonicContact NH1-OE2 2.68Å; R156-E235 IonicContact NH2-OE2 3.97Å; R156-E235 PolarHBondContact NH2-OE2 3.45Å
157	L	94.5	Very high	89.5	Confident	4 Å²	4	61.9 Å²	61.9	2%	0.021	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	114.9	173.6	-56	-177	0	0	0	107.5	T81 L82 V84 Y109 A132 L160 L165 L167	T81-L157 CarbonylContact C-O 3.4Å; T81-L157 VanDerWaalsContact CA-O 3.23Å; T81-L157 WeakPolarHBondContact CA-O 3.1Å; L82-L157 PolarHBondContact N-O 3.37Å; L82-L157 PolarHBondContact O-N 2.93Å; V84-L157 HydrophobicContact CG2-CD1 3.75Å; V84-L157 HydrophobicContact CG2-CG 4.09Å; Y109-L157 HydrophobicContact CD1-CD2 4.04Å; Y109-L157 HydrophobicContact CE1-CD2 4.16Å; Y109-L157 HydrophobicContact CG-CD1 4.35Å; A132-L157 HydrophobicContact CB-CD2 3.56Å; L157-L160 HydrophobicContact CB-CD1 4.15Å; L157-L160 HydrophobicContact CB-CD2 4.47Å; L157-L165 HydrophobicContact CD1-CD2 4.34Å; L157-L167 HydrophobicContact CD1-CD2 3.87Å
158	E	91.5	Very high	91.4	Very high	104 Å²	104	56 Å²	56	49%	0.486	28%	0.277	S	S	.	.			trans	-110.2	167.5	-175.6	-61.5	179.9	-172.8	0	0	111.4	T81 R156 L160	T81-E158 HydrophobicContact CG2-CG 4.31Å; R156-E158 WeakPolarHBondContact CD-OE1 3.14Å; R156-E158 HydrophobicContact CG-CG 3.93Å; R156-E158 IonicContact CZ-OE1 3.27Å; R156-E158 IonicContact NE-OE1 3.34Å; R156-E158 PolarHBondContact NE-OE1 2.97Å; R156-E158 IonicContact NH1-OE1 3.16Å; R156-E158 PolarHBondContact NH1-OE1 3.46Å; E158-L160 VanDerWaalsContact C-N 3.25Å; E158-L160 PolarHBondContact O-N 3.09Å
159	G	87.2	Confident	92.8	Very high	56 Å²	56	44.9 Å²	44.9	58%	0.577	24%	0.235	S	C	*	.			trans	65.2	26.1	172.8	0	0	0	0	0	114.2	Q161	G159-Q161 PolarHBondContact O-N 2.83Å
160	L	91.1	Very high	93.7	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.021	21%	0.213	C	C	.	.			trans	-76.1	122.9	-177.5	-60	172.3	0	0	0	110.7	R76 T80 L82 Y109 Q111 L157 E158 L165	R76-L160 VanDerWaalsContact CD-CB 3.47Å; T80-L160 WeakPolarHBondContact O-CB 3.48Å; T80-L160 PolarHBondContact O-N 3.2Å; T80-L160 VanDerWaalsContact O-N 3.16Å; L82-L160 HydrophobicContact CB-CD1 4Å; L82-L160 HydrophobicContact CD1-CD1 4.13Å; L82-L160 HydrophobicContact CG-CD1 3.64Å; Y109-L160 HydrophobicContact CD2-CD2 4.01Å; Y109-L160 HydrophobicContact CE2-CD2 3.56Å; Q111-L160 HydrophobicContact CG-CD2 4.09Å; L157-L160 HydrophobicContact CB-CD1 4.15Å; L157-L160 HydrophobicContact CB-CD2 4.47Å; E158-L160 VanDerWaalsContact C-N 3.25Å; E158-L160 PolarHBondContact O-N 3.09Å; L160-L165 HydrophobicContact CD1-CD2 3.75Å; L160-L165 HydrophobicContact CD2-CD2 3.78Å; L160-L165 HydrophobicContact CG-CD2 4.4Å
161	Q	88.6	Confident	94	Very high	166 Å²	166	37.3 Å²	37.3	78%	0.776	20%	0.201	S	C	*	.			trans	-108.7	-44.1	-176.4	-59.6	-169.2	9.1	0	0	112.2	R76 G159	R76-Q161 PolarHBondContact NH2-O 3.1Å; R76-Q161 VanDerWaalsContact NH2-O 3.09Å; G159-Q161 PolarHBondContact O-N 2.83Å
162	G	87.1	Confident	94.1	Very high	11 Å²	11	39.9 Å²	39.9	11%	0.113	21%	0.213	C	C	.	.	S	Bend	trans	-64	159.3	-177	0	0	0	0	0	113.8	R76 D113 G164	R76-G162 PolarHBondContact NE-O 3.45Å; D113-G162 VanDerWaalsContact OD1-CA 3.24Å; D113-G162 WeakPolarHBondContact OD1-CA 3.16Å; G162-G164 PolarHBondContact O-N 3.41Å
163	A	93.8	Very high	93.9	Very high	44 Å²	44	35.3 Å²	35.3	36%	0.364	19%	0.189	S	C	.	.	S	Bend	trans	-66	-20.8	-175.5	0	0	0	0	0	114.4	W73 R76 D113	W73-A163 HydrophobicContact CZ2-CB 4.3Å; R76-A163 WeakPolarHBondContact CB-O 3.43Å; R76-A163 PolarHBondContact N-O 2.9Å; D113-A163 HydrophobicContact CB-CB 4.37Å; D113-A163 PolarHBondContact OD1-N 3.18Å
164	G	95.4	Very high	93.8	Very high	1 Å²	1	32 Å²	32	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	-174.4	172.5	0	0	0	0	0	112.5	I74 A112 G162	I74-G164 CarbonylContact O-C 3.6Å; I74-G164 WeakPolarHBondContact O-CA 3.31Å; A112-G164 PolarHBondContact N-O 2.7Å; A112-G164 CarbonylContact O-C 3.46Å; A112-G164 PolarHBondContact O-N 3.16Å; A112-G164 VanDerWaalsContact O-O 3.04Å; G162-G164 PolarHBondContact O-N 3.41Å
165	L	96.9	Very high	93.7	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	159.9	177.1	65.6	88.5	0	0	0	113.2	I74 L82 Y110 Q111 L157 L160 L167	I74-L165 WeakPolarHBondContact CB-O 3.03Å; I74-L165 PolarHBondContact N-O 3.45Å; I74-L165 PolarHBondContact O-N 3.05Å; L82-L165 HydrophobicContact CD1-CD2 3.93Å; L82-L165 HydrophobicContact CD1-CG 4.49Å; Y110-L165 CarbonylContact O-C 3.53Å; Y110-L165 WeakPolarHBondContact O-CA 3.28Å; Y110-L165 VanDerWaalsContact O-CB 3.3Å; Y110-L165 WeakPolarHBondContact O-CB 3.48Å; Q111-L165 HydrophobicContact CG-CB 4.5Å; L157-L165 HydrophobicContact CD1-CD2 4.34Å; L160-L165 HydrophobicContact CD1-CD2 3.75Å; L160-L165 HydrophobicContact CD2-CD2 3.78Å; L160-L165 HydrophobicContact CG-CD2 4.4Å; L165-L167 HydrophobicContact CD1-CD2 3.63Å; L165-L167 HydrophobicContact CD1-CG 3.95Å
166	Y	97.1	Very high	93.6	Very high	1 Å²	1	27.5 Å²	27.5	0%	0.004	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	142	166.2	-56.9	-93.6	0	0	0	109.1	R70 W73 Y109 Y110 A112 D115 E116 A117	R70-Y166 HydrophobicContact CG-CD1 4.36Å; R70-Y166 HydrophobicContact CG-CG 4.46Å; W73-Y166 HydrophobicContact CB-CD1 4.28Å; W73-Y166 HydrophobicContact CB-CE1 3.59Å; W73-Y166 HydrophobicContact CB-CE2 4.41Å; W73-Y166 AromaticContact CD1-CE2 3.67Å; W73-Y166 AromaticContact CD1-CZ 3.74Å; W73-Y166 HydrophobicContact CG-CE1 4.44Å; W73-Y166 HydrophobicContact CG-CE2 4.45Å; W73-Y166 VanDerWaalsContact N-CE1 3.28Å; Y109-Y166 CarbonylContact C-O 3.6Å; Y109-Y166 WeakPolarHBondContact CA-O 3.36Å; Y110-Y166 AromaticContact CD1-CD2 3.92Å; Y110-Y166 HydrophobicContact CD1-CD2 3.92Å; Y110-Y166 HydrophobicContact CD1-CE2 4.33Å; Y110-Y166 PolarHBondContact N-O 3.28Å; Y110-Y166 PolarHBondContact O-N 3.1Å; A112-Y166 HydrophobicContact CB-CD2 4.43Å; A112-Y166 HydrophobicContact CB-CE2 3.88Å; D115-Y166 VanDerWaalsContact CA-OH 3.23Å; D115-Y166 WeakPolarHBondContact CA-OH 3.45Å; D115-Y166 WeakPolarHBondContact OD1-CE1 3.48Å; D115-Y166 PolarHBondContact OD1-OH 2.74Å; E116-Y166 PolarHBondContact N-OH 2.75Å; A117-Y166 HydrophobicContact CB-CD1 4.3Å; A117-Y166 HydrophobicContact CB-CD2 4.48Å; A117-Y166 HydrophobicContact CB-CE1 3.57Å; A117-Y166 HydrophobicContact CB-CE2 3.76Å; A117-Y166 WeakPolarHBondContact CB-OH 3.44Å; A117-Y166 PolarHBondContact N-OH 3.43Å
167	L	97.8	Very high	93.6	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	144.1	165	-61.4	178.1	0	0	0	109.3	R70 T71 I74 V84 L107 L157 L165 F169 V181 V183	R70-L167 WeakPolarHBondContact CA-O 3.31Å; R70-L167 WeakPolarHBondContact CG-O 3.3Å; T71-L167 HydrophobicContact CG2-CB 3.77Å; T71-L167 PolarHBondContact N-O 3.14Å; T71-L167 PolarHBondContact OG1-N 3.11Å; T71-L167 PolarHBondContact OG1-O 3.48Å; I74-L167 HydrophobicContact CD1-CD1 4.18Å; I74-L167 HydrophobicContact CD1-CG 4.14Å; V84-L167 HydrophobicContact CG1-CD1 3.76Å; V84-L167 HydrophobicContact CG2-CD1 4.04Å; V84-L167 HydrophobicContact CG2-CD2 4.23Å; L107-L167 HydrophobicContact CD1-CB 4.26Å; L107-L167 HydrophobicContact CD1-CD2 4.48Å; L157-L167 HydrophobicContact CD1-CD2 3.87Å; L165-L167 HydrophobicContact CD1-CD2 3.63Å; L165-L167 HydrophobicContact CD1-CG 3.95Å; L167-F169 HydrophobicContact CB-CE2 4.31Å; L167-V181 HydrophobicContact CD1-CG1 4.37Å; L167-V183 HydrophobicContact CD1-CG2 3.63Å
168	A	97.7	Very high	93.6	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	127.5	175.8	0	0	0	0	0	111.5	W68 L69 R70 Y108 Y129	W68-A168 HydrophobicContact CE3-CB 4.06Å; W68-A168 HydrophobicContact CZ3-CB 4.32Å; L69-A168 CarbonylContact O-C 3.58Å; L69-A168 WeakPolarHBondContact O-CA 3.41Å; R70-A168 HydrophobicContact CB-CB 4.4Å; R70-A168 HydrophobicContact CG-CB 4.44Å; Y108-A168 PolarHBondContact N-O 2.75Å; Y108-A168 PolarHBondContact O-N 2.8Å; Y129-A168 HydrophobicContact CD1-CB 3.93Å; Y129-A168 HydrophobicContact CE1-CB 3.66Å
169	F	97.6	Very high	93.7	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	120.3	-179.4	-58.7	-97	0	0	0	108.7	W30 W40 W68 L69 T71 I86 F105 L107 L167 L178 V181	W30-F169 HydrophobicContact CE3-CE2 4.42Å; W30-F169 HydrophobicContact CH2-CE2 4.2Å; W30-F169 HydrophobicContact CZ3-CD2 4.17Å; W30-F169 AromaticContact CZ3-CE2 3.64Å; W30-F169 HydrophobicContact CZ3-CE2 3.64Å; W30-F169 HydrophobicContact CZ3-CZ 4.37Å; W40-F169 HydrophobicContact CH2-CB 4.46Å; W40-F169 HydrophobicContact CZ2-CB 4.16Å; W68-F169 CarbonylContact C-O 3.54Å; W68-F169 VanDerWaalsContact CA-O 3.29Å; W68-F169 WeakPolarHBondContact CA-O 3.5Å; L69-F169 HydrophobicContact CB-CB 4.39Å; L69-F169 PolarHBondContact N-O 3.44Å; L69-F169 PolarHBondContact O-N 2.97Å; T71-F169 HydrophobicContact CG2-CE2 4.14Å; I86-F169 HydrophobicContact CD1-CE1 4.08Å; I86-F169 HydrophobicContact CG2-CE1 4.49Å; F105-F169 HydrophobicContact CD2-CD1 4.26Å; F105-F169 AromaticContact CE2-CD1 3.77Å; F105-F169 HydrophobicContact CE2-CD1 3.77Å; F105-F169 HydrophobicContact CE2-CE1 4.3Å; L107-F169 HydrophobicContact CD1-CD1 4.01Å; L107-F169 HydrophobicContact CD1-CE1 3.76Å; L107-F169 HydrophobicContact CD1-CE2 4.39Å; L107-F169 HydrophobicContact CD1-CG 4.42Å; L107-F169 HydrophobicContact CD1-CZ 3.94Å; L167-F169 HydrophobicContact CB-CE2 4.31Å; F169-L178 HydrophobicContact CB-CD1 4.31Å; F169-L178 HydrophobicContact CD1-CD1 3.69Å; F169-L178 HydrophobicContact CD1-CD2 4.04Å; F169-L178 HydrophobicContact CD2-CD1 4.21Å; F169-L178 HydrophobicContact CE1-CD1 4.04Å; F169-L178 HydrophobicContact CE1-CD2 4.08Å; F169-L178 HydrophobicContact CG-CD1 3.81Å; F169-L178 HydrophobicContact CZ-CD1 4.46Å; F169-V181 HydrophobicContact CE1-CG2 4.29Å; F169-V181 HydrophobicContact CZ-CG1 4.16Å; F169-V181 HydrophobicContact CZ-CG2 3.74Å
170	Q	96.3	Very high	94	Very high	6 Å²	6	18.9 Å²	18.9	3%	0.028	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	123.4	179.5	-177.5	-160.4	41.4	0	0	110	S66 Y67 W68 N106 Y108	S66-Q170 WeakPolarHBondContact OG-CG 3.45Å; S66-Q170 PolarHBondContact OG-NE2 2.87Å; Y67-Q170 WeakPolarHBondContact O-CA 3.5Å; W68-Q170 HydrophobicContact CD2-CB 3.96Å; W68-Q170 HydrophobicContact CD2-CG 4Å; W68-Q170 HydrophobicContact CE3-CB 3.94Å; W68-Q170 HydrophobicContact CE3-CG 4.42Å; W68-Q170 HydrophobicContact CG-CG 4.45Å; W68-Q170 HydrophobicContact CH2-CB 4.41Å; W68-Q170 HydrophobicContact CH2-CG 4.46Å; W68-Q170 HydrophobicContact CZ2-CB 4.43Å; W68-Q170 HydrophobicContact CZ2-CG 4.04Å; W68-Q170 HydrophobicContact CZ3-CB 4.18Å; N106-Q170 HydrophobicContact CB-CB 4.23Å; N106-Q170 PolarHBondContact N-O 3.11Å; N106-Q170 PolarHBondContact ND2-OE1 3.36Å; N106-Q170 PolarHBondContact O-N 3.42Å; Y108-Q170 HydrophobicContact CD2-CB 4.17Å; Y108-Q170 HydrophobicContact CE2-CB 3.72Å; Y108-Q170 HydrophobicContact CE2-CG 4.37Å; Y108-Q170 VanDerWaalsContact CE2-OE1 3.26Å; Y108-Q170 PolarHBondContact OH-OE1 3.29Å
171	S	95.2	Very high	94.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	141	171.6	179.2	0	0	0	0	110.7	Y67 A174	Y67-S171 PolarHBondContact N-O 3.36Å; Y67-S171 PolarHBondContact O-N 2.84Å; S171-A174 WeakPolarHBondContact OG-CB 3.35Å; S171-A174 PolarHBondContact OG-N 2.82Å
172	Q	93.1	Very high	94.6	Very high	56 Å²	56	14 Å²	14	26%	0.262	8%	0.08	S	C	.	.	S	Bend	trans	-140.4	85.9	173.4	-73.6	177.3	-0.4	0	0	108.2	K102	K102-Q172 WeakPolarHBondContact CD-O 3.37Å; K102-Q172 VanDerWaalsContact CE-O 3.31Å; K102-Q172 WeakPolarHBondContact CE-O 3.47Å; K102-Q172 WeakPolarHBondContact CG-O 3.49Å
173	G	91	Very high	95	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.075	C	C	.	.	S	Bend	trans	82.3	16.1	-178.7	0	0	0	0	0	115.6	T60 P61 H100 C101 K102	T60-G173 WeakPolarHBondContact O-CA 3.24Å; P61-G173 WeakPolarHBondContact CA-O 3.38Å; H100-G173 WeakPolarHBondContact O-CA 3.34Å; C101-G173 CarbonylContact C-O 3.57Å; C101-G173 VanDerWaalsContact CA-O 3.3Å; C101-G173 WeakPolarHBondContact CA-O 3.35Å; K102-G173 PolarHBondContact N-O 2.84Å
174	A	92.9	Very high	95.1	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.061	C	C	.	.	B	Isolated β-bridge	trans	-86.2	153.4	175.6	0	0	0	0	0	112.3	T60 M90 K102 S171 M176	T60-A174 PolarHBondContact N-O 2.88Å; T60-A174 VanDerWaalsContact N-O 3.13Å; M90-A174 HydrophobicContact CE-CB 4.15Å; K102-A174 WeakPolarHBondContact O-CA 3.47Å; S171-A174 WeakPolarHBondContact OG-CB 3.35Å; S171-A174 PolarHBondContact OG-N 2.82Å; A174-M176 HydrophobicContact CB-CG 4.36Å; A174-M176 HydrophobicContact CB-SD 4.42Å
175	C	93.4	Very high	95	Very high	14 Å²	14	12.2 Å²	12.2	10%	0.095	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	105.4	166.8	-171.1	0	0	0	0	109.3	I58 C59 M91 M96	I58-C175 CarbonylContact O-C 3.57Å; I58-C175 WeakPolarHBondContact O-CA 3.47Å; C59-C175 HydrophobicContact CB-CB 3.93Å; C59-C175 WeakPolarHBondContact CB-SG 3.25Å; C59-C175 WeakPolarHBondContact SG-CB 3.08Å; C59-C175 CovalentContact SG-SG 2.05Å; C59-C175 PolarHBondContact SG-SG 2.91Å; M91-C175 HydrophobicContact CB-CB 4.15Å; M91-C175 HydrophobicContact CG-CB 4.28Å; M91-C175 PolarHBondContact N-O 2.74Å; M96-C175 HydrophobicContact CE-CB 3.82Å; M96-C175 HydrophobicContact SD-CB 3.98Å
176	M	93.8	Very high	94.8	Very high	7 Å²	7	14.4 Å²	14.4	3%	0.034	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	162.4	-165.2	63.9	170.2	-67.2	0	0	112.7	W40 I58 F88 T89 M90 F105 A174 L178	W40-M176 HydrophobicContact CH2-CE 4.12Å; W40-M176 HydrophobicContact CH2-CG 4.4Å; W40-M176 HydrophobicContact CH2-SD 3.96Å; I58-M176 HydrophobicContact CG2-CG 3.65Å; I58-M176 HydrophobicContact CG2-SD 4.47Å; I58-M176 PolarHBondContact N-O 2.87Å; I58-M176 PolarHBondContact O-N 2.05Å; I58-M176 VanDerWaalsContact O-O 3.07Å; F88-M176 HydrophobicContact CB-CE 4.36Å; F88-M176 HydrophobicContact CD2-CE 4.35Å; T89-M176 CarbonylContact O-C 3.58Å; T89-M176 WeakPolarHBondContact O-CA 3.15Å; T89-M176 WeakPolarHBondContact O-CB 3.34Å; M90-M176 HydrophobicContact CB-CB 4.47Å; M90-M176 HydrophobicContact CE-CB 3.7Å; M90-M176 HydrophobicContact CE-CE 4.49Å; M90-M176 HydrophobicContact CE-CG 4.14Å; M90-M176 HydrophobicContact CE-SD 3.69Å; F105-M176 HydrophobicContact CB-SD 3.72Å; F105-M176 HydrophobicContact CD1-CE 3.47Å; F105-M176 VanDerWaalsContact CD1-CE 3.47Å; F105-M176 HydrophobicContact CD1-SD 3.55Å; F105-M176 VanDerWaalsContact CD1-SD 3.55Å; F105-M176 HydrophobicContact CD2-CE 4.49Å; F105-M176 HydrophobicContact CE1-CE 3.6Å; F105-M176 HydrophobicContact CE1-SD 4.31Å; F105-M176 HydrophobicContact CG-CE 3.94Å; F105-M176 HydrophobicContact CG-SD 3.74Å; F105-M176 HydrophobicContact CZ-CE 4.19Å; A174-M176 HydrophobicContact CB-CG 4.36Å; A174-M176 HydrophobicContact CB-SD 4.42Å; M176-L178 HydrophobicContact CE-CD2 3.57Å; M176-L178 HydrophobicContact CE-CG 3.88Å
177	A	93.9	Very high	94.6	Very high	10 Å²	10	15.8 Å²	15.8	8%	0.083	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	128.5	166.3	0	0	0	0	0	111.3	F56 Q57 F88 T89 L179	F56-A177 CarbonylContact O-C 3.46Å; F56-A177 VanDerWaalsContact O-CA 3.28Å; F56-A177 WeakPolarHBondContact O-CA 3.36Å; Q57-A177 HydrophobicContact CB-CB 4.23Å; Q57-A177 HydrophobicContact CG-CB 4.32Å; F88-A177 CarbonylContact C-O 3.31Å; F88-A177 WeakPolarHBondContact CA-O 3.23Å; F88-A177 VanDerWaalsContact CB-O 3.31Å; F88-A177 WeakPolarHBondContact CB-O 3.27Å; T89-A177 PolarHBondContact N-O 2.85Å; T89-A177 PolarHBondContact O-N 2.85Å; A177-L179 HydrophobicContact CB-CD2 4.43Å; A177-L179 PolarHBondContact O-N 3.25Å
178	L	94.8	Very high	94.4	Very high	4 Å²	4	15.8 Å²	15.8	2%	0.021	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	112.2	166.4	-64	172.3	0	0	0	108	W40 T55 F56 L69 I86 F88 F105 F169 M176	W40-L178 HydrophobicContact CH2-CD1 3.86Å; W40-L178 HydrophobicContact CH2-CG 4.17Å; W40-L178 HydrophobicContact CZ3-CD1 3.78Å; W40-L178 HydrophobicContact CZ3-CG 4.01Å; T55-L178 VanDerWaalsContact CA-O 3.31Å; T55-L178 WeakPolarHBondContact CA-O 3.48Å; T55-L178 WeakPolarHBondContact CB-O 3.41Å; F56-L178 HydrophobicContact CB-CB 4.32Å; F56-L178 HydrophobicContact CB-CD1 4.44Å; F56-L178 PolarHBondContact N-O 2.8Å; F56-L178 PolarHBondContact O-N 3.42Å; L69-L178 HydrophobicContact CD2-CD1 4.03Å; I86-L178 HydrophobicContact CG2-CD2 3.81Å; F88-L178 HydrophobicContact CB-CD2 4.16Å; F105-L178 HydrophobicContact CE2-CD2 4.46Å; F105-L178 HydrophobicContact CZ-CD2 4.18Å; F169-L178 HydrophobicContact CB-CD1 4.31Å; F169-L178 HydrophobicContact CD1-CD1 3.69Å; F169-L178 HydrophobicContact CD1-CD2 4.04Å; F169-L178 HydrophobicContact CD2-CD1 4.21Å; F169-L178 HydrophobicContact CE1-CD1 4.04Å; F169-L178 HydrophobicContact CE1-CD2 4.08Å; F169-L178 HydrophobicContact CG-CD1 3.81Å; F169-L178 HydrophobicContact CZ-CD1 4.46Å; M176-L178 HydrophobicContact CE-CD2 3.57Å; M176-L178 HydrophobicContact CE-CG 3.88Å
179	L	92.8	Very high	94.2	Very high	59 Å²	59	18.4 Å²	18.4	31%	0.309	9%	0.092	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-40.8	-178	-59.6	-176.7	0	0	0	112.3	T55 R87 T89 A177	T55-L179 HydrophobicContact CG2-CD2 4.33Å; R87-L179 HydrophobicContact CB-CB 4.22Å; R87-L179 PolarHBondContact O-N 2.92Å; T89-L179 HydrophobicContact CG2-CD1 3.96Å; T89-L179 HydrophobicContact CG2-CG 4.46Å; A177-L179 HydrophobicContact CB-CD2 4.43Å; A177-L179 PolarHBondContact O-N 3.25Å
180	A	93.5	Very high	94	Very high	12 Å²	12	22.7 Å²	22.7	10%	0.099	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	147.5	174.4	0	0	0	0	0	111.6	T21 R87	T21-A180 WeakPolarHBondContact OG1-CA 3.39Å; R87-A180 HydrophobicContact CB-CB 4.16Å; R87-A180 PolarHBondContact N-O 3.23Å; R87-A180 PolarHBondContact O-N 3.01Å; R87-A180 VanDerWaalsContact O-N 3.16Å
181	V	95.7	Very high	93.8	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.006	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	122.6	169.6	-175.5	0	0	0	0	108.6	M19 N20 T21 W30 V84 E85 L167 F169 V183	M19-V181 HydrophobicContact CE-CB 4.1Å; M19-V181 HydrophobicContact CE-CG1 3.64Å; N20-V181 WeakPolarHBondContact CA-O 3.07Å; T21-V181 HydrophobicContact CG2-CB 4.28Å; T21-V181 PolarHBondContact N-O 2.89Å; T21-V181 PolarHBondContact OG1-N 3.02Å; W30-V181 HydrophobicContact CH2-CB 4.06Å; W30-V181 HydrophobicContact CH2-CG2 3.88Å; W30-V181 HydrophobicContact CZ3-CG2 4.38Å; V84-V181 HydrophobicContact CG1-CG1 4.18Å; E85-V181 WeakPolarHBondContact O-CA 3.21Å; L167-V181 HydrophobicContact CD1-CG1 4.37Å; F169-V181 HydrophobicContact CE1-CG2 4.29Å; F169-V181 HydrophobicContact CZ-CG1 4.16Å; F169-V181 HydrophobicContact CZ-CG2 3.74Å; V181-V183 HydrophobicContact CG1-CG2 4.36Å
182	R	96.1	Very high	93.7	Very high	66 Å²	66	32.1 Å²	32.1	25%	0.249	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	122.3	175.7	173.8	-171.7	170.1	164.7	-0.7	109.4	V17 M19 N20 E85 F184	V17-R182 HydrophobicContact CG1-CG 4.34Å; M19-R182 CarbonylContact O-C 3.56Å; M19-R182 VanDerWaalsContact O-CA 3.3Å; M19-R182 WeakPolarHBondContact O-CA 3.37Å; N20-R182 HydrophobicContact CB-CB 4.43Å; N20-R182 HydrophobicContact CB-CG 4.32Å; E85-R182 HydrophobicContact CB-CB 4.23Å; E85-R182 PolarHBondContact N-O 3.13Å; E85-R182 PolarHBondContact O-N 3.17Å; R182-F184 HydrophobicContact CG-CD1 4.07Å
183	V	96.7	Very high	93.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.6	175.3	-175.3	0	0	0	0	108.6	L18 M19 I74 L82 Y83 V84 L167 V181	L18-V183 PolarHBondContact N-O 3.09Å; M19-V183 HydrophobicContact CB-CB 4.2Å; M19-V183 HydrophobicContact CB-CG2 4.38Å; M19-V183 HydrophobicContact CE-CG2 3.83Å; M19-V183 PolarHBondContact N-O 3Å; M19-V183 PolarHBondContact O-N 3.4Å; I74-V183 HydrophobicContact CD1-CB 4.47Å; I74-V183 HydrophobicContact CD1-CG2 3.96Å; I74-V183 HydrophobicContact CG2-CG1 4.33Å; L82-V183 HydrophobicContact CB-CG1 4.34Å; L82-V183 HydrophobicContact CD1-CG1 3.94Å; Y83-V183 WeakPolarHBondContact O-CA 3.41Å; V84-V183 HydrophobicContact CG1-CG2 4.29Å; V84-V183 HydrophobicContact CG2-CG1 4.5Å; V84-V183 HydrophobicContact CG2-CG2 4.24Å; L167-V183 HydrophobicContact CD1-CG2 3.63Å; V181-V183 HydrophobicContact CG1-CG2 4.36Å
184	F	95	Very high	93.5	Very high	15 Å²	15	36 Å²	36	7%	0.066	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	165.2	-176.5	68	-84.4	0	0	0	111.9	E16 V17 Y83 E85 L154 R182 R186	E16-F184 CarbonylContact O-C 3.58Å; E16-F184 WeakPolarHBondContact O-CA 3.39Å; E16-F184 VanDerWaalsContact O-CB 3.25Å; E16-F184 WeakPolarHBondContact O-CB 3.49Å; V17-F184 HydrophobicContact CG2-CB 4.24Å; Y83-F184 HydrophobicContact CD2-CD2 4.45Å; Y83-F184 HydrophobicContact CD2-CE2 4.19Å; Y83-F184 HydrophobicContact CG-CE2 4.15Å; Y83-F184 HydrophobicContact CG-CZ 4.23Å; Y83-F184 PolarHBondContact N-O 3.27Å; Y83-F184 PolarHBondContact O-N 2.87Å; E85-F184 HydrophobicContact CB-CE1 4.32Å; L154-F184 HydrophobicContact CD1-CE1 4.01Å; L154-F184 HydrophobicContact CD1-CZ 4.06Å; R182-F184 HydrophobicContact CG-CD1 4.07Å; F184-R186 HydrophobicContact CE2-CG 4.42Å
185	F	93.8	Very high	93.4	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.018	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	163.9	165.6	66	-88.4	0	0	0	110.8	S15 E16 L18 R77 A79 L82 K187 V202	S15-F185 CarbonylContact C-O 3.54Å; S15-F185 WeakPolarHBondContact CA-O 3.24Å; S15-F185 VanDerWaalsContact CB-O 3.23Å; S15-F185 WeakPolarHBondContact CB-O 3.42Å; E16-F185 HydrophobicContact CB-CD1 4.14Å; E16-F185 HydrophobicContact CB-CE1 3.61Å; E16-F185 HydrophobicContact CB-CE2 4.03Å; E16-F185 HydrophobicContact CB-CZ 3.56Å; E16-F185 VanDerWaalsContact CD-CZ 3.46Å; E16-F185 HydrophobicContact CG-CE1 3.75Å; E16-F185 HydrophobicContact CG-CZ 3.86Å; E16-F185 PolarHBondContact N-O 2.92Å; E16-F185 PolarHBondContact O-N 3.17Å; E16-F185 WeakPolarHBondContact OE2-CZ 3.45Å; L18-F185 HydrophobicContact CD1-CD1 4.02Å; L18-F185 HydrophobicContact CD2-CD1 4.22Å; L18-F185 HydrophobicContact CD2-CE1 3.93Å; L18-F185 HydrophobicContact CG-CD1 4.1Å; L18-F185 HydrophobicContact CG-CE1 4.32Å; R77-F185 HydrophobicContact CB-CE1 4.44Å; A79-F185 HydrophobicContact CB-CB 3.45Å; A79-F185 VanDerWaalsContact CB-CB 3.45Å; A79-F185 HydrophobicContact CB-CD1 3.74Å; A79-F185 HydrophobicContact CB-CD2 3.67Å; A79-F185 HydrophobicContact CB-CE1 4.34Å; A79-F185 HydrophobicContact CB-CE2 4.29Å; A79-F185 HydrophobicContact CB-CG 3.35Å; L82-F185 HydrophobicContact CD2-CB 3.87Å; L82-F185 HydrophobicContact CD2-CD1 4.28Å; L82-F185 HydrophobicContact CD2-CG 4.5Å; F185-K187 HydrophobicContact CD2-CB 4.47Å; F185-K187 HydrophobicContact CE2-CB 4.22Å; F185-K187 HydrophobicContact CE2-CD 3.97Å; F185-V202 HydrophobicContact CD2-CG1 3.86Å; F185-V202 HydrophobicContact CD2-CG2 4.37Å; F185-V202 HydrophobicContact CE2-CG1 4Å; F185-V202 HydrophobicContact CE2-CG2 3.71Å
186	R	92.3	Very high	93.4	Very high	47 Å²	47	36.1 Å²	36.1	18%	0.177	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	145.9	178.7	-67	171.4	175	-117.4	11.7	109.7	Y83 F184 P203 E235 D236	Y83-R186 HydrophobicContact CD2-CG 4.22Å; Y83-R186 HydrophobicContact CE2-CB 4.43Å; Y83-R186 HydrophobicContact CE2-CG 3.83Å; F184-R186 HydrophobicContact CE2-CG 4.42Å; R186-P203 WeakPolarHBondContact O-CD 3.45Å; R186-E235 WeakPolarHBondContact CD-O 3.26Å; R186-D236 WeakPolarHBondContact CD-O 3.47Å; R186-D236 PolarHBondContact NH1-O 2.92Å
187	K	92.6	Very high	93.5	Very high	30 Å²	30	37.4 Å²	37.4	13%	0.13	19%	0.187	C	C	.	.			trans	-152.2	143.3	179.4	65.1	-173.4	-168.5	168.5	0	110.9	P14 E16 F185 E200 T201 V202	P14-K187 WeakPolarHBondContact CB-O 3.11Å; P14-K187 WeakPolarHBondContact CG-O 3.42Å; P14-K187 PolarHBondContact O-N 3.42Å; P14-K187 VanDerWaalsContact O-N 3.1Å; E16-K187 HydrophobicContact CB-CD 4.11Å; E16-K187 IonicContact OE2-NZ 3.07Å; E16-K187 PolarHBondContact OE2-NZ 2.73Å; F185-K187 HydrophobicContact CD2-CB 4.47Å; F185-K187 HydrophobicContact CE2-CB 4.22Å; F185-K187 HydrophobicContact CE2-CD 3.97Å; K187-E200 HydrophobicContact CD-CG 3.98Å; K187-E200 WeakPolarHBondContact CD-OE1 3.34Å; K187-E200 WeakPolarHBondContact CE-OE1 3.48Å; K187-E200 WeakPolarHBondContact CE-OE2 3.2Å; K187-E200 HydrophobicContact CG-CG 4.38Å; K187-E200 IonicContact NZ-OE1 3.11Å; K187-E200 PolarHBondContact NZ-OE1 3.1Å; K187-E200 IonicContact NZ-OE2 3.99Å; K187-E200 PolarHBondContact NZ-OE2 3.25Å; K187-T201 CarbonylContact C-O 3.56Å; K187-T201 WeakPolarHBondContact CA-O 3.45Å; K187-V202 HydrophobicContact CB-CG2 4.1Å
188	C	93.7	Very high	93.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-77.4	122.6	172.8	-59.8	0	0	0	0	109.5	E200 T201 C233 G237 Q238 W239	C188-E200 WeakPolarHBondContact O-CA 3.38Å; C188-T201 PolarHBondContact N-O 2.94Å; C188-T201 PolarHBondContact O-N 2.8Å; C188-C233 HydrophobicContact CB-CB 3.84Å; C188-C233 WeakPolarHBondContact CB-SG 3.02Å; C188-C233 WeakPolarHBondContact SG-CA 3.31Å; C188-C233 WeakPolarHBondContact SG-CB 3.16Å; C188-C233 CovalentContact SG-SG 2.03Å; C188-C233 PolarHBondContact SG-SG 3.22Å; C188-G237 WeakPolarHBondContact CA-O 3.28Å; C188-G237 PolarHBondContact SG-O 2.92Å; C188-Q238 VanDerWaalsContact SG-C 3.59Å; C188-Q238 PolarHBondContact SG-O 2.97Å; C188-W239 HydrophobicContact CB-CD2 3.92Å; C188-W239 HydrophobicContact CB-CE3 4.41Å; C188-W239 HydrophobicContact CB-CG 4.35Å; C188-W239 HydrophobicContact CB-CH2 4.24Å; C188-W239 HydrophobicContact CB-CZ2 3.73Å
189	P	93.6	Very high	93.5	Very high	56 Å²	56	40.3 Å²	40.3	36%	0.364	21%	0.205	S	C	.	.	P	Polyproline II helix	trans	-71	159	-177.7	30.4	-35.3	0	0	0	110.9	P14 L191 W239	P14-P189 HydrophobicContact CB-CG 4.23Å; P14-P189 HydrophobicContact CG-CG 4.48Å; P189-L191 PolarHBondContact O-N 3.45Å; P189-W239 PolarHBondContact O-NE1 3.24Å
190	P	93.5	Very high	93.5	Very high	90 Å²	90	41.7 Å²	41.7	58%	0.584	21%	0.21	S	C	*	.	P	Polyproline II helix	trans	-53.1	128.1	175.3	-24.3	32.9	0	0	0	111.9	F198 E200	P190-F198 WeakPolarHBondContact CA-O 3.45Å; P190-E200 HydrophobicContact CG-CB 3.99Å
191	L	92.6	Very high	93.5	Very high	52 Å²	52	42 Å²	42	27%	0.272	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	140.8	-176.5	-179.6	64.7	0	0	0	110.4	P189 R193 A197 F198 M231 W239	P189-L191 PolarHBondContact O-N 3.45Å; L191-R193 HydrophobicContact CD2-CB 4.41Å; L191-R193 HydrophobicContact CG-CB 4.43Å; L191-A197 WeakPolarHBondContact O-CA 3.3Å; L191-F198 PolarHBondContact N-O 3.47Å; L191-F198 VanDerWaalsContact N-O 3.1Å; L191-F198 PolarHBondContact O-N 2.71Å; L191-M231 HydrophobicContact CD2-CE 4.15Å; L191-M231 HydrophobicContact CD2-SD 3.91Å; L191-W239 HydrophobicContact CD2-CB 4.2Å; L191-W239 HydrophobicContact CD2-CD2 4.34Å; L191-W239 HydrophobicContact CD2-CG 3.8Å
192	R	92.6	Very high	93.4	Very high	151 Å²	151	43.1 Å²	43.1	57%	0.57	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	132.6	163.4	-66.3	-175.7	-175.2	-170.4	1.5	108.9	A196 A197 L260	R192-A196 CarbonylContact C-O 3.59Å; R192-A196 VanDerWaalsContact CA-O 3.27Å; R192-A196 WeakPolarHBondContact CA-O 3.37Å; R192-A197 HydrophobicContact CG-CB 4.12Å; R192-L260 HydrophobicContact CB-CD2 3.95Å; R192-L260 WeakPolarHBondContact O-CD2 3.46Å
193	R	90.1	Very high	93.2	Very high	113 Å²	113	40.6 Å²	40.6	43%	0.426	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	141	179.8	-164.5	169.8	-175.6	-174.1	1.5	110.1	L191 F195 A196 F198 G241 P243	L191-R193 HydrophobicContact CD2-CB 4.41Å; L191-R193 HydrophobicContact CG-CB 4.43Å; R193-F195 VanDerWaalsContact C-N 3.28Å; R193-F195 PolarHBondContact O-N 3.15Å; R193-A196 PolarHBondContact N-O 2.93Å; R193-A196 PolarHBondContact O-N 2.74Å; R193-F198 HydrophobicContact CB-CE2 4.44Å; R193-G241 PolarHBondContact NH1-O 2.95Å; R193-P243 HydrophobicContact CB-CG 4.41Å; R193-P243 HydrophobicContact CG-CG 4.33Å
194	A	89.9	Confident	92.8	Very high	25 Å²	25	45 Å²	45	21%	0.207	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	45.7	176.9	0	0	0	0	0	113.5	A196 P243 C247	A194-A196 PolarHBondContact O-N 2.99Å; A194-A196 VanDerWaalsContact O-N 3.12Å; A194-P243 HydrophobicContact CB-CG 4.19Å; A194-C247 PolarHBondContact O-N 2.88Å; A194-C247 VanDerWaalsContact O-N 3.11Å
195	F	92.2	Very high	92.4	Very high	17 Å²	17	47.4 Å²	47.4	8%	0.075	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	19	-175.9	-49.2	-80.5	0	0	0	115.4	R193 C214 V215 A218 C247 C249 A255 D259 C262	R193-F195 VanDerWaalsContact C-N 3.28Å; R193-F195 PolarHBondContact O-N 3.15Å; F195-C214 WeakPolarHBondContact O-CA 3.42Å; F195-V215 HydrophobicContact CB-CG2 4.12Å; F195-V215 WeakPolarHBondContact O-CG2 3.39Å; F195-V215 PolarHBondContact O-N 3.02Å; F195-A218 HydrophobicContact CB-CB 4.07Å; F195-C247 HydrophobicContact CB-CB 3.86Å; F195-C247 WeakPolarHBondContact CD2-O 3.45Å; F195-C247 WeakPolarHBondContact O-CB 3.44Å; F195-C249 WeakPolarHBondContact CE1-SG 3.12Å; F195-A255 HydrophobicContact CE1-CB 3.91Å; F195-A255 HydrophobicContact CZ-CB 3.62Å; F195-D259 HydrophobicContact CD1-CB 4.49Å; F195-D259 HydrophobicContact CD2-CB 4.11Å; F195-D259 HydrophobicContact CE1-CB 3.99Å; F195-D259 HydrophobicContact CE2-CB 3.56Å; F195-D259 HydrophobicContact CZ-CB 3.5Å; F195-D259 VanDerWaalsContact CZ-CG 3.46Å; F195-D259 WeakPolarHBondContact CZ-OD1 3.22Å; F195-D259 PolarHBondContact N-O 2.89Å; F195-C262 VanDerWaalsContact CD1-SG 3.59Å
196	A	93.3	Very high	92	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	146.8	172.1	0	0	0	0	0	111	R192 R193 A194 F198 V213 P229	R192-A196 CarbonylContact C-O 3.59Å; R192-A196 VanDerWaalsContact CA-O 3.27Å; R192-A196 WeakPolarHBondContact CA-O 3.37Å; R193-A196 PolarHBondContact N-O 2.93Å; R193-A196 PolarHBondContact O-N 2.74Å; A194-A196 PolarHBondContact O-N 2.99Å; A194-A196 VanDerWaalsContact O-N 3.12Å; A196-F198 HydrophobicContact CB-CE2 3.66Å; A196-F198 HydrophobicContact CB-CZ 3.63Å; A196-V213 CarbonylContact C-O 3.57Å; A196-V213 WeakPolarHBondContact CA-O 3.5Å; A196-P229 HydrophobicContact CB-CB 3.81Å; A196-P229 HydrophobicContact CB-CG 3.5Å; A196-P229 VanDerWaalsContact CB-CG 3.5Å
197	A	94.1	Very high	91.9	Very high	33 Å²	33	53 Å²	53	27%	0.273	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.8	169.1	0	0	0	0	0	109.2	L191 R192 G212 V213 V215	L191-A197 WeakPolarHBondContact O-CA 3.3Å; R192-A197 HydrophobicContact CG-CB 4.12Å; A197-G212 CarbonylContact O-C 3.53Å; A197-G212 VanDerWaalsContact O-CA 3.23Å; A197-G212 WeakPolarHBondContact O-CA 3.09Å; A197-V213 PolarHBondContact N-O 3.2Å; A197-V213 PolarHBondContact O-N 3.5Å; A197-V215 HydrophobicContact CB-CG1 4.36Å
198	F	94.6	Very high	91.8	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.018	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	129.4	176.6	-57.9	-84	0	0	0	108.6	P190 L191 R193 A196 P229 M231 W239 P243	P190-F198 WeakPolarHBondContact CA-O 3.45Å; L191-F198 PolarHBondContact N-O 3.47Å; L191-F198 VanDerWaalsContact N-O 3.1Å; L191-F198 PolarHBondContact O-N 2.71Å; R193-F198 HydrophobicContact CB-CE2 4.44Å; A196-F198 HydrophobicContact CB-CE2 3.66Å; A196-F198 HydrophobicContact CB-CZ 3.63Å; F198-P229 HydrophobicContact CE1-CB 4.38Å; F198-P229 HydrophobicContact CZ-CB 4.14Å; F198-M231 HydrophobicContact CD1-CB 3.85Å; F198-M231 HydrophobicContact CD1-CG 4Å; F198-M231 HydrophobicContact CD1-SD 4.49Å; F198-M231 HydrophobicContact CD2-CG 4.3Å; F198-M231 HydrophobicContact CD2-SD 3.79Å; F198-M231 HydrophobicContact CE1-CB 3.85Å; F198-M231 HydrophobicContact CE1-CG 3.61Å; F198-M231 HydrophobicContact CE1-SD 4.36Å; F198-M231 HydrophobicContact CE2-CG 3.95Å; F198-M231 HydrophobicContact CE2-SD 3.63Å; F198-M231 HydrophobicContact CG-CB 4.34Å; F198-M231 HydrophobicContact CG-CG 4.34Å; F198-M231 HydrophobicContact CG-SD 4.24Å; F198-M231 HydrophobicContact CZ-CB 4.34Å; F198-M231 HydrophobicContact CZ-CG 3.59Å; F198-M231 HydrophobicContact CZ-SD 3.94Å; F198-W239 HydrophobicContact CB-CH2 3.87Å; F198-W239 HydrophobicContact CB-CZ2 3.89Å; F198-P243 HydrophobicContact CE2-CG 4.1Å; F198-P243 HydrophobicContact CZ-CB 4Å; F198-P243 HydrophobicContact CZ-CG 3.97Å
199	P	94.3	Very high	91.8	Very high	71 Å²	71	60.1 Å²	60.1	46%	0.461	32%	0.318	S	S	.	.			trans	-70.1	165.8	179.6	31.6	-35.9	0	0	0	111.2	T201 R211 W239	P199-T201 PolarHBondContact O-N 2.84Å; P199-T201 PolarHBondContact O-OG1 2.89Å; P199-T201 VanDerWaalsContact O-OG1 3.1Å; P199-R211 WeakPolarHBondContact CD-O 3.31Å; P199-W239 WeakPolarHBondContact O-CZ2 3.47Å
200	E	93.7	Very high	91.7	Very high	89 Å²	89	57.7 Å²	57.7	42%	0.416	30%	0.302	S	S	.	.			trans	-55.8	131.6	164.4	-172.7	170.9	96.1	0	0	109.8	K187 C188 P190	K187-E200 HydrophobicContact CD-CG 3.98Å; K187-E200 WeakPolarHBondContact CD-OE1 3.34Å; K187-E200 WeakPolarHBondContact CE-OE1 3.48Å; K187-E200 WeakPolarHBondContact CE-OE2 3.2Å; K187-E200 HydrophobicContact CG-CG 4.38Å; K187-E200 IonicContact NZ-OE1 3.11Å; K187-E200 PolarHBondContact NZ-OE1 3.1Å; K187-E200 IonicContact NZ-OE2 3.99Å; K187-E200 PolarHBondContact NZ-OE2 3.25Å; C188-E200 WeakPolarHBondContact O-CA 3.38Å; P190-E200 HydrophobicContact CG-CB 3.99Å
201	T	93.9	Very high	91.7	Very high	18 Å²	18	61.8 Å²	61.8	11%	0.11	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-132.2	130.1	-173.8	-56.7	0	0	0	0	109.9	K187 C188 P199 E208 A210 C233	K187-T201 CarbonylContact C-O 3.56Å; K187-T201 WeakPolarHBondContact CA-O 3.45Å; C188-T201 PolarHBondContact N-O 2.94Å; C188-T201 PolarHBondContact O-N 2.8Å; P199-T201 PolarHBondContact O-N 2.84Å; P199-T201 PolarHBondContact O-OG1 2.89Å; P199-T201 VanDerWaalsContact O-OG1 3.1Å; T201-E208 HydrophobicContact CG2-CB 4.37Å; T201-E208 HydrophobicContact CG2-CG 4.02Å; T201-A210 HydrophobicContact CG2-CB 4.12Å; T201-A210 VanDerWaalsContact OG1-CB 3.3Å; T201-A210 WeakPolarHBondContact OG1-CB 3.41Å; T201-C233 HydrophobicContact CG2-CB 3.95Å
202	V	93.2	Very high	91.7	Very high	24 Å²	24	59.4 Å²	59.4	15%	0.145	29%	0.294	C	S	.	.			trans	-101.7	121.9	175.5	-174.5	0	0	0	0	107.8	A78 A79 F185 K187	A78-V202 HydrophobicContact CB-CG2 4.39Å; A79-V202 HydrophobicContact CB-CG1 4.11Å; F185-V202 HydrophobicContact CD2-CG1 3.86Å; F185-V202 HydrophobicContact CD2-CG2 4.37Å; F185-V202 HydrophobicContact CE2-CG1 4Å; F185-V202 HydrophobicContact CE2-CG2 3.71Å; K187-V202 HydrophobicContact CB-CG2 4.1Å
203	P	91.5	Very high	91.8	Very high	14 Å²	14	57.2 Å²	57.2	9%	0.091	30%	0.297	C	S	.	.			trans	-74.7	130.3	-177.8	29.7	-33.4	0	0	0	111.4	R186 E208	R186-P203 WeakPolarHBondContact O-CD 3.45Å; P203-E208 HydrophobicContact CB-CB 4.08Å
204	H	88.6	Confident	91.9	Very high	93 Å²	93	53.2 Å²	53.2	43%	0.431	29%	0.286	S	S	.	.	S	Bend	trans	-99.5	-14.6	175.6	-61.3	-55	0	0	0	113.5	A78 T80 E208	A78-H204 PolarHBondContact O-CE1 2.83Å; A78-H204 VanDerWaalsContact O-CE1 3.3Å; T80-H204 WeakPolarHBondContact CG2-ND1 3.45Å; T80-H204 WeakPolarHBondContact OG1-CA 3.24Å; T80-H204 PolarHBondContact OG1-ND1 3.39Å; T80-H204 VanDerWaalsContact OG1-ND1 3.12Å; H204-E208 WeakPolarHBondContact CB-OE2 3.25Å; H204-E208 IonicContact CD2-OE2 2.72Å; H204-E208 IonicContact CG-OE2 2.64Å; H204-E208 PolarHBondContact N-OE2 3.49Å
205	S	85.8	Confident	92.1	Very high	65 Å²	65	52.5 Å²	52.5	46%	0.455	28%	0.279	S	S	.	.	S	Bend	trans	-130.6	-169.3	173.4	72.3	0	0	0	0	110.3	V207	S205-V207 PolarHBondContact O-N 2.65Å; S205-V207 PolarHBondContact OG-N 3.25Å; S205-V207 PolarHBondContact OG-O 2.94Å
206	L	86.6	Confident	92.1	Very high	101 Å²	101	59.3 Å²	59.3	53%	0.529	31%	0.311	S	S	.	.	S	Bend	trans	-54.8	-35.4	174.2	-65.7	174.4	0	0	0	112.4	E235	L206-E235 PolarHBondContact O-N 2.88Å
207	V	89.3	Confident	92.1	Very high	66 Å²	66	60.4 Å²	60.4	40%	0.4	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	121	-178.7	-172.4	0	0	0	0	110.3	S205 L232 C233	S205-V207 PolarHBondContact O-N 2.65Å; S205-V207 PolarHBondContact OG-N 3.25Å; S205-V207 PolarHBondContact OG-O 2.94Å; V207-L232 HydrophobicContact CG1-CB 3.58Å; V207-L232 HydrophobicContact CG1-CD1 4.14Å; V207-L232 HydrophobicContact CG1-CD2 3.94Å; V207-L232 HydrophobicContact CG1-CG 4.07Å; V207-C233 CarbonylContact C-O 3.57Å; V207-C233 WeakPolarHBondContact CA-O 3.19Å
208	E	91.6	Very high	92.1	Very high	54 Å²	54	59.4 Å²	59.4	25%	0.252	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	136.3	-178.7	-165.2	64.5	-129.2	0	0	111.4	T201 P203 H204 L232 C233	T201-E208 HydrophobicContact CG2-CB 4.37Å; T201-E208 HydrophobicContact CG2-CG 4.02Å; P203-E208 HydrophobicContact CB-CB 4.08Å; H204-E208 WeakPolarHBondContact CB-OE2 3.25Å; H204-E208 IonicContact CD2-OE2 2.72Å; H204-E208 IonicContact CG-OE2 2.64Å; H204-E208 PolarHBondContact N-OE2 3.49Å; E208-L232 CarbonylContact O-C 3.54Å; E208-L232 WeakPolarHBondContact O-CA 3.14Å; E208-C233 HydrophobicContact CB-CB 4.35Å; E208-C233 PolarHBondContact N-O 3.46Å; E208-C233 PolarHBondContact O-N 3.47Å
209	Q	92.6	Very high	91.9	Very high	127 Å²	127	62 Å²	62	59%	0.593	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	113.3	178.2	-174.6	177.3	78.7	0	0	111.5	L232	Q209-L232 HydrophobicContact CB-CD2 4.17Å; Q209-L232 HydrophobicContact CG-CD2 4.38Å
210	A	93	Very high	91.6	Very high	5 Å²	5	61 Å²	61	4%	0.041	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	129.1	170.4	0	0	0	0	0	111.4	T201 S230 M231 W239	T201-A210 HydrophobicContact CG2-CB 4.12Å; T201-A210 VanDerWaalsContact OG1-CB 3.3Å; T201-A210 WeakPolarHBondContact OG1-CB 3.41Å; A210-S230 VanDerWaalsContact O-CA 3.26Å; A210-S230 WeakPolarHBondContact O-CA 3.42Å; A210-S230 WeakPolarHBondContact O-CB 3.37Å; A210-M231 PolarHBondContact N-O 3.05Å; A210-M231 PolarHBondContact O-N 3.03Å; A210-W239 HydrophobicContact CB-CH2 3.35Å; A210-W239 HydrophobicContact CB-CZ3 3.48Å; A210-W239 VanDerWaalsContact CB-CZ3 3.48Å
211	R	93.3	Very high	90.9	Very high	176 Å²	176	59.4 Å²	59.4	66%	0.664	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	119.5	170.5	-176.9	176.1	174.5	160.8	3.8	109.9	P199 P228	P199-R211 WeakPolarHBondContact CD-O 3.31Å; R211-P228 HydrophobicContact CG-CB 4.05Å; R211-P228 HydrophobicContact CG-CG 4.04Å
212	G	92.7	Very high	89.7	Confident	2 Å²	2	64.2 Å²	64.2	2%	0.021	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-85.8	164.8	172	0	0	0	0	0	112.9	A197 P229	A197-G212 CarbonylContact O-C 3.53Å; A197-G212 VanDerWaalsContact O-CA 3.23Å; A197-G212 WeakPolarHBondContact O-CA 3.09Å; G212-P229 WeakPolarHBondContact CA-O 3.49Å; G212-P229 PolarHBondContact N-O 3.14Å
213	V	93.3	Very high	88.4	Confident	104 Å²	104	65.4 Å²	65.4	63%	0.63	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	140.1	174.9	-176.7	0	0	0	0	108.2	A196 A197 V215	A196-V213 CarbonylContact C-O 3.57Å; A196-V213 WeakPolarHBondContact CA-O 3.5Å; A197-V213 PolarHBondContact N-O 3.2Å; A197-V213 PolarHBondContact O-N 3.5Å; V213-V215 PolarHBondContact O-N 3.17Å
214	C	92.8	Very high	86.4	Confident	29 Å²	29	74.7 Å²	74.7	20%	0.196	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	139	175.6	-60.9	0	0	0	0	111.2	F195 A218 T220 C247	F195-C214 WeakPolarHBondContact O-CA 3.42Å; C214-A218 HydrophobicContact CB-CB 4.04Å; C214-T220 PolarHBondContact SG-N 3.28Å; C214-C247 WeakPolarHBondContact CA-SG 3.31Å; C214-C247 HydrophobicContact CB-CB 3.68Å; C214-C247 WeakPolarHBondContact CB-SG 3.45Å; C214-C247 WeakPolarHBondContact SG-CB 3.29Å; C214-C247 CovalentContact SG-SG 2.04Å; C214-C247 PolarHBondContact SG-SG 2.94Å
215	V	93.6	Very high	84.9	Confident	11 Å²	11	77.4 Å²	77.4	7%	0.067	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-63	162.9	175.7	-60.6	0	0	0	0	110.7	F195 A197 V213 N217 A218	F195-V215 HydrophobicContact CB-CG2 4.12Å; F195-V215 WeakPolarHBondContact O-CG2 3.39Å; F195-V215 PolarHBondContact O-N 3.02Å; A197-V215 HydrophobicContact CB-CG1 4.36Å; V213-V215 PolarHBondContact O-N 3.17Å; V215-N217 PolarHBondContact O-N 2.94Å; V215-A218 HydrophobicContact CG2-CB 3.8Å; V215-A218 WeakPolarHBondContact O-CB 3.23Å; V215-A218 PolarHBondContact O-N 3.05Å
216	E	93.2	Very high	83.9	Confident	160 Å²	160	77.4 Å²	77.4	75%	0.748	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	132.8	177.4	-157.7	-159.9	140.5	0	0	111.2	A218	E216-A218 PolarHBondContact O-N 3.38Å
217	N	93.3	Very high	83.4	Confident	22 Å²	22	78.6 Å²	78.6	12%	0.118	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	67	14.1	-175	-45.4	-74.7	0	0	0	115.6	V215 R250 Y253 C262	V215-N217 PolarHBondContact O-N 2.94Å; N217-R250 HydrophobicContact CB-CG 4.44Å; N217-R250 WeakPolarHBondContact O-CB 3.23Å; N217-R250 VanDerWaalsContact O-CG 3.29Å; N217-R250 WeakPolarHBondContact O-CG 3.29Å; N217-R250 PolarHBondContact O-N 3.46Å; N217-R250 PolarHBondContact OD1-NE 2.99Å; N217-R250 PolarHBondContact OD1-NH2 3.34Å; N217-Y253 HydrophobicContact CB-CD1 3.36Å; N217-Y253 HydrophobicContact CB-CD2 4.14Å; N217-Y253 HydrophobicContact CB-CE1 3.49Å; N217-Y253 VanDerWaalsContact CB-CE1 3.49Å; N217-Y253 HydrophobicContact CB-CE2 4.26Å; N217-Y253 HydrophobicContact CB-CG 3.71Å; N217-Y253 VanDerWaalsContact OD1-CE1 3.27Å; N217-Y253 WeakPolarHBondContact OD1-CE1 3.39Å; N217-Y253 PolarHBondContact OD1-OH 2.77Å; N217-Y253 VanDerWaalsContact OD1-OH 3.12Å; N217-C262 HydrophobicContact CB-CB 3.95Å
218	A	92.5	Very high	83	Confident	13 Å²	13	77 Å²	77	11%	0.107	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	157	165.4	0	0	0	0	0	112.1	F195 C214 V215 E216 C247 A248	F195-A218 HydrophobicContact CB-CB 4.07Å; C214-A218 HydrophobicContact CB-CB 4.04Å; V215-A218 HydrophobicContact CG2-CB 3.8Å; V215-A218 WeakPolarHBondContact O-CB 3.23Å; V215-A218 PolarHBondContact O-N 3.05Å; E216-A218 PolarHBondContact O-N 3.38Å; A218-C247 HydrophobicContact CB-CB 4.03Å; A218-A248 CarbonylContact C-O 3.54Å; A218-A248 VanDerWaalsContact CA-O 3.26Å; A218-A248 WeakPolarHBondContact CA-O 3.32Å
219	V	90.9	Very high	83	Confident	59 Å²	59	74.5 Å²	74.5	36%	0.358	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	153.4	176.8	-66.9	0	0	0	0	110.1	A248 R250 P274	V219-A248 PolarHBondContact N-O 3.1Å; V219-A248 PolarHBondContact O-N 3.3Å; V219-R250 HydrophobicContact CG1-CB 4.25Å; V219-R250 HydrophobicContact CG2-CB 4.32Å; V219-P274 HydrophobicContact CG2-CB 4.11Å
220	T	87.8	Confident	83	Confident	49 Å²	49	69.1 Å²	69.1	30%	0.301	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-66.7	129.9	167.9	-47	0	0	0	0	108.6	C214	C214-T220 PolarHBondContact SG-N 3.28Å
221	P	78.6	Confident	83	Confident	56 Å²	56	69 Å²	69	36%	0.364	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-57.2	140.1	175.5	-25.3	34.8	0	0	0	111.8	G223 S246 A248	P221-G223 PolarHBondContact O-N 3.27Å; P221-S246 VanDerWaalsContact CD-O 3.31Å; P221-S246 WeakPolarHBondContact CD-O 3.22Å; P221-A248 HydrophobicContact CG-CB 4.06Å
222	P	69	Low	83	Confident	118 Å²	118	63.9 Å²	63.9	77%	0.766	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-68.6	131.1	178.4	27.7	-33.5	0	0	0	111.2
223	G	65.6	Low	83.1	Confident	50 Å²	50	63.8 Å²	63.8	52%	0.515	37%	0.369	S	S	.	.	S	Bend	trans	-179.1	167.8	177.7	0	0	0	0	0	111.4	P221 L225 A226	P221-G223 PolarHBondContact O-N 3.27Å; G223-L225 PolarHBondContact O-N 2.93Å; G223-A226 PolarHBondContact O-N 3.1Å
224	E	51.2	Low	83	Confident	208 Å²	208	59 Å²	59	97%	0.972	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-16.9	-175.1	-64	-179.3	152.4	0	0	114
225	L	56.3	Low	82.8	Confident	150 Å²	150	60.8 Å²	60.8	79%	0.785	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.9	56.5	175.5	-70.7	164.1	0	0	0	110.6	G223 Q227	G223-L225 PolarHBondContact O-N 2.93Å; L225-Q227 PolarHBondContact O-N 3.12Å
226	A	64.6	Low	82.5	Confident	66 Å²	66	62.7 Å²	62.7	55%	0.545	36%	0.356	S	S	.	.			trans	-69.7	52.6	173.4	0	0	0	0	0	112.7	G223	G223-A226 PolarHBondContact O-N 3.1Å
227	Q	76.1	Confident	82.3	Confident	125 Å²	125	55 Å²	55	58%	0.584	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-73.4	142.2	176.2	-70.4	-91.1	-8.2	0	0	109.9	L225 S245	L225-Q227 PolarHBondContact O-N 3.12Å; Q227-S245 PolarHBondContact O-OG 3.1Å
228	P	81.2	Confident	82.2	Confident	34 Å²	34	58.9 Å²	58.9	22%	0.221	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-60.2	145.5	170.4	30.7	-37.5	0	0	0	109.8	R211 S230	R211-P228 HydrophobicContact CG-CB 4.05Å; R211-P228 HydrophobicContact CG-CG 4.04Å; P228-S230 PolarHBondContact O-N 2.82Å
229	P	91.1	Very high	82.2	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.006	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-60.8	134.8	176.4	29	-36.7	0	0	0	109.7	A196 F198 G212 S245	A196-P229 HydrophobicContact CB-CB 3.81Å; A196-P229 HydrophobicContact CB-CG 3.5Å; A196-P229 VanDerWaalsContact CB-CG 3.5Å; F198-P229 HydrophobicContact CE1-CB 4.38Å; F198-P229 HydrophobicContact CZ-CB 4.14Å; G212-P229 WeakPolarHBondContact CA-O 3.49Å; G212-P229 PolarHBondContact N-O 3.14Å; P229-S245 VanDerWaalsContact CA-OG 3.3Å; P229-S245 WeakPolarHBondContact CA-OG 3.27Å; P229-S245 WeakPolarHBondContact CB-O 3.48Å
230	S	92.5	Very high	82.2	Confident	13 Å²	13	60.7 Å²	60.7	9%	0.091	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	152.1	175.1	63.1	0	0	0	0	111.7	A210 P228 P243 T244	A210-S230 VanDerWaalsContact O-CA 3.26Å; A210-S230 WeakPolarHBondContact O-CA 3.42Å; A210-S230 WeakPolarHBondContact O-CB 3.37Å; P228-S230 PolarHBondContact O-N 2.82Å; S230-P243 WeakPolarHBondContact O-CA 3.5Å; S230-T244 PolarHBondContact N-OG1 3.41Å; S230-T244 PolarHBondContact O-N 3.49Å; S230-T244 PolarHBondContact O-OG1 2.82Å; S230-T244 VanDerWaalsContact OG-CG2 3.28Å; S230-T244 WeakPolarHBondContact OG-CG2 3.46Å; S230-T244 PolarHBondContact OG-OG1 3.23Å
231	M	93.4	Very high	82.2	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.01	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	161.6	174.8	-82.5	-164.8	76	0	0	110.1	L191 F198 A210 W239 G241 P243	L191-M231 HydrophobicContact CD2-CE 4.15Å; L191-M231 HydrophobicContact CD2-SD 3.91Å; F198-M231 HydrophobicContact CD1-CB 3.85Å; F198-M231 HydrophobicContact CD1-CG 4Å; F198-M231 HydrophobicContact CD1-SD 4.49Å; F198-M231 HydrophobicContact CD2-CG 4.3Å; F198-M231 HydrophobicContact CD2-SD 3.79Å; F198-M231 HydrophobicContact CE1-CB 3.85Å; F198-M231 HydrophobicContact CE1-CG 3.61Å; F198-M231 HydrophobicContact CE1-SD 4.36Å; F198-M231 HydrophobicContact CE2-CG 3.95Å; F198-M231 HydrophobicContact CE2-SD 3.63Å; F198-M231 HydrophobicContact CG-CB 4.34Å; F198-M231 HydrophobicContact CG-CG 4.34Å; F198-M231 HydrophobicContact CG-SD 4.24Å; F198-M231 HydrophobicContact CZ-CB 4.34Å; F198-M231 HydrophobicContact CZ-CG 3.59Å; F198-M231 HydrophobicContact CZ-SD 3.94Å; A210-M231 PolarHBondContact N-O 3.05Å; A210-M231 PolarHBondContact O-N 3.03Å; M231-W239 HydrophobicContact CB-CE3 3.69Å; M231-W239 HydrophobicContact CB-CZ3 3.72Å; M231-W239 HydrophobicContact CE-CB 3.85Å; M231-W239 HydrophobicContact CE-CD2 4.49Å; M231-W239 HydrophobicContact CE-CE3 4.33Å; M231-W239 HydrophobicContact CE-CG 4.37Å; M231-G241 WeakPolarHBondContact CE-O 3.31Å; M231-P243 HydrophobicContact CG-CB 4.05Å; M231-P243 HydrophobicContact CG-CG 3.9Å; M231-P243 HydrophobicContact SD-CG 3.8Å
232	L	94.2	Very high	82.6	Confident	70 Å²	70	62.3 Å²	62.3	37%	0.366	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.8	-177.5	-65.4	179.2	0	0	0	109.6	V207 E208 Q209 V240	V207-L232 HydrophobicContact CG1-CB 3.58Å; V207-L232 HydrophobicContact CG1-CD1 4.14Å; V207-L232 HydrophobicContact CG1-CD2 3.94Å; V207-L232 HydrophobicContact CG1-CG 4.07Å; E208-L232 CarbonylContact O-C 3.54Å; E208-L232 WeakPolarHBondContact O-CA 3.14Å; Q209-L232 HydrophobicContact CB-CD2 4.17Å; Q209-L232 HydrophobicContact CG-CD2 4.38Å; L232-V240 HydrophobicContact CB-CB 4.06Å; L232-V240 PolarHBondContact O-N 3.48Å
233	C	93.9	Very high	83.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	116.8	175.3	176.2	0	0	0	0	109.2	C188 T201 V207 E208 W239	C188-C233 HydrophobicContact CB-CB 3.84Å; C188-C233 WeakPolarHBondContact CB-SG 3.02Å; C188-C233 WeakPolarHBondContact SG-CA 3.31Å; C188-C233 WeakPolarHBondContact SG-CB 3.16Å; C188-C233 CovalentContact SG-SG 2.03Å; C188-C233 PolarHBondContact SG-SG 3.22Å; T201-C233 HydrophobicContact CG2-CB 3.95Å; V207-C233 CarbonylContact C-O 3.57Å; V207-C233 WeakPolarHBondContact CA-O 3.19Å; E208-C233 HydrophobicContact CB-CB 4.35Å; E208-C233 PolarHBondContact N-O 3.46Å; E208-C233 PolarHBondContact O-N 3.47Å; C233-W239 HydrophobicContact CB-CE3 4.29Å; C233-W239 HydrophobicContact CB-CZ3 4.03Å
234	G	91.4	Very high	84.5	Confident	4 Å²	4	60 Å²	60	4%	0.041	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	155.4	178.5	0	0	0	0	0	112.7	D236 G237 Q238	G234-D236 PolarHBondContact O-N 2.6Å; G234-G237 PolarHBondContact O-N 3.03Å; G234-Q238 PolarHBondContact N-O 3.27Å
235	E	88.7	Confident	86.1	Confident	65 Å²	65	51.8 Å²	51.8	30%	0.304	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-20.5	175.1	62.7	167.9	-179.4	0	0	114.4	R156 R186 L206 G237	R156-E235 IonicContact CZ-OE2 2.67Å; R156-E235 IonicContact NH1-OE2 2.68Å; R156-E235 IonicContact NH2-OE2 3.97Å; R156-E235 PolarHBondContact NH2-OE2 3.45Å; R186-E235 WeakPolarHBondContact CD-O 3.26Å; L206-E235 PolarHBondContact O-N 2.88Å; E235-G237 VanDerWaalsContact C-N 3.26Å; E235-G237 PolarHBondContact O-N 3.06Å
236	D	86.7	Confident	87.6	Confident	51 Å²	51	47.7 Å²	47.7	27%	0.273	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-9.4	177	81.1	-36.3	0	0	0	113.2	R186 G234 Q238	R186-D236 WeakPolarHBondContact CD-O 3.47Å; R186-D236 PolarHBondContact NH1-O 2.92Å; G234-D236 PolarHBondContact O-N 2.6Å; D236-Q238 WeakPolarHBondContact OD1-CB 3.42Å; D236-Q238 PolarHBondContact OD1-N 3.45Å; D236-Q238 WeakPolarHBondContact OD2-CG 3.48Å; D236-Q238 PolarHBondContact OD2-NE2 3.23Å
237	G	89.3	Confident	88.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.26	C	S	.	.	S	Bend	trans	91.2	9	-176.4	0	0	0	0	0	114.3	P14 C188 G234 E235	P14-G237 WeakPolarHBondContact CG-O 3.48Å; C188-G237 WeakPolarHBondContact CA-O 3.28Å; C188-G237 PolarHBondContact SG-O 2.92Å; G234-G237 PolarHBondContact O-N 3.03Å; E235-G237 VanDerWaalsContact C-N 3.26Å; E235-G237 PolarHBondContact O-N 3.06Å
238	Q	91.9	Very high	89.5	Confident	102 Å²	102	39.2 Å²	39.2	48%	0.477	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-102.6	148.2	-180	-62.9	-173.8	56.1	0	0	113.1	C188 G234 D236 V240	C188-Q238 VanDerWaalsContact SG-C 3.59Å; C188-Q238 PolarHBondContact SG-O 2.97Å; G234-Q238 PolarHBondContact N-O 3.27Å; D236-Q238 WeakPolarHBondContact OD1-CB 3.42Å; D236-Q238 PolarHBondContact OD1-N 3.45Å; D236-Q238 WeakPolarHBondContact OD2-CG 3.48Å; D236-Q238 PolarHBondContact OD2-NE2 3.23Å; Q238-V240 PolarHBondContact O-N 3Å
239	W	92.5	Very high	90.1	Very high	42 Å²	42	37.6 Å²	37.6	16%	0.159	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	120	172.6	-72.9	110.2	0	0	0	110.8	C188 P189 L191 F198 P199 A210 M231 C233	C188-W239 HydrophobicContact CB-CD2 3.92Å; C188-W239 HydrophobicContact CB-CE3 4.41Å; C188-W239 HydrophobicContact CB-CG 4.35Å; C188-W239 HydrophobicContact CB-CH2 4.24Å; C188-W239 HydrophobicContact CB-CZ2 3.73Å; P189-W239 PolarHBondContact O-NE1 3.24Å; L191-W239 HydrophobicContact CD2-CB 4.2Å; L191-W239 HydrophobicContact CD2-CD2 4.34Å; L191-W239 HydrophobicContact CD2-CG 3.8Å; F198-W239 HydrophobicContact CB-CH2 3.87Å; F198-W239 HydrophobicContact CB-CZ2 3.89Å; P199-W239 WeakPolarHBondContact O-CZ2 3.47Å; A210-W239 HydrophobicContact CB-CH2 3.35Å; A210-W239 HydrophobicContact CB-CZ3 3.48Å; A210-W239 VanDerWaalsContact CB-CZ3 3.48Å; M231-W239 HydrophobicContact CB-CE3 3.69Å; M231-W239 HydrophobicContact CB-CZ3 3.72Å; M231-W239 HydrophobicContact CE-CB 3.85Å; M231-W239 HydrophobicContact CE-CD2 4.49Å; M231-W239 HydrophobicContact CE-CE3 4.33Å; M231-W239 HydrophobicContact CE-CG 4.37Å; C233-W239 HydrophobicContact CB-CE3 4.29Å; C233-W239 HydrophobicContact CB-CZ3 4.03Å
240	V	90.8	Very high	90.2	Very high	68 Å²	68	42.3 Å²	42.3	41%	0.412	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.2	-176.8	-175.4	0	0	0	0	110.3	L232 Q238	L232-V240 HydrophobicContact CB-CB 4.06Å; L232-V240 PolarHBondContact O-N 3.48Å; Q238-V240 PolarHBondContact O-N 3Å
241	G	86.4	Confident	90.2	Very high	42 Å²	42	44 Å²	44	43%	0.433	26%	0.255	S	S	.	.	S	Bend	trans	73.6	-172.2	173.3	0	0	0	0	0	115.7	R193 M231	R193-G241 PolarHBondContact NH1-O 2.95Å; M231-G241 WeakPolarHBondContact CE-O 3.31Å
242	P	88.3	Confident	90.3	Very high	98 Å²	98	44 Å²	44	64%	0.636	25%	0.254	S	S	*	.	S	Bend	trans	-83.1	164.7	165.7	35.4	-33.6	0	0	0	111.5
243	P	86.7	Confident	90.3	Very high	22 Å²	22	42.5 Å²	42.5	14%	0.143	24%	0.244	C	C	.	.			trans	-55.5	147.1	166.8	-24.6	34.6	0	0	0	113.3	R193 A194 F198 S230 M231 S245	R193-P243 HydrophobicContact CB-CG 4.41Å; R193-P243 HydrophobicContact CG-CG 4.33Å; A194-P243 HydrophobicContact CB-CG 4.19Å; F198-P243 HydrophobicContact CE2-CG 4.1Å; F198-P243 HydrophobicContact CZ-CB 4Å; F198-P243 HydrophobicContact CZ-CG 3.97Å; S230-P243 WeakPolarHBondContact O-CA 3.5Å; M231-P243 HydrophobicContact CG-CB 4.05Å; M231-P243 HydrophobicContact CG-CG 3.9Å; M231-P243 HydrophobicContact SD-CG 3.8Å; P243-S245 VanDerWaalsContact C-N 3.3Å; P243-S245 VanDerWaalsContact CB-O 3.3Å; P243-S245 WeakPolarHBondContact CB-O 3.24Å; P243-S245 PolarHBondContact O-N 2.93Å
244	T	86.9	Confident	90.2	Very high	96 Å²	96	45.2 Å²	45.2	59%	0.589	26%	0.257	S	S	*	.	S	Bend	trans	-64.9	-31.6	175.2	50.8	0	0	0	0	113.3	S230	S230-T244 PolarHBondContact N-OG1 3.41Å; S230-T244 PolarHBondContact O-N 3.49Å; S230-T244 PolarHBondContact O-OG1 2.82Å; S230-T244 VanDerWaalsContact OG-CG2 3.28Å; S230-T244 WeakPolarHBondContact OG-CG2 3.46Å; S230-T244 PolarHBondContact OG-OG1 3.23Å
245	S	86.2	Confident	90.2	Very high	37 Å²	37	47.2 Å²	47.2	26%	0.259	27%	0.273	S	S	.	.	S	Bend	trans	-144	160.7	171	69.4	0	0	0	0	110.3	Q227 P229 P243	Q227-S245 PolarHBondContact O-OG 3.1Å; P229-S245 VanDerWaalsContact CA-OG 3.3Å; P229-S245 WeakPolarHBondContact CA-OG 3.27Å; P229-S245 WeakPolarHBondContact CB-O 3.48Å; P243-S245 VanDerWaalsContact C-N 3.3Å; P243-S245 VanDerWaalsContact CB-O 3.3Å; P243-S245 WeakPolarHBondContact CB-O 3.24Å; P243-S245 PolarHBondContact O-N 2.93Å
246	S	86.3	Confident	90	Very high	64 Å²	64	44.1 Å²	44.1	45%	0.448	26%	0.259	S	S	.	.			trans	-107.9	145	173.3	56.2	0	0	0	0	110.7	P221	P221-S246 VanDerWaalsContact CD-O 3.31Å; P221-S246 WeakPolarHBondContact CD-O 3.22Å
247	C	90.9	Very high	89.9	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.014	27%	0.266	C	S	.	.			trans	-80.5	165.4	163.3	-58.4	0	0	0	0	109.6	A194 F195 C214 A218	A194-C247 PolarHBondContact O-N 2.88Å; A194-C247 VanDerWaalsContact O-N 3.11Å; F195-C247 HydrophobicContact CB-CB 3.86Å; F195-C247 WeakPolarHBondContact CD2-O 3.45Å; F195-C247 WeakPolarHBondContact O-CB 3.44Å; C214-C247 WeakPolarHBondContact CA-SG 3.31Å; C214-C247 HydrophobicContact CB-CB 3.68Å; C214-C247 WeakPolarHBondContact CB-SG 3.45Å; C214-C247 WeakPolarHBondContact SG-CB 3.29Å; C214-C247 CovalentContact SG-SG 2.04Å; C214-C247 PolarHBondContact SG-SG 2.94Å; A218-C247 HydrophobicContact CB-CB 4.03Å
248	A	91.3	Very high	89.2	Confident	10 Å²	10	48.8 Å²	48.8	8%	0.083	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	144.1	174.9	0	0	0	0	0	110.6	A218 V219 P221 R250	A218-A248 CarbonylContact C-O 3.54Å; A218-A248 VanDerWaalsContact CA-O 3.26Å; A218-A248 WeakPolarHBondContact CA-O 3.32Å; V219-A248 PolarHBondContact N-O 3.1Å; V219-A248 PolarHBondContact O-N 3.3Å; P221-A248 HydrophobicContact CG-CB 4.06Å; A248-R250 PolarHBondContact O-N 3.07Å
249	C	92.3	Very high	88.6	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.007	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	132.3	175.1	-60.9	0	0	0	0	110.9	F195 Y253 C262 P274 G275	F195-C249 WeakPolarHBondContact CE1-SG 3.12Å; C249-Y253 WeakPolarHBondContact CB-O 3.49Å; C249-C262 WeakPolarHBondContact CA-SG 3.38Å; C249-C262 HydrophobicContact CB-CB 3.73Å; C249-C262 WeakPolarHBondContact CB-SG 3.42Å; C249-C262 VanDerWaalsContact SG-CA 3.52Å; C249-C262 WeakPolarHBondContact SG-CB 3.32Å; C249-C262 CovalentContact SG-SG 2.03Å; C249-C262 PolarHBondContact SG-SG 3.2Å; C249-P274 VanDerWaalsContact O-CA 3.32Å; C249-P274 WeakPolarHBondContact O-CA 3.45Å; C249-G275 PolarHBondContact O-N 3.28Å
250	R	93.3	Very high	88.4	Confident	100 Å²	100	49 Å²	49	38%	0.377	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-67	165.7	-176.9	78.5	-171.4	178.4	166.3	3.7	111.8	N217 V219 A248 G252 Y253	N217-R250 HydrophobicContact CB-CG 4.44Å; N217-R250 WeakPolarHBondContact O-CB 3.23Å; N217-R250 VanDerWaalsContact O-CG 3.29Å; N217-R250 WeakPolarHBondContact O-CG 3.29Å; N217-R250 PolarHBondContact O-N 3.46Å; N217-R250 PolarHBondContact OD1-NE 2.99Å; N217-R250 PolarHBondContact OD1-NH2 3.34Å; V219-R250 HydrophobicContact CG1-CB 4.25Å; V219-R250 HydrophobicContact CG2-CB 4.32Å; A248-R250 PolarHBondContact O-N 3.07Å; R250-G252 PolarHBondContact O-N 2.91Å; R250-Y253 HydrophobicContact CG-CD2 3.53Å; R250-Y253 HydrophobicContact CG-CE2 4.02Å; R250-Y253 HydrophobicContact CG-CG 4.27Å; R250-Y253 PolarHBondContact NH2-OH 2.86Å; R250-Y253 PolarHBondContact O-N 3.5Å
251	P	93.5	Very high	88.5	Confident	49 Å²	49	51.4 Å²	51.4	32%	0.318	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	134.4	173.7	-30.4	38.2	0	0	0	112.4	Y253 K271 V272 A294	P251-Y253 WeakPolarHBondContact O-CD2 3.05Å; P251-K271 CarbonylContact C-O 3.5Å; P251-K271 WeakPolarHBondContact CA-O 3.37Å; P251-V272 WeakPolarHBondContact CB-O 3.22Å; P251-V272 VanDerWaalsContact CG-O 3.28Å; P251-V272 WeakPolarHBondContact CG-O 3.47Å; P251-A294 HydrophobicContact CB-CB 3.66Å
252	G	94.3	Very high	88.8	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	1.2	-172.2	0	0	0	0	0	116.1	R250 C265 K271 G292 S293	R250-G252 PolarHBondContact O-N 2.91Å; G252-C265 VanDerWaalsContact C-SG 3.5Å; G252-C265 PolarHBondContact O-N 3.4Å; G252-C265 PolarHBondContact O-SG 3.15Å; G252-K271 PolarHBondContact N-O 3.34Å; G252-G292 VanDerWaalsContact O-CA 3.29Å; G252-G292 WeakPolarHBondContact O-CA 3.35Å; G252-S293 VanDerWaalsContact CA-O 3.3Å; G252-S293 WeakPolarHBondContact CA-O 3.44Å
253	Y	94.6	Very high	89	Confident	40 Å²	40	50.2 Å²	50.2	16%	0.157	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	135.9	-178.7	-64	-106.3	0	0	0	113.5	N217 C249 R250 P251 R263 A264 K271	N217-Y253 HydrophobicContact CB-CD1 3.36Å; N217-Y253 HydrophobicContact CB-CD2 4.14Å; N217-Y253 HydrophobicContact CB-CE1 3.49Å; N217-Y253 VanDerWaalsContact CB-CE1 3.49Å; N217-Y253 HydrophobicContact CB-CE2 4.26Å; N217-Y253 HydrophobicContact CB-CG 3.71Å; N217-Y253 VanDerWaalsContact OD1-CE1 3.27Å; N217-Y253 WeakPolarHBondContact OD1-CE1 3.39Å; N217-Y253 PolarHBondContact OD1-OH 2.77Å; N217-Y253 VanDerWaalsContact OD1-OH 3.12Å; C249-Y253 WeakPolarHBondContact CB-O 3.49Å; R250-Y253 HydrophobicContact CG-CD2 3.53Å; R250-Y253 HydrophobicContact CG-CE2 4.02Å; R250-Y253 HydrophobicContact CG-CG 4.27Å; R250-Y253 PolarHBondContact NH2-OH 2.86Å; R250-Y253 PolarHBondContact O-N 3.5Å; P251-Y253 WeakPolarHBondContact O-CD2 3.05Å; Y253-R263 CarbonylContact C-O 3.54Å; Y253-R263 WeakPolarHBondContact CA-O 3.49Å; Y253-R263 WeakPolarHBondContact CB-O 3.42Å; Y253-A264 HydrophobicContact CD1-CB 4.04Å; Y253-A264 HydrophobicContact CE1-CB 3.74Å; Y253-K271 WeakPolarHBondContact O-CD 3.31Å; Y253-K271 WeakPolarHBondContact O-CE 3.46Å; Y253-K271 PolarHBondContact O-NZ 3.18Å
254	E	92.7	Very high	89.4	Confident	56 Å²	56	51.2 Å²	51.2	26%	0.262	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	169.9	178	65.1	-178.7	179.1	0	0	113.1	C262 R263 C279	E254-C262 CarbonylContact O-C 3.47Å; E254-C262 VanDerWaalsContact O-CA 3.32Å; E254-C262 WeakPolarHBondContact O-CA 3.17Å; E254-R263 PolarHBondContact N-O 3.47Å; E254-R263 PolarHBondContact O-N 2.93Å; E254-C279 HydrophobicContact CG-CB 4.48Å; E254-C279 VanDerWaalsContact CG-SG 3.55Å; E254-C279 VanDerWaalsContact OE2-CB 3.32Å; E254-C279 WeakPolarHBondContact OE2-CB 3.47Å; E254-C279 PolarHBondContact OE2-N 3Å; E254-C279 PolarHBondContact OE2-SG 3.07Å
255	A	90.9	Very high	89.8	Confident	46 Å²	46	46.7 Å²	46.7	38%	0.38	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	135.3	179.3	0	0	0	0	0	112.3	F195	F195-A255 HydrophobicContact CE1-CB 3.91Å; F195-A255 HydrophobicContact CZ-CB 3.62Å
256	G	85.1	Confident	90.3	Very high	1 Å²	1	48 Å²	48	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	137	172.8	0	0	0	0	0	111.6	L260 R261	G256-L260 PolarHBondContact O-N 3Å; G256-R261 PolarHBondContact N-O 3.35Å; G256-R261 WeakPolarHBondContact O-CG 3.26Å; G256-R261 PolarHBondContact O-N 2.89Å; G256-R261 VanDerWaalsContact O-N 3.16Å
257	D	83.1	Confident	90.7	Very high	79 Å²	79	48 Å²	48	42%	0.422	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	58.7	178.2	-52.8	-27	0	0	0	114.3	D259 L260 R261 R263	D257-D259 PolarHBondContact O-N 3.38Å; D257-L260 WeakPolarHBondContact O-CB 3.15Å; D257-L260 WeakPolarHBondContact O-CD1 3.46Å; D257-L260 WeakPolarHBondContact O-CG 3.45Å; D257-R261 IonicContact OD2-CZ 3.15Å; D257-R261 IonicContact OD2-NE 3.39Å; D257-R261 PolarHBondContact OD2-NE 3.38Å; D257-R261 IonicContact OD2-NH2 2.75Å; D257-R261 PolarHBondContact OD2-NH2 3.13Å; D257-R263 IonicContact OD1-CZ 2.81Å; D257-R263 IonicContact OD1-NH1 2.85Å; D257-R263 IonicContact OD1-NH2 3.79Å; D257-R263 PolarHBondContact OD1-NH2 3.3Å; D257-R263 IonicContact OD2-NH2 3.27Å; D257-R263 PolarHBondContact OD2-NH2 2.99Å
258	G	75.1	Confident	90.8	Very high	70 Å²	70	48.9 Å²	48.9	72%	0.722	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	51.5	173.4	0	0	0	0	0	113.2	L260	G258-L260 VanDerWaalsContact C-N 3.31Å; G258-L260 PolarHBondContact O-N 3.07Å
259	D	80.4	Confident	91	Very high	76 Å²	76	51 Å²	51	41%	0.406	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	25.1	175.7	-52.4	-17.1	0	0	0	115.8	F195 D257	F195-D259 HydrophobicContact CD1-CB 4.49Å; F195-D259 HydrophobicContact CD2-CB 4.11Å; F195-D259 HydrophobicContact CE1-CB 3.99Å; F195-D259 HydrophobicContact CE2-CB 3.56Å; F195-D259 HydrophobicContact CZ-CB 3.5Å; F195-D259 VanDerWaalsContact CZ-CG 3.46Å; F195-D259 WeakPolarHBondContact CZ-OD1 3.22Å; F195-D259 PolarHBondContact N-O 2.89Å; D257-D259 PolarHBondContact O-N 3.38Å
260	L	87.6	Confident	91.1	Very high	72 Å²	72	51.1 Å²	51.1	38%	0.377	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-20.4	178.7	-61.2	-179.7	0	0	0	114.3	R192 G256 D257 G258	R192-L260 HydrophobicContact CB-CD2 3.95Å; R192-L260 WeakPolarHBondContact O-CD2 3.46Å; G256-L260 PolarHBondContact O-N 3Å; D257-L260 WeakPolarHBondContact O-CB 3.15Å; D257-L260 WeakPolarHBondContact O-CD1 3.46Å; D257-L260 WeakPolarHBondContact O-CG 3.45Å; G258-L260 VanDerWaalsContact C-N 3.31Å; G258-L260 PolarHBondContact O-N 3.07Å
261	R	91.6	Very high	91.1	Very high	119 Å²	119	46.9 Å²	46.9	45%	0.449	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	162.1	176	55.1	172.7	163.2	177.6	-7.6	112.4	G256 D257 R263	G256-R261 PolarHBondContact N-O 3.35Å; G256-R261 WeakPolarHBondContact O-CG 3.26Å; G256-R261 PolarHBondContact O-N 2.89Å; G256-R261 VanDerWaalsContact O-N 3.16Å; D257-R261 IonicContact OD2-CZ 3.15Å; D257-R261 IonicContact OD2-NE 3.39Å; D257-R261 PolarHBondContact OD2-NE 3.38Å; D257-R261 IonicContact OD2-NH2 2.75Å; D257-R261 PolarHBondContact OD2-NH2 3.13Å; R261-R263 VanDerWaalsContact NH2-NH2 3.2Å
262	C	93.4	Very high	91	Very high	11 Å²	11	47.1 Å²	47.1	7%	0.074	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	122.7	172.9	-66.3	0	0	0	0	110.4	F195 N217 C249 E254	F195-C262 VanDerWaalsContact CD1-SG 3.59Å; N217-C262 HydrophobicContact CB-CB 3.95Å; C249-C262 WeakPolarHBondContact CA-SG 3.38Å; C249-C262 HydrophobicContact CB-CB 3.73Å; C249-C262 WeakPolarHBondContact CB-SG 3.42Å; C249-C262 VanDerWaalsContact SG-CA 3.52Å; C249-C262 WeakPolarHBondContact SG-CB 3.32Å; C249-C262 CovalentContact SG-SG 2.03Å; C249-C262 PolarHBondContact SG-SG 3.2Å; E254-C262 CarbonylContact O-C 3.47Å; E254-C262 VanDerWaalsContact O-CA 3.32Å; E254-C262 WeakPolarHBondContact O-CA 3.17Å
263	R	93.6	Very high	90.7	Very high	103 Å²	103	54 Å²	54	39%	0.389	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	138.8	179.4	-71.7	179.2	171.4	146.4	2.9	110.1	Y253 E254 D257 R261	Y253-R263 CarbonylContact C-O 3.54Å; Y253-R263 WeakPolarHBondContact CA-O 3.49Å; Y253-R263 WeakPolarHBondContact CB-O 3.42Å; E254-R263 PolarHBondContact N-O 3.47Å; E254-R263 PolarHBondContact O-N 2.93Å; D257-R263 IonicContact OD1-CZ 2.81Å; D257-R263 IonicContact OD1-NH1 2.85Å; D257-R263 IonicContact OD1-NH2 3.79Å; D257-R263 PolarHBondContact OD1-NH2 3.3Å; D257-R263 IonicContact OD2-NH2 3.27Å; D257-R263 PolarHBondContact OD2-NH2 2.99Å; R261-R263 VanDerWaalsContact NH2-NH2 3.2Å
264	A	95.1	Very high	90.2	Very high	44 Å²	44	54.7 Å²	54.7	36%	0.364	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	136.9	174.7	0	0	0	0	0	110.4	Y253 P291	Y253-A264 HydrophobicContact CD1-CB 4.04Å; Y253-A264 HydrophobicContact CE1-CB 3.74Å; A264-P291 HydrophobicContact CB-CB 4.4Å
265	C	95.3	Very high	89.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-54.5	137.8	172.8	-65.3	0	0	0	0	110.4	G252 H269 C279 P291 G292	G252-C265 VanDerWaalsContact C-SG 3.5Å; G252-C265 PolarHBondContact O-N 3.4Å; G252-C265 PolarHBondContact O-SG 3.15Å; C265-H269 HydrophobicContact CB-CB 4.23Å; C265-C279 WeakPolarHBondContact CA-SG 3.38Å; C265-C279 HydrophobicContact CB-CB 3.7Å; C265-C279 WeakPolarHBondContact CB-SG 3.43Å; C265-C279 WeakPolarHBondContact SG-CB 3.39Å; C265-C279 CovalentContact SG-SG 2.02Å; C265-C279 PolarHBondContact SG-SG 3.29Å; C265-P291 CarbonylContact O-C 3.44Å; C265-P291 WeakPolarHBondContact O-CA 3.24Å; C265-P291 WeakPolarHBondContact O-CB 3.25Å; C265-G292 PolarHBondContact O-N 3.22Å
266	P	95.3	Very high	88.6	Confident	64 Å²	64	56.9 Å²	56.9	42%	0.416	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-64.2	161.1	175.4	26.1	-32.6	0	0	0	111.3	H269	P266-H269 HydrophobicContact CG-CB 4.03Å; P266-H269 WeakPolarHBondContact O-CB 3.31Å; P266-H269 PolarHBondContact O-N 3.14Å
267	S	94.9	Very high	88.3	Confident	65 Å²	65	58.9 Å²	58.9	46%	0.455	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	145	173.5	-57.5	0	0	0	0	111	H269 R289	S267-H269 PolarHBondContact O-N 2.75Å; S267-H269 PolarHBondContact O-ND1 3.49Å; S267-R289 PolarHBondContact OG-O 2.9Å
268	G	94	Very high	88.6	Confident	20 Å²	20	57.1 Å²	57.1	21%	0.206	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	4	-170.9	0	0	0	0	0	115	C282 T288	G268-C282 PolarHBondContact O-N 2.81Å; G268-C282 PolarHBondContact O-SG 3.12Å; G268-C282 VanDerWaalsContact O-SG 3.38Å; G268-T288 PolarHBondContact N-O 3.24Å
269	H	95.3	Very high	89.5	Confident	56 Å²	56	54.9 Å²	54.9	26%	0.259	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	155.4	176.6	-61.8	65.8	0	0	0	111.8	C265 P266 S267 C279 T280 S281 T288	C265-H269 HydrophobicContact CB-CB 4.23Å; P266-H269 HydrophobicContact CG-CB 4.03Å; P266-H269 WeakPolarHBondContact O-CB 3.31Å; P266-H269 PolarHBondContact O-N 3.14Å; S267-H269 PolarHBondContact O-N 2.75Å; S267-H269 PolarHBondContact O-ND1 3.49Å; H269-C279 HydrophobicContact CB-CB 4.23Å; H269-T280 CarbonylContact C-O 3.59Å; H269-T280 WeakPolarHBondContact CA-O 3.43Å; H269-T280 WeakPolarHBondContact CB-O 3.46Å; H269-S281 VanDerWaalsContact CD2-CA 3.47Å; H269-S281 WeakPolarHBondContact CD2-CA 3.21Å; H269-S281 PolarHBondContact CD2-N 2.87Å; H269-S281 PolarHBondContact CD2-OG 2.84Å; H269-S281 PolarHBondContact NE2-OG 2.91Å; H269-T288 WeakPolarHBondContact O-CG2 3.31Å
270	F	94.3	Very high	90.2	Very high	3 Å²	3	54.9 Å²	54.9	1%	0.013	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	165.4	-178.4	76.6	-62.8	0	0	0	112.3	V272 T280 S281 S293 C296 H311	F270-V272 HydrophobicContact CD2-CG2 3.8Å; F270-V272 HydrophobicContact CE2-CG2 3.44Å; F270-V272 VanDerWaalsContact CE2-CG2 3.44Å; F270-T280 VanDerWaalsContact CD1-O 3.24Å; F270-T280 WeakPolarHBondContact CD1-O 3.5Å; F270-T280 WeakPolarHBondContact CE1-OG1 3.18Å; F270-T280 PolarHBondContact N-O 2.84Å; F270-T280 PolarHBondContact O-N 3.46Å; F270-T280 PolarHBondContact O-OG1 2.82Å; F270-S281 WeakPolarHBondContact CE1-O 3.49Å; F270-S293 WeakPolarHBondContact CA-O 3.35Å; F270-S293 WeakPolarHBondContact CB-O 3.16Å; F270-C296 WeakPolarHBondContact CD1-SG 3.34Å; F270-C296 VanDerWaalsContact CG-SG 3.51Å; F270-H311 HydrophobicContact CZ-CB 4.07Å
271	K	93.7	Very high	90.5	Very high	11 Å²	11	55.1 Å²	55.1	5%	0.048	34%	0.341	C	S	.	.			trans	-148.1	120.6	170.6	175.1	179.7	169.3	175.2	0	110.6	P251 G252 Y253 E273 G275 G277 S293 A294	P251-K271 CarbonylContact C-O 3.5Å; P251-K271 WeakPolarHBondContact CA-O 3.37Å; G252-K271 PolarHBondContact N-O 3.34Å; Y253-K271 WeakPolarHBondContact O-CD 3.31Å; Y253-K271 WeakPolarHBondContact O-CE 3.46Å; Y253-K271 PolarHBondContact O-NZ 3.18Å; K271-E273 WeakPolarHBondContact CE-O 3.33Å; K271-G275 PolarHBondContact NZ-O 2.68Å; K271-G277 WeakPolarHBondContact CD-O 3.33Å; K271-G277 WeakPolarHBondContact CE-O 3.46Å; K271-G277 PolarHBondContact NZ-O 2.88Å; K271-S293 PolarHBondContact N-O 3.02Å; K271-A294 CarbonylContact C-O 3.59Å; K271-A294 WeakPolarHBondContact O-CA 3.23Å
272	V	90.8	Very high	90.7	Very high	53 Å²	53	50.7 Å²	50.7	32%	0.321	33%	0.328	S	S	.	.			trans	-78.5	-47	-171.3	-170	0	0	0	0	112.8	P251 F270 A294 P310	P251-V272 WeakPolarHBondContact CB-O 3.22Å; P251-V272 VanDerWaalsContact CG-O 3.28Å; P251-V272 WeakPolarHBondContact CG-O 3.47Å; F270-V272 HydrophobicContact CD2-CG2 3.8Å; F270-V272 HydrophobicContact CE2-CG2 3.44Å; F270-V272 VanDerWaalsContact CE2-CG2 3.44Å; V272-A294 WeakPolarHBondContact CA-O 3.35Å; V272-P310 HydrophobicContact CG1-CB 3.99Å; V272-P310 HydrophobicContact CG1-CG 3.93Å; V272-P310 HydrophobicContact CG2-CB 3.87Å
273	E	88	Confident	90.7	Very high	146 Å²	146	51.3 Å²	51.3	68%	0.682	33%	0.332	S	S	*	.	S	Bend	trans	-111.2	149	-167.7	-68	179.8	174.1	0	0	111.7	K271	K271-E273 WeakPolarHBondContact CE-O 3.33Å
274	P	85.1	Confident	90.8	Very high	54 Å²	54	48.4 Å²	48.4	35%	0.351	34%	0.335	S	S	.	.	S	Bend	trans	-67.9	137.4	168.8	30.6	-33.6	0	0	0	110.2	V219 C249	V219-P274 HydrophobicContact CG2-CB 4.11Å; C249-P274 VanDerWaalsContact O-CA 3.32Å; C249-P274 WeakPolarHBondContact O-CA 3.45Å
275	G	79.4	Confident	90.8	Very high	24 Å²	24	49.4 Å²	49.4	25%	0.247	33%	0.334	C	S	.	.	S	Bend	trans	157.8	-169.9	179.4	0	0	0	0	0	114.2	C249 K271 G277	C249-G275 PolarHBondContact O-N 3.28Å; K271-G275 PolarHBondContact NZ-O 2.68Å; G275-G277 VanDerWaalsContact C-N 3.3Å; G275-G277 PolarHBondContact O-N 2.7Å
276	S	69.3	Low	90.8	Very high	124 Å²	124	49.9 Å²	49.9	87%	0.867	34%	0.338	S	S	*	.	S	Bend	trans	-76.8	-9	177.5	51.5	0	0	0	0	114.5
277	G	79.4	Confident	90.8	Very high	42 Å²	42	50.4 Å²	50.4	43%	0.433	34%	0.337	S	S	.	.			trans	-60.4	139.2	175.8	0	0	0	0	0	112.6	K271 G275	K271-G277 WeakPolarHBondContact CD-O 3.33Å; K271-G277 WeakPolarHBondContact CE-O 3.46Å; K271-G277 PolarHBondContact NZ-O 2.88Å; G275-G277 VanDerWaalsContact C-N 3.3Å; G275-G277 PolarHBondContact O-N 2.7Å
278	G	89.7	Confident	90.8	Very high	43 Å²	43	47.8 Å²	47.8	44%	0.443	32%	0.318	S	S	.	.			trans	-77.4	175.2	172.6	0	0	0	0	0	113.1
279	C	93.7	Very high	90.7	Very high	22 Å²	22	57.2 Å²	57.2	15%	0.149	35%	0.347	C	S	.	.			trans	-73	132.5	173.4	-66.4	0	0	0	0	111.1	E254 C265 H269	E254-C279 HydrophobicContact CG-CB 4.48Å; E254-C279 VanDerWaalsContact CG-SG 3.55Å; E254-C279 VanDerWaalsContact OE2-CB 3.32Å; E254-C279 WeakPolarHBondContact OE2-CB 3.47Å; E254-C279 PolarHBondContact OE2-N 3Å; E254-C279 PolarHBondContact OE2-SG 3.07Å; C265-C279 WeakPolarHBondContact CA-SG 3.38Å; C265-C279 HydrophobicContact CB-CB 3.7Å; C265-C279 WeakPolarHBondContact CB-SG 3.43Å; C265-C279 WeakPolarHBondContact SG-CB 3.39Å; C265-C279 CovalentContact SG-SG 2.02Å; C265-C279 PolarHBondContact SG-SG 3.29Å; H269-C279 HydrophobicContact CB-CB 4.23Å
280	T	93.8	Very high	90.6	Very high	76 Å²	76	60.3 Å²	60.3	47%	0.466	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	145.3	179.4	54.2	0	0	0	0	110.5	H269 F270	H269-T280 CarbonylContact C-O 3.59Å; H269-T280 WeakPolarHBondContact CA-O 3.43Å; H269-T280 WeakPolarHBondContact CB-O 3.46Å; F270-T280 VanDerWaalsContact CD1-O 3.24Å; F270-T280 WeakPolarHBondContact CD1-O 3.5Å; F270-T280 WeakPolarHBondContact CE1-OG1 3.18Å; F270-T280 PolarHBondContact N-O 2.84Å; F270-T280 PolarHBondContact O-N 3.46Å; F270-T280 PolarHBondContact O-OG1 2.82Å
281	S	94.9	Very high	90.6	Very high	77 Å²	77	63.8 Å²	63.8	54%	0.538	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	145.7	176.8	-44.5	0	0	0	0	110.7	H269 F270	H269-S281 VanDerWaalsContact CD2-CA 3.47Å; H269-S281 WeakPolarHBondContact CD2-CA 3.21Å; H269-S281 PolarHBondContact CD2-N 2.87Å; H269-S281 PolarHBondContact CD2-OG 2.84Å; H269-S281 PolarHBondContact NE2-OG 2.91Å; F270-S281 WeakPolarHBondContact CE1-O 3.49Å
282	C	95.4	Very high	90.7	Very high	26 Å²	26	64 Å²	64	18%	0.176	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-56.3	134	179.2	-71.9	0	0	0	0	111.5	G268 T288 C296	G268-C282 PolarHBondContact O-N 2.81Å; G268-C282 PolarHBondContact O-SG 3.12Å; G268-C282 VanDerWaalsContact O-SG 3.38Å; C282-T288 PolarHBondContact SG-N 3.4Å; C282-C296 WeakPolarHBondContact CA-SG 3.22Å; C282-C296 HydrophobicContact CB-CB 3.69Å; C282-C296 WeakPolarHBondContact CB-SG 3.46Å; C282-C296 WeakPolarHBondContact SG-CB 3.48Å; C282-C296 CovalentContact SG-SG 2.03Å; C282-C296 PolarHBondContact SG-SG 2.74Å
283	P	94.8	Very high	90.9	Very high	24 Å²	24	62.4 Å²	62.4	16%	0.156	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-71	165.9	178.4	32.4	-38.3	0	0	0	111.3	S286 H311 A312 A313	P283-S286 VanDerWaalsContact CD-OG 3.31Å; P283-S286 WeakPolarHBondContact CD-OG 3.36Å; P283-S286 WeakPolarHBondContact CG-OG 3.22Å; P283-S286 WeakPolarHBondContact O-CB 3.49Å; P283-S286 PolarHBondContact O-N 3.45Å; P283-S286 VanDerWaalsContact O-N 3.15Å; P283-S286 PolarHBondContact O-OG 2.82Å; P283-H311 WeakPolarHBondContact CB-O 3.48Å; P283-A312 WeakPolarHBondContact CG-O 3.18Å; P283-A313 HydrophobicContact CB-CB 4.45Å
284	G	94.9	Very high	91.1	Very high	43 Å²	43	57.2 Å²	57.2	44%	0.443	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	143	-174.5	0	0	0	0	0	114.4	S286 A313 C314	G284-S286 PolarHBondContact O-N 3.01Å; G284-S286 VanDerWaalsContact O-N 3.14Å; G284-A313 CarbonylContact O-C 3.57Å; G284-A313 VanDerWaalsContact O-CA 3.3Å; G284-A313 WeakPolarHBondContact O-CA 3.32Å; G284-A313 WeakPolarHBondContact O-CB 3.47Å; G284-C314 PolarHBondContact O-N 2.82Å
285	N	95.4	Very high	91.4	Very high	64 Å²	64	61.7 Å²	61.7	34%	0.342	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	21.7	-177	-47.5	-46.4	0	0	0	115.1	L299 Y302 C314	N285-L299 WeakPolarHBondContact O-CG 3.18Å; N285-L299 PolarHBondContact O-N 3.43Å; N285-Y302 HydrophobicContact CB-CD1 3.68Å; N285-Y302 HydrophobicContact CB-CD2 3.94Å; N285-Y302 HydrophobicContact CB-CE1 4.04Å; N285-Y302 HydrophobicContact CB-CE2 4.27Å; N285-Y302 HydrophobicContact CB-CG 3.63Å; N285-Y302 VanDerWaalsContact CG-CE1 3.49Å; N285-Y302 VanDerWaalsContact ND2-CE1 3.34Å; N285-Y302 WeakPolarHBondContact ND2-CE1 3.43Å; N285-C314 HydrophobicContact CB-CB 4.07Å; N285-C314 WeakPolarHBondContact CB-O 3.3Å; N285-C314 PolarHBondContact ND2-O 2.82Å
286	S	95.6	Very high	92.1	Very high	11 Å²	11	60.6 Å²	60.6	8%	0.077	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-133.5	153.1	172.8	79.8	0	0	0	0	110.8	P283 G284 C296 P297 R304	P283-S286 VanDerWaalsContact CD-OG 3.31Å; P283-S286 WeakPolarHBondContact CD-OG 3.36Å; P283-S286 WeakPolarHBondContact CG-OG 3.22Å; P283-S286 WeakPolarHBondContact O-CB 3.49Å; P283-S286 PolarHBondContact O-N 3.45Å; P283-S286 VanDerWaalsContact O-N 3.15Å; P283-S286 PolarHBondContact O-OG 2.82Å; G284-S286 PolarHBondContact O-N 3.01Å; G284-S286 VanDerWaalsContact O-N 3.14Å; S286-C296 VanDerWaalsContact OG-CB 3.3Å; S286-C296 WeakPolarHBondContact OG-CB 3.46Å; S286-P297 VanDerWaalsContact CA-O 3.29Å; S286-P297 WeakPolarHBondContact CA-O 3.04Å; S286-P297 WeakPolarHBondContact CB-O 3.1Å; S286-R304 PolarHBondContact OG-NH2 2.87Å
287	N	94.9	Very high	93.3	Very high	75 Å²	75	57.3 Å²	57.3	40%	0.401	34%	0.341	S	S	.	.			trans	-159.2	146	178.1	-168.7	6.8	0	0	0	111.2	P297 L299	N287-P297 PolarHBondContact N-O 2.87Å; N287-P297 VanDerWaalsContact O-CD 3.32Å; N287-P297 WeakPolarHBondContact O-CD 3.4Å; N287-P297 WeakPolarHBondContact O-CG 3.22Å; N287-L299 HydrophobicContact CB-CD2 4.22Å
288	T	94.2	Very high	94	Very high	9 Å²	9	57.3 Å²	57.3	6%	0.055	33%	0.334	C	S	.	.			trans	-120.7	135.6	167	-173.9	0	0	0	0	111.4	G268 H269 C282 I290 S293	G268-T288 PolarHBondContact N-O 3.24Å; H269-T288 WeakPolarHBondContact O-CG2 3.31Å; C282-T288 PolarHBondContact SG-N 3.4Å; T288-I290 PolarHBondContact OG1-N 2.84Å; T288-I290 PolarHBondContact OG1-O 2.77Å; T288-S293 WeakPolarHBondContact CB-OG 3.48Å; T288-S293 WeakPolarHBondContact CG2-OG 3.37Å; T288-S293 PolarHBondContact OG1-OG 3.47Å
289	R	92.9	Very high	94.2	Very high	219 Å²	219	59.4 Å²	59.4	83%	0.826	34%	0.335	S	S	*	.			trans	-91	-19.9	175.9	-61	-176.2	-176	-175	1.3	112.5	S267	S267-R289 PolarHBondContact OG-O 2.9Å
290	I	92.8	Very high	94.2	Very high	121 Å²	121	67.2 Å²	67.2	62%	0.621	37%	0.369	S	S	*	.	S	Bend	trans	-95.3	125.7	-170.9	-49.4	176.9	0	0	0	109.2	T288 S293	T288-I290 PolarHBondContact OG1-N 2.84Å; T288-I290 PolarHBondContact OG1-O 2.77Å; I290-S293 PolarHBondContact O-OG 3.31Å
291	P	94.7	Very high	94	Very high	75 Å²	75	65.7 Å²	65.7	49%	0.487	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	151	171	-22.8	33.8	0	0	0	111.8	A264 C265	A264-P291 HydrophobicContact CB-CB 4.4Å; C265-P291 CarbonylContact O-C 3.44Å; C265-P291 WeakPolarHBondContact O-CA 3.24Å; C265-P291 WeakPolarHBondContact O-CB 3.25Å
292	G	94	Very high	94	Very high	17 Å²	17	64.8 Å²	64.8	18%	0.175	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	20	177.9	0	0	0	0	0	114.7	G252 C265	G252-G292 VanDerWaalsContact O-CA 3.29Å; G252-G292 WeakPolarHBondContact O-CA 3.35Å; C265-G292 PolarHBondContact O-N 3.22Å
293	S	94.8	Very high	93.9	Very high	18 Å²	18	65.3 Å²	65.3	13%	0.126	35%	0.354	C	S	.	.			trans	-75.3	130	-175	-72	0	0	0	0	113.2	G252 F270 K271 T288 I290	G252-S293 VanDerWaalsContact CA-O 3.3Å; G252-S293 WeakPolarHBondContact CA-O 3.44Å; F270-S293 WeakPolarHBondContact CA-O 3.35Å; F270-S293 WeakPolarHBondContact CB-O 3.16Å; K271-S293 PolarHBondContact N-O 3.02Å; T288-S293 WeakPolarHBondContact CB-OG 3.48Å; T288-S293 WeakPolarHBondContact CG2-OG 3.37Å; T288-S293 PolarHBondContact OG1-OG 3.47Å; I290-S293 PolarHBondContact O-OG 3.31Å
294	A	92.6	Very high	93.8	Very high	37 Å²	37	66.2 Å²	66.2	31%	0.306	35%	0.354	S	S	.	.	S	Bend	trans	-78.5	-22.1	174.5	0	0	0	0	0	113.6	P251 K271 V272	P251-A294 HydrophobicContact CB-CB 3.66Å; K271-A294 CarbonylContact C-O 3.59Å; K271-A294 WeakPolarHBondContact O-CA 3.23Å; V272-A294 WeakPolarHBondContact CA-O 3.35Å
295	Y	92.5	Very high	93.7	Very high	149 Å²	149	64.6 Å²	64.6	58%	0.584	34%	0.337	S	S	*	.	S	Bend	trans	-146.3	161	179.8	70.1	-83.2	0	0	0	110.5	P297	Y295-P297 HydrophobicContact CE2-CB 4.12Å; Y295-P297 HydrophobicContact CE2-CG 4.49Å
296	C	94.3	Very high	93.4	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	36%	0.363	C	S	.	.			trans	-104.1	114.1	171.7	-61	0	0	0	0	109.9	F270 C282 S286 R304	F270-C296 WeakPolarHBondContact CD1-SG 3.34Å; F270-C296 VanDerWaalsContact CG-SG 3.51Å; C282-C296 WeakPolarHBondContact CA-SG 3.22Å; C282-C296 HydrophobicContact CB-CB 3.69Å; C282-C296 WeakPolarHBondContact CB-SG 3.46Å; C282-C296 WeakPolarHBondContact SG-CB 3.48Å; C282-C296 CovalentContact SG-SG 2.03Å; C282-C296 PolarHBondContact SG-SG 2.74Å; S286-C296 VanDerWaalsContact OG-CB 3.3Å; S286-C296 WeakPolarHBondContact OG-CB 3.46Å; C296-R304 PolarHBondContact O-NH1 2.98Å
297	P	93.7	Very high	93.1	Very high	56 Å²	56	74 Å²	74	36%	0.364	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-63.4	149.6	173.9	25	-31.6	0	0	0	111	S286 N287 Y295	S286-P297 VanDerWaalsContact CA-O 3.29Å; S286-P297 WeakPolarHBondContact CA-O 3.04Å; S286-P297 WeakPolarHBondContact CB-O 3.1Å; N287-P297 PolarHBondContact N-O 2.87Å; N287-P297 VanDerWaalsContact O-CD 3.32Å; N287-P297 WeakPolarHBondContact O-CD 3.4Å; N287-P297 WeakPolarHBondContact O-CG 3.22Å; Y295-P297 HydrophobicContact CE2-CB 4.12Å; Y295-P297 HydrophobicContact CE2-CG 4.49Å
298	C	94.6	Very high	93	Very high	41 Å²	41	71.8 Å²	71.8	28%	0.277	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-71.4	151.6	179.2	-61.1	0	0	0	0	112	Y302 C314	C298-Y302 WeakPolarHBondContact CB-O 3.3Å; C298-C314 WeakPolarHBondContact CA-SG 3.45Å; C298-C314 HydrophobicContact CB-CB 3.63Å; C298-C314 WeakPolarHBondContact CB-SG 3.35Å; C298-C314 WeakPolarHBondContact SG-CB 3.17Å; C298-C314 CovalentContact SG-SG 2.03Å; C298-C314 PolarHBondContact SG-SG 2.99Å
299	L	94.4	Very high	92.8	Very high	87 Å²	87	74.1 Å²	74.1	46%	0.455	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-72.8	153.9	168.4	-61.4	179.6	0	0	0	110.1	N285 N287 G301 Y302	N285-L299 WeakPolarHBondContact O-CG 3.18Å; N285-L299 PolarHBondContact O-N 3.43Å; N287-L299 HydrophobicContact CB-CD2 4.22Å; L299-G301 PolarHBondContact O-N 2.89Å; L299-Y302 HydrophobicContact CB-CD2 4.35Å; L299-Y302 PolarHBondContact O-N 3.38Å
300	H	92.1	Very high	92.4	Very high	187 Å²	187	66.6 Å²	66.6	87%	0.866	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	132.7	-179.9	-177.3	74.2	0	0	0	112.1
301	G	90.4	Very high	92.1	Very high	43 Å²	43	66.8 Å²	66.8	44%	0.443	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	8.3	-174.3	0	0	0	0	0	115	L299 R316	L299-G301 PolarHBondContact O-N 2.89Å; G301-R316 WeakPolarHBondContact O-CB 3.41Å
302	Y	94.3	Very high	92	Very high	58 Å²	58	64.4 Å²	64.4	23%	0.227	36%	0.362	C	S	.	.			trans	-131.6	145.8	171.9	-61.6	-92.8	0	0	0	110.7	N285 C298 L299 T315 R316	N285-Y302 HydrophobicContact CB-CD1 3.68Å; N285-Y302 HydrophobicContact CB-CD2 3.94Å; N285-Y302 HydrophobicContact CB-CE1 4.04Å; N285-Y302 HydrophobicContact CB-CE2 4.27Å; N285-Y302 HydrophobicContact CB-CG 3.63Å; N285-Y302 VanDerWaalsContact CG-CE1 3.49Å; N285-Y302 VanDerWaalsContact ND2-CE1 3.34Å; N285-Y302 WeakPolarHBondContact ND2-CE1 3.43Å; C298-Y302 WeakPolarHBondContact CB-O 3.3Å; L299-Y302 HydrophobicContact CB-CD2 4.35Å; L299-Y302 PolarHBondContact O-N 3.38Å; Y302-T315 CarbonylContact C-O 3.58Å; Y302-T315 WeakPolarHBondContact CA-O 3.35Å; Y302-R316 HydrophobicContact CD1-CB 4.01Å; Y302-R316 HydrophobicContact CD1-CG 4.45Å; Y302-R316 HydrophobicContact CE1-CB 4.22Å; Y302-R316 HydrophobicContact CE1-CG 4.19Å
303	D	94.2	Very high	92	Very high	37 Å²	37	65.6 Å²	65.6	20%	0.198	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-137.9	169.6	-172.7	-58.9	-66.1	0	0	0	110.4	C314 T315 V409 S413	D303-C314 WeakPolarHBondContact O-CA 3.3Å; D303-T315 PolarHBondContact N-O 3.07Å; D303-T315 PolarHBondContact O-N 2.94Å; D303-V409 HydrophobicContact CB-CB 4.09Å; D303-V409 HydrophobicContact CB-CG1 4.19Å; D303-S413 WeakPolarHBondContact OD2-CA 3.42Å; D303-S413 WeakPolarHBondContact OD2-CB 3.34Å; D303-S413 PolarHBondContact OD2-OG 3.02Å
304	R	93.6	Very high	92	Very high	44 Å²	44	64.8 Å²	64.8	17%	0.166	36%	0.364	C	S	.	.			trans	-122.9	145.3	164.5	-72.2	-173.8	-172.3	97.3	-1.4	108.5	S286 C296 D308 A312 C314	S286-R304 PolarHBondContact OG-NH2 2.87Å; C296-R304 PolarHBondContact O-NH1 2.98Å; R304-D308 WeakPolarHBondContact CA-OD2 3.33Å; R304-D308 HydrophobicContact CB-CB 4.21Å; R304-D308 HydrophobicContact CG-CB 4.5Å; R304-A312 VanDerWaalsContact CZ-O 3.3Å; R304-A312 PolarHBondContact NE-O 2.94Å; R304-A312 PolarHBondContact NH2-O 2.98Å; R304-C314 PolarHBondContact NH1-SG 2.76Å
305	A	92.6	Very high	92.2	Very high	9 Å²	9	63.6 Å²	63.6	7%	0.074	35%	0.353	C	S	.	.			trans	-82.1	158	169.4	0	0	0	0	0	110.1	S307 D308 V409	A305-S307 PolarHBondContact O-N 2.71Å; A305-S307 VanDerWaalsContact O-N 3.08Å; A305-D308 PolarHBondContact N-OD2 3.01Å; A305-D308 WeakPolarHBondContact O-CB 3.28Å; A305-D308 PolarHBondContact O-N 2.78Å; A305-V409 HydrophobicContact CB-CG1 4.39Å
306	D	89.1	Confident	92.3	Very high	169 Å²	169	61.5 Å²	61.5	90%	0.904	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-18.8	177.1	-60.7	-36	0	0	0	113.4
307	S	89.6	Confident	92.4	Very high	102 Å²	102	62.4 Å²	62.4	71%	0.713	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-8	174	54.4	0	0	0	0	114.4	A305	A305-S307 PolarHBondContact O-N 2.71Å; A305-S307 VanDerWaalsContact O-N 3.08Å
308	D	91.2	Very high	92.5	Very high	30 Å²	30	59.9 Å²	59.9	16%	0.16	33%	0.334	C	S	.	.	S	Bend	trans	-82.1	132.7	178.3	-66.7	-30.8	0	0	0	110.4	R304 A305 A312 R346	R304-D308 WeakPolarHBondContact CA-OD2 3.33Å; R304-D308 HydrophobicContact CB-CB 4.21Å; R304-D308 HydrophobicContact CG-CB 4.5Å; A305-D308 PolarHBondContact N-OD2 3.01Å; A305-D308 WeakPolarHBondContact O-CB 3.28Å; A305-D308 PolarHBondContact O-N 2.78Å; D308-A312 HydrophobicContact CB-CB 4.24Å; D308-R346 VanDerWaalsContact CG-NH1 3.33Å; D308-R346 IonicContact OD1-CZ 3.37Å; D308-R346 IonicContact OD1-NH1 3.11Å; D308-R346 PolarHBondContact OD1-NH1 3.38Å; D308-R346 VanDerWaalsContact OD1-NH1 3.15Å; D308-R346 IonicContact OD1-NH2 3.01Å; D308-R346 PolarHBondContact OD1-NH2 3.4Å; D308-R346 IonicContact OD2-CZ 2.67Å; D308-R346 IonicContact OD2-NH1 3.21Å; D308-R346 PolarHBondContact OD2-NH1 2.88Å; D308-R346 IonicContact OD2-NH2 3.09Å
309	P	89.7	Confident	92.5	Very high	58 Å²	58	59.8 Å²	59.8	38%	0.377	33%	0.333	S	S	.	.			trans	-66.6	150.5	174.6	28.8	-34.3	0	0	0	110.4	H311 A312	P309-H311 PolarHBondContact O-N 3.16Å; P309-A312 HydrophobicContact CG-CB 4.11Å; P309-A312 VanDerWaalsContact O-CB 3.25Å; P309-A312 WeakPolarHBondContact O-CB 3.23Å; P309-A312 PolarHBondContact O-N 2.79Å
310	P	85.9	Confident	92.6	Very high	60 Å²	60	57.3 Å²	57.3	39%	0.39	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-17.7	-175.5	-26.1	35.6	0	0	0	115.2	V272	V272-P310 HydrophobicContact CG1-CB 3.99Å; V272-P310 HydrophobicContact CG1-CG 3.93Å; V272-P310 HydrophobicContact CG2-CB 3.87Å
311	H	86.5	Confident	92.7	Very high	126 Å²	126	48.6 Å²	48.6	58%	0.583	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-3.1	174.6	60.7	-107	0	0	0	114.4	F270 P283 P309	F270-H311 HydrophobicContact CZ-CB 4.07Å; P283-H311 WeakPolarHBondContact CB-O 3.48Å; P309-H311 PolarHBondContact O-N 3.16Å
312	A	91.8	Very high	92.9	Very high	25 Å²	25	51.1 Å²	51.1	21%	0.207	28%	0.282	C	S	.	.	S	Bend	trans	-67.9	150	173.1	0	0	0	0	0	111.7	P283 R304 D308 P309	P283-A312 WeakPolarHBondContact CG-O 3.18Å; R304-A312 VanDerWaalsContact CZ-O 3.3Å; R304-A312 PolarHBondContact NE-O 2.94Å; R304-A312 PolarHBondContact NH2-O 2.98Å; D308-A312 HydrophobicContact CB-CB 4.24Å; P309-A312 HydrophobicContact CG-CB 4.11Å; P309-A312 VanDerWaalsContact O-CB 3.25Å; P309-A312 WeakPolarHBondContact O-CB 3.23Å; P309-A312 PolarHBondContact O-N 2.79Å
313	A	94.5	Very high	92.8	Very high	42 Å²	42	54.9 Å²	54.9	35%	0.347	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-64.7	147.4	168.2	0	0	0	0	0	110.6	P283 G284	P283-A313 HydrophobicContact CB-CB 4.45Å; G284-A313 CarbonylContact O-C 3.57Å; G284-A313 VanDerWaalsContact O-CA 3.3Å; G284-A313 WeakPolarHBondContact O-CA 3.32Å; G284-A313 WeakPolarHBondContact O-CB 3.47Å
314	C	95.6	Very high	92.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-73.8	143.2	170.6	-56.1	0	0	0	0	109.9	G284 N285 C298 D303 R304	G284-C314 PolarHBondContact O-N 2.82Å; N285-C314 HydrophobicContact CB-CB 4.07Å; N285-C314 WeakPolarHBondContact CB-O 3.3Å; N285-C314 PolarHBondContact ND2-O 2.82Å; C298-C314 WeakPolarHBondContact CA-SG 3.45Å; C298-C314 HydrophobicContact CB-CB 3.63Å; C298-C314 WeakPolarHBondContact CB-SG 3.35Å; C298-C314 WeakPolarHBondContact SG-CB 3.17Å; C298-C314 CovalentContact SG-SG 2.03Å; C298-C314 PolarHBondContact SG-SG 2.99Å; D303-C314 WeakPolarHBondContact O-CA 3.3Å; R304-C314 PolarHBondContact NH1-SG 2.76Å
315	T	95.7	Very high	92.6	Very high	13 Å²	13	56 Å²	56	8%	0.08	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-128.7	168.7	-171.1	51.3	0	0	0	0	109.5	Y302 D303 G344 R346 V409	Y302-T315 CarbonylContact C-O 3.58Å; Y302-T315 WeakPolarHBondContact CA-O 3.35Å; D303-T315 PolarHBondContact N-O 3.07Å; D303-T315 PolarHBondContact O-N 2.94Å; T315-G344 VanDerWaalsContact CB-O 3.32Å; T315-G344 WeakPolarHBondContact CB-O 3.45Å; T315-R346 HydrophobicContact CG2-CG 3.77Å; T315-R346 WeakPolarHBondContact OG1-CD 3.41Å; T315-R346 PolarHBondContact OG1-NH1 3.38Å; T315-V409 WeakPolarHBondContact OG1-CG1 2.98Å
316	R	94.8	Very high	92.3	Very high	104 Å²	104	58 Å²	58	39%	0.392	33%	0.328	S	S	.	.			trans	-126.9	164	-176	65.2	179.9	-177.9	-167	2.6	111.9	G301 Y302 D342 G344 N407 V409	G301-R316 WeakPolarHBondContact O-CB 3.41Å; Y302-R316 HydrophobicContact CD1-CB 4.01Å; Y302-R316 HydrophobicContact CD1-CG 4.45Å; Y302-R316 HydrophobicContact CE1-CB 4.22Å; Y302-R316 HydrophobicContact CE1-CG 4.19Å; R316-D342 IonicContact CZ-OD2 3.22Å; R316-D342 VanDerWaalsContact CZ-OD2 3.22Å; R316-D342 IonicContact NE-OD2 2.91Å; R316-D342 PolarHBondContact NE-OD2 3.31Å; R316-D342 IonicContact NH2-OD2 2.69Å; R316-D342 PolarHBondContact NH2-OD2 2.97Å; R316-G344 PolarHBondContact N-O 3.23Å; R316-G344 VanDerWaalsContact O-CA 3.31Å; R316-G344 WeakPolarHBondContact O-CA 3.41Å; R316-N407 PolarHBondContact O-ND2 2.99Å; R316-V409 VanDerWaalsContact C-CG2 3.44Å; R316-V409 WeakPolarHBondContact O-CG2 3.01Å
317	P	95.3	Very high	92	Very high	19 Å²	19	54.6 Å²	54.6	12%	0.123	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-57	151.5	169.5	-26.6	37.4	0	0	0	112	S413	P317-S413 VanDerWaalsContact CG-CB 3.46Å; P317-S413 WeakPolarHBondContact CG-OG 3.35Å
318	P	96.1	Very high	91.4	Very high	4 Å²	4	53 Å²	53	3%	0.026	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-74.6	156.7	-179.9	33.3	-34.4	0	0	0	111.2	L349 S405 S410 A418	P318-L349 HydrophobicContact CB-CD1 3.95Å; P318-L349 HydrophobicContact CG-CD1 3.97Å; P318-S405 WeakPolarHBondContact CG-O 3.34Å; P318-S410 WeakPolarHBondContact CD-OG 3.43Å; P318-A418 VanDerWaalsContact O-CB 3.27Å; P318-A418 WeakPolarHBondContact O-CB 3.29Å
319	S	95.9	Very high	90.3	Very high	38 Å²	38	56.4 Å²	56.4	27%	0.266	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-69.4	163.2	167.6	61.8	0	0	0	0	111.8	P340 L341 D342 S405	S319-P340 WeakPolarHBondContact O-CB 3.3Å; S319-P340 WeakPolarHBondContact O-CG 3.43Å; S319-L341 PolarHBondContact OG-N 2.87Å; S319-D342 PolarHBondContact N-O 3.11Å; S319-D342 PolarHBondContact OG-N 2.92Å; S319-D342 PolarHBondContact OG-O 2.89Å; S319-S405 PolarHBondContact O-OG 3.49Å
320	A	95.4	Very high	89	Confident	35 Å²	35	59.4 Å²	59.4	29%	0.289	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-61.9	150.6	-175.9	0	0	0	0	0	113.1	A418	A320-A418 HydrophobicContact CB-CB 4.04Å
321	P	95.4	Very high	87.8	Confident	5 Å²	5	59.7 Å²	59.7	3%	0.032	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-58.9	152.1	169.8	-18.1	30.8	0	0	0	111.8	W337 Y351 I403 V420	P321-W337 HydrophobicContact CB-CG 4.34Å; P321-Y351 HydrophobicContact CG-CD1 4.12Å; P321-Y351 HydrophobicContact CG-CE1 4.15Å; P321-I403 HydrophobicContact CB-CG2 4.42Å; P321-I403 HydrophobicContact CG-CB 4.45Å; P321-I403 HydrophobicContact CG-CG2 3.92Å; P321-V420 HydrophobicContact CB-CG1 3.97Å; P321-V420 HydrophobicContact CG-CG1 4.32Å
322	R	94.6	Very high	87.3	Confident	96 Å²	96	54 Å²	54	36%	0.362	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	152.1	-174.6	-63.5	-176.6	-68.6	164.3	-2.5	111.3	V338 E339	R322-V338 HydrophobicContact CB-CB 4.15Å; R322-V338 HydrophobicContact CB-CG1 4.5Å; R322-V338 PolarHBondContact N-O 2.89Å; R322-V338 WeakPolarHBondContact O-CA 3.38Å; R322-V338 WeakPolarHBondContact O-CB 3.42Å; R322-V338 PolarHBondContact O-N 2.81Å; R322-E339 PolarHBondContact NE-O 2.81Å; R322-E339 PolarHBondContact NH2-O 2.93Å; R322-E339 VanDerWaalsContact NH2-O 3.11Å
323	H	91.9	Very high	87	Confident	136 Å²	136	52.8 Å²	52.8	63%	0.63	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	44.1	61.1	172.5	-50.8	-71.4	0	0	0	114.9	V338	H323-V338 HydrophobicContact CB-CG2 4.17Å
324	P	92.9	Very high	86.7	Confident	32 Å²	32	52.3 Å²	52.3	21%	0.208	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	134.9	172.5	30.6	-35.5	0	0	0	110.8	E336 I403 V420 I422	P324-E336 CarbonylContact C-O 3.55Å; P324-E336 WeakPolarHBondContact CA-O 3.31Å; P324-I403 HydrophobicContact CB-CD1 3.95Å; P324-V420 HydrophobicContact CB-CG1 4.37Å; P324-V420 HydrophobicContact CG-CG1 4.01Å; P324-V420 HydrophobicContact CG-CG2 3.85Å; P324-I422 HydrophobicContact CB-CB 4.49Å; P324-I422 HydrophobicContact CB-CD1 4.39Å
325	V	89.1	Confident	86.6	Confident	74 Å²	74	52.3 Å²	52.3	45%	0.448	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	135.2	-180	177.3	0	0	0	0	108.9	L335 E336	V325-L335 WeakPolarHBondContact O-CA 3.36Å; V325-E336 PolarHBondContact N-O 3.01Å; V325-E336 PolarHBondContact O-N 3.14Å
326	S	86.8	Confident	86.5	Confident	49 Å²	49	54.3 Å²	54.3	34%	0.343	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.3	176	52.5	0	0	0	0	111.3
327	Q	83.1	Confident	86.5	Confident	99 Å²	99	50 Å²	50	46%	0.463	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	114.1	170.7	-60.7	172.6	23.4	0	0	108.7	I334	Q327-I334 HydrophobicContact CB-CB 4.33Å; Q327-I334 PolarHBondContact N-O 3.37Å; Q327-I334 PolarHBondContact O-N 3.43Å
328	L	78.1	Confident	86.5	Confident	69 Å²	69	52.3 Å²	52.3	36%	0.361	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.2	179.2	-173.1	77.3	0	0	0	110.2	L333 L393 V424 T425	L328-L333 HydrophobicContact CD1-CB 4.31Å; L328-L393 HydrophobicContact CD1-CD1 4.34Å; L328-V424 HydrophobicContact CD1-CG1 4.35Å; L328-T425 WeakPolarHBondContact CD2-O 3.36Å
329	N	67.1	Low	86.4	Confident	101 Å²	101	55.5 Å²	55.5	54%	0.54	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	104.1	175.6	-174.6	23.8	0	0	0	108.9	S331 S332	N329-S331 PolarHBondContact O-N 2.85Å; N329-S332 PolarHBondContact N-O 2.65Å; N329-S332 PolarHBondContact O-N 2.88Å; N329-S332 PolarHBondContact O-OG 2.95Å
330	D	61.7	Low	86.4	Confident	121 Å²	121	54 Å²	54	65%	0.647	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	-93.8	-173.3	-56	-29.3	0	0	0	114.3
331	S	61.8	Low	86.4	Confident	65 Å²	65	59 Å²	59	46%	0.455	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	9.1	-179.5	60	0	0	0	0	113.7	N329	N329-S331 PolarHBondContact O-N 2.85Å
332	S	75.6	Confident	86.3	Confident	7 Å²	7	61 Å²	61	5%	0.049	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	141.3	-179.7	69.9	0	0	0	0	111.5	N329 V390	N329-S332 PolarHBondContact N-O 2.65Å; N329-S332 PolarHBondContact O-N 2.88Å; N329-S332 PolarHBondContact O-OG 2.95Å; S332-V390 CarbonylContact C-O 3.57Å; S332-V390 WeakPolarHBondContact CA-O 3.48Å
333	L	85.7	Confident	86.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.3	177.7	165	63.6	0	0	0	108.8	L328 L335 T389 V390 L393 F401 V424	L328-L333 HydrophobicContact CD1-CB 4.31Å; L333-L335 HydrophobicContact CD1-CD2 4.05Å; L333-L335 HydrophobicContact CD1-CG 4.34Å; L333-L335 HydrophobicContact CD2-CD1 4.28Å; L333-L335 HydrophobicContact CD2-CD2 4.09Å; L333-L335 HydrophobicContact CD2-CG 4.05Å; L333-L335 HydrophobicContact CG-CD2 4.18Å; L333-L335 HydrophobicContact CG-CG 4Å; L333-T389 CarbonylContact O-C 3.57Å; L333-T389 WeakPolarHBondContact O-CA 3.24Å; L333-V390 HydrophobicContact CB-CB 4.31Å; L333-V390 PolarHBondContact N-O 2.81Å; L333-V390 PolarHBondContact O-N 3.38Å; L333-L393 HydrophobicContact CB-CD1 3.67Å; L333-L393 HydrophobicContact CD2-CD1 4.21Å; L333-F401 HydrophobicContact CD2-CD2 3.81Å; L333-F401 HydrophobicContact CD2-CE2 3.27Å; L333-F401 HydrophobicContact CD2-CZ 3.74Å; L333-V424 HydrophobicContact CD1-CG1 4.13Å; L333-V424 HydrophobicContact CD1-CG2 4.18Å; L333-V424 HydrophobicContact CD2-CB 4.22Å; L333-V424 HydrophobicContact CD2-CG1 4.15Å; L333-V424 HydrophobicContact CD2-CG2 3.93Å
334	I	89.2	Confident	86.3	Confident	31 Å²	31	54.4 Å²	54.4	16%	0.159	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	122.8	168.1	-60.7	167.8	0	0	0	107.3	Q327 E336 R387 T389	Q327-I334 HydrophobicContact CB-CB 4.33Å; Q327-I334 PolarHBondContact N-O 3.37Å; Q327-I334 PolarHBondContact O-N 3.43Å; I334-E336 HydrophobicContact CG2-CG 4.06Å; I334-R387 HydrophobicContact CG2-CG 4.47Å; I334-T389 HydrophobicContact CG1-CG2 3.96Å
335	L	92.8	Very high	86.2	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128	169.8	-68.8	173.1	0	0	0	108.6	V325 L333 W337 L353 R387 V388 V390 F401 I422	V325-L335 WeakPolarHBondContact O-CA 3.36Å; L333-L335 HydrophobicContact CD1-CD2 4.05Å; L333-L335 HydrophobicContact CD1-CG 4.34Å; L333-L335 HydrophobicContact CD2-CD1 4.28Å; L333-L335 HydrophobicContact CD2-CD2 4.09Å; L333-L335 HydrophobicContact CD2-CG 4.05Å; L333-L335 HydrophobicContact CG-CD2 4.18Å; L333-L335 HydrophobicContact CG-CG 4Å; L335-W337 HydrophobicContact CB-CE3 4.45Å; L335-W337 HydrophobicContact CB-CZ3 4.1Å; L335-L353 HydrophobicContact CD1-CD2 3.59Å; L335-R387 CarbonylContact O-C 3.59Å; L335-R387 VanDerWaalsContact O-CA 3.3Å; L335-R387 WeakPolarHBondContact O-CA 3.49Å; L335-V388 HydrophobicContact CB-CG1 4.01Å; L335-V388 HydrophobicContact CD1-CG1 4.42Å; L335-V388 PolarHBondContact N-O 3.17Å; L335-V388 PolarHBondContact O-N 2.79Å; L335-V390 HydrophobicContact CD1-CG2 4.37Å; L335-F401 HydrophobicContact CD1-CB 3.8Å; L335-F401 HydrophobicContact CD1-CD1 3.92Å; L335-F401 HydrophobicContact CD1-CD2 4.19Å; L335-F401 HydrophobicContact CD1-CG 3.7Å; L335-I422 HydrophobicContact CD2-CG2 3.84Å
336	E	93.1	Very high	86.4	Confident	55 Å²	55	54.3 Å²	54.3	26%	0.257	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	147.1	174	-70.8	-178.1	152.1	0	0	109.3	P324 V325 I334 P386 R387	P324-E336 CarbonylContact C-O 3.55Å; P324-E336 WeakPolarHBondContact CA-O 3.31Å; V325-E336 PolarHBondContact N-O 3.01Å; V325-E336 PolarHBondContact O-N 3.14Å; I334-E336 HydrophobicContact CG2-CG 4.06Å; E336-P386 WeakPolarHBondContact CA-O 3.21Å; E336-R387 HydrophobicContact CG-CB 4.05Å; E336-R387 HydrophobicContact CG-CG 3.75Å; E336-R387 WeakPolarHBondContact OE1-CD 3.36Å; E336-R387 IonicContact OE1-CZ 3.16Å; E336-R387 IonicContact OE1-NE 3.31Å; E336-R387 PolarHBondContact OE1-NE 2.67Å; E336-R387 IonicContact OE1-NH1 3.6Å; E336-R387 PolarHBondContact OE1-NH1 2.86Å
337	W	94.9	Very high	86.6	Confident	14 Å²	14	55.4 Å²	55.4	5%	0.053	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	172.2	177.5	55	96.3	0	0	0	111.4	P321 L335 Y351 L353 L383 P386 V388 I403	P321-W337 HydrophobicContact CB-CG 4.34Å; L335-W337 HydrophobicContact CB-CE3 4.45Å; L335-W337 HydrophobicContact CB-CZ3 4.1Å; W337-Y351 AromaticContact CE2-CG 3.92Å; W337-Y351 HydrophobicContact CZ2-CD1 4.47Å; W337-Y351 AromaticContact CZ2-CD2 3.82Å; W337-Y351 HydrophobicContact CZ2-CD2 3.82Å; W337-Y351 AromaticContact CZ2-CG 3.77Å; W337-Y351 HydrophobicContact CZ2-CG 3.77Å; W337-Y351 AromaticContact NE1-CD1 3.41Å; W337-Y351 AromaticContact NE1-CD2 3.56Å; W337-Y351 AromaticContact NE1-CE1 3.44Å; W337-Y351 AromaticContact NE1-CE2 3.61Å; W337-Y351 AromaticContact NE1-CG 3.48Å; W337-Y351 AromaticContact NE1-CZ 3.56Å; W337-L353 HydrophobicContact CH2-CD1 3.78Å; W337-L353 HydrophobicContact CZ2-CD1 4.38Å; W337-L353 HydrophobicContact CZ3-CD1 4.4Å; W337-L383 HydrophobicContact CH2-CD1 4.26Å; W337-P386 VanDerWaalsContact CD1-CB 3.48Å; W337-P386 HydrophobicContact CD2-CB 4.06Å; W337-P386 HydrophobicContact CG-CB 3.91Å; W337-P386 HydrophobicContact CZ2-CB 4.47Å; W337-P386 PolarHBondContact N-O 3.21Å; W337-P386 VanDerWaalsContact O-CB 3.31Å; W337-P386 WeakPolarHBondContact O-CB 3.38Å; W337-V388 HydrophobicContact CH2-CB 4.36Å; W337-V388 HydrophobicContact CH2-CG1 4.12Å; W337-V388 HydrophobicContact CZ3-CG1 4Å; W337-I403 HydrophobicContact CB-CD1 4.48Å; W337-I403 HydrophobicContact CD2-CD1 3.99Å; W337-I403 HydrophobicContact CD2-CG2 4.01Å; W337-I403 HydrophobicContact CE3-CD1 3.68Å; W337-I403 HydrophobicContact CE3-CG2 4.43Å; W337-I403 HydrophobicContact CG-CD1 4.37Å; W337-I403 HydrophobicContact CG-CG2 4.46Å; W337-I403 HydrophobicContact CH2-CG2 4.47Å; W337-I403 HydrophobicContact CZ2-CG2 4.01Å; W337-I403 HydrophobicContact CZ3-CD1 4.26Å
338	V	95.3	Very high	87.1	Confident	67 Å²	67	53.8 Å²	53.8	41%	0.406	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	146.6	171.9	-179.4	0	0	0	0	108.8	R322 H323	R322-V338 HydrophobicContact CB-CB 4.15Å; R322-V338 HydrophobicContact CB-CG1 4.5Å; R322-V338 PolarHBondContact N-O 2.89Å; R322-V338 WeakPolarHBondContact O-CA 3.38Å; R322-V338 WeakPolarHBondContact O-CB 3.42Å; R322-V338 PolarHBondContact O-N 2.81Å; H323-V338 HydrophobicContact CB-CG2 4.17Å
339	E	94.9	Very high	88	Confident	70 Å²	70	51.1 Å²	51.1	33%	0.327	30%	0.301	S	S	.	.			trans	-59.9	151.2	178.8	-55.8	-169	136.2	0	0	112.6	R322 R343	R322-E339 PolarHBondContact NE-O 2.81Å; R322-E339 PolarHBondContact NH2-O 2.93Å; R322-E339 VanDerWaalsContact NH2-O 3.11Å; E339-R343 IonicContact OE1-CZ 3.41Å; E339-R343 IonicContact OE1-NH2 3.68Å; E339-R343 PolarHBondContact OE1-NH2 3.15Å; E339-R343 IonicContact OE2-CZ 2.64Å; E339-R343 IonicContact OE2-NE 3.62Å; E339-R343 IonicContact OE2-NH2 3.87Å; E339-R343 PolarHBondContact OE2-NH2 3.47Å
340	P	95.7	Very high	89.3	Confident	7 Å²	7	47.7 Å²	47.7	5%	0.045	29%	0.285	C	S	.	.			trans	-40.4	150	167	-35.8	39.8	0	0	0	114.8	S319 D342 L349 Y351	S319-P340 WeakPolarHBondContact O-CB 3.3Å; S319-P340 WeakPolarHBondContact O-CG 3.43Å; P340-D342 WeakPolarHBondContact CB-O 2.72Å; P340-L349 HydrophobicContact CG-CD1 4.35Å; P340-L349 HydrophobicContact CG-CD2 4.28Å; P340-Y351 WeakPolarHBondContact CD-OH 3.4Å; P340-Y351 HydrophobicContact CG-CE1 4.35Å
341	L	94.3	Very high	91	Very high	141 Å²	141	42 Å²	42	74%	0.738	25%	0.254	S	S	*	.	S	Bend	trans	-70.3	-44.8	173.3	178	63	0	0	0	111.1	S319	S319-L341 PolarHBondContact OG-N 2.87Å
342	D	94.5	Very high	92.6	Very high	47 Å²	47	44.2 Å²	44.2	25%	0.251	25%	0.253	S	S	.	.			trans	-114.1	131	170.5	-177.7	16.9	0	0	0	110.2	R316 S319 P340 G344	R316-D342 IonicContact CZ-OD2 3.22Å; R316-D342 VanDerWaalsContact CZ-OD2 3.22Å; R316-D342 IonicContact NE-OD2 2.91Å; R316-D342 PolarHBondContact NE-OD2 3.31Å; R316-D342 IonicContact NH2-OD2 2.69Å; R316-D342 PolarHBondContact NH2-OD2 2.97Å; S319-D342 PolarHBondContact N-O 3.11Å; S319-D342 PolarHBondContact OG-N 2.92Å; S319-D342 PolarHBondContact OG-O 2.89Å; P340-D342 WeakPolarHBondContact CB-O 2.72Å; D342-G344 WeakPolarHBondContact OD1-CA 3.3Å; D342-G344 PolarHBondContact OD1-N 2.99Å
343	R	94.1	Very high	93.5	Very high	88 Å²	88	43.9 Å²	43.9	33%	0.332	25%	0.25	S	S	.	.			trans	-88	-4.6	173.9	-60.6	-174	168.1	-137.1	4.2	113.1	E339 L349 N407	E339-R343 IonicContact OE1-CZ 3.41Å; E339-R343 IonicContact OE1-NH2 3.68Å; E339-R343 PolarHBondContact OE1-NH2 3.15Å; E339-R343 IonicContact OE2-CZ 2.64Å; E339-R343 IonicContact OE2-NE 3.62Å; E339-R343 IonicContact OE2-NH2 3.87Å; E339-R343 PolarHBondContact OE2-NH2 3.47Å; R343-L349 HydrophobicContact CG-CD2 4.2Å; R343-N407 PolarHBondContact O-ND2 3.35Å; R343-N407 VanDerWaalsContact O-ND2 3.15Å
344	G	91.2	Very high	93.9	Very high	5 Å²	5	47.6 Å²	47.6	5%	0.052	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	18.5	-176.7	0	0	0	0	0	114.3	T315 R316 D342	T315-G344 VanDerWaalsContact CB-O 3.32Å; T315-G344 WeakPolarHBondContact CB-O 3.45Å; R316-G344 PolarHBondContact N-O 3.23Å; R316-G344 VanDerWaalsContact O-CA 3.31Å; R316-G344 WeakPolarHBondContact O-CA 3.41Å; D342-G344 WeakPolarHBondContact OD1-CA 3.3Å; D342-G344 PolarHBondContact OD1-N 2.99Å
345	G	91.4	Very high	94	Very high	69 Å²	69	46.7 Å²	46.7	71%	0.711	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	12.1	-179.4	0	0	0	0	0	115.7
346	R	92.7	Very high	93.9	Very high	34 Å²	34	47.5 Å²	47.5	13%	0.128	27%	0.272	C	S	.	.			trans	-121.4	156.1	-176.5	-50.5	-176.6	70	87.1	0.3	113.9	D308 T315 D348	D308-R346 VanDerWaalsContact CG-NH1 3.33Å; D308-R346 IonicContact OD1-CZ 3.37Å; D308-R346 IonicContact OD1-NH1 3.11Å; D308-R346 PolarHBondContact OD1-NH1 3.38Å; D308-R346 VanDerWaalsContact OD1-NH1 3.15Å; D308-R346 IonicContact OD1-NH2 3.01Å; D308-R346 PolarHBondContact OD1-NH2 3.4Å; D308-R346 IonicContact OD2-CZ 2.67Å; D308-R346 IonicContact OD2-NH1 3.21Å; D308-R346 PolarHBondContact OD2-NH1 2.88Å; D308-R346 IonicContact OD2-NH2 3.09Å; T315-R346 HydrophobicContact CG2-CG 3.77Å; T315-R346 WeakPolarHBondContact OG1-CD 3.41Å; T315-R346 PolarHBondContact OG1-NH1 3.38Å; R346-D348 WeakPolarHBondContact CB-OD1 3.14Å; R346-D348 WeakPolarHBondContact CD-OD1 3.45Å; R346-D348 IonicContact CZ-OD2 3.57Å; R346-D348 IonicContact NE-OD1 2.66Å; R346-D348 PolarHBondContact NE-OD1 2.85Å; R346-D348 VanDerWaalsContact NE-OD1 3.11Å; R346-D348 IonicContact NE-OD2 3.57Å; R346-D348 PolarHBondContact NE-OD2 3.26Å; R346-D348 IonicContact NH2-OD2 2.74Å; R346-D348 PolarHBondContact NH2-OD2 3Å
347	G	91.9	Very high	93.6	Very high	72 Å²	72	45.2 Å²	45.2	74%	0.742	26%	0.262	S	S	*	.	S	Bend	trans	-94.7	-13.4	174.8	0	0	0	0	0	114.9	L349	G347-L349 PolarHBondContact O-N 3.26Å; G347-L349 VanDerWaalsContact O-N 3.11Å
348	D	94.2	Very high	93	Very high	65 Å²	65	45.2 Å²	45.2	35%	0.348	26%	0.264	S	S	.	.			trans	-83.8	31.8	-175.7	60.8	-1.5	0	0	0	113.6	R346 S350 N407 G408	R346-D348 WeakPolarHBondContact CB-OD1 3.14Å; R346-D348 WeakPolarHBondContact CD-OD1 3.45Å; R346-D348 IonicContact CZ-OD2 3.57Å; R346-D348 IonicContact NE-OD1 2.66Å; R346-D348 PolarHBondContact NE-OD1 2.85Å; R346-D348 VanDerWaalsContact NE-OD1 3.11Å; R346-D348 IonicContact NE-OD2 3.57Å; R346-D348 PolarHBondContact NE-OD2 3.26Å; R346-D348 IonicContact NH2-OD2 2.74Å; R346-D348 PolarHBondContact NH2-OD2 3Å; D348-S350 PolarHBondContact O-N 2.98Å; D348-N407 WeakPolarHBondContact OD1-CB 3.23Å; D348-G408 PolarHBondContact OD1-N 2.79Å; D348-G408 WeakPolarHBondContact OD2-CA 3.45Å; D348-G408 PolarHBondContact OD2-N 2.91Å; D348-G408 VanDerWaalsContact OD2-N 3.14Å
349	L	95.3	Very high	91.8	Very high	14 Å²	14	45 Å²	45	7%	0.073	28%	0.275	C	S	.	.			trans	-66.1	129.7	180	179.5	67.2	0	0	0	111.1	P318 P340 R343 G347 Y351	P318-L349 HydrophobicContact CB-CD1 3.95Å; P318-L349 HydrophobicContact CG-CD1 3.97Å; P340-L349 HydrophobicContact CG-CD1 4.35Å; P340-L349 HydrophobicContact CG-CD2 4.28Å; R343-L349 HydrophobicContact CG-CD2 4.2Å; G347-L349 PolarHBondContact O-N 3.26Å; G347-L349 VanDerWaalsContact O-N 3.11Å; L349-Y351 WeakPolarHBondContact CD2-OH 3.35Å
350	S	95.9	Very high	90	Very high	29 Å²	29	50.4 Å²	50.4	20%	0.203	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	169.5	170.3	62.2	0	0	0	0	111.6	D348 L383 V406	D348-S350 PolarHBondContact O-N 2.98Å; S350-L383 CarbonylContact C-O 3.59Å; S350-L383 VanDerWaalsContact CA-O 3.24Å; S350-L383 WeakPolarHBondContact CA-O 3.23Å; S350-V406 PolarHBondContact N-O 3.16Å; S350-V406 WeakPolarHBondContact O-CG2 3.28Å; S350-V406 PolarHBondContact O-N 2.86Å
351	Y	95.9	Very high	88.1	Confident	1 Å²	1	55.4 Å²	55.4	0%	0.004	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	150.6	-178.5	-49.7	-79	0	0	0	111.9	P321 W337 P340 L349 G382 L383 P386 Q404	P321-Y351 HydrophobicContact CG-CD1 4.12Å; P321-Y351 HydrophobicContact CG-CE1 4.15Å; W337-Y351 AromaticContact CE2-CG 3.92Å; W337-Y351 HydrophobicContact CZ2-CD1 4.47Å; W337-Y351 AromaticContact CZ2-CD2 3.82Å; W337-Y351 HydrophobicContact CZ2-CD2 3.82Å; W337-Y351 AromaticContact CZ2-CG 3.77Å; W337-Y351 HydrophobicContact CZ2-CG 3.77Å; W337-Y351 AromaticContact NE1-CD1 3.41Å; W337-Y351 AromaticContact NE1-CD2 3.56Å; W337-Y351 AromaticContact NE1-CE1 3.44Å; W337-Y351 AromaticContact NE1-CE2 3.61Å; W337-Y351 AromaticContact NE1-CG 3.48Å; W337-Y351 AromaticContact NE1-CZ 3.56Å; P340-Y351 WeakPolarHBondContact CD-OH 3.4Å; P340-Y351 HydrophobicContact CG-CE1 4.35Å; L349-Y351 WeakPolarHBondContact CD2-OH 3.35Å; Y351-G382 PolarHBondContact O-N 3.05Å; Y351-G382 VanDerWaalsContact O-N 3.15Å; Y351-L383 VanDerWaalsContact CD2-O 3.25Å; Y351-L383 WeakPolarHBondContact CD2-O 3.22Å; Y351-L383 PolarHBondContact N-O 3.04Å; Y351-L383 PolarHBondContact O-N 2.93Å; Y351-L383 VanDerWaalsContact O-N 3.08Å; Y351-P386 HydrophobicContact CE2-CB 4.21Å; Y351-Q404 VanDerWaalsContact CA-O 3.26Å; Y351-Q404 WeakPolarHBondContact CA-O 3.44Å
352	R	95.8	Very high	85.8	Confident	111 Å²	111	52 Å²	52	42%	0.419	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	135.7	172	176.7	-174.7	-67.9	158.1	-3.2	108.7	A381 Q404	R352-A381 HydrophobicContact CB-CB 4.32Å; R352-A381 HydrophobicContact CG-CB 4.05Å; R352-Q404 HydrophobicContact CB-CB 4.37Å; R352-Q404 PolarHBondContact N-O 3.03Å; R352-Q404 PolarHBondContact O-N 3.24Å
353	L	94.6	Very high	83.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	129.6	173	-81.2	84.9	0	0	0	111.3	L335 W337 F376 Q380 L383 V388 F401 T402 I403	L335-L353 HydrophobicContact CD1-CD2 3.59Å; W337-L353 HydrophobicContact CH2-CD1 3.78Å; W337-L353 HydrophobicContact CZ2-CD1 4.38Å; W337-L353 HydrophobicContact CZ3-CD1 4.4Å; L353-F376 HydrophobicContact CB-CE1 4.31Å; L353-F376 HydrophobicContact CD2-CE1 4.47Å; L353-Q380 HydrophobicContact CB-CG 4.49Å; L353-Q380 PolarHBondContact N-O 3.23Å; L353-Q380 WeakPolarHBondContact O-CG 3.37Å; L353-Q380 PolarHBondContact O-NE2 3.11Å; L353-L383 HydrophobicContact CD1-CD1 3.42Å; L353-L383 VanDerWaalsContact CD1-CD1 3.42Å; L353-V388 HydrophobicContact CD1-CG1 4.1Å; L353-V388 HydrophobicContact CD2-CG1 3.65Å; L353-F401 HydrophobicContact CD2-CD1 4.4Å; L353-T402 WeakPolarHBondContact CA-O 3.42Å; L353-I403 HydrophobicContact CD1-CG2 4.49Å; L353-I403 HydrophobicContact CD2-CG1 4.28Å; L353-I403 HydrophobicContact CG-CG1 4.13Å
354	L	93.8	Very high	81.3	Confident	78 Å²	78	60.4 Å²	60.4	41%	0.408	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	131.3	164.8	-52.2	176	0	0	0	107.5	F401 T402	L354-F401 CarbonylContact O-C 3.55Å; L354-F401 WeakPolarHBondContact O-CA 3.09Å; L354-T402 PolarHBondContact N-O 3.42Å; L354-T402 PolarHBondContact O-N 3.39Å
355	C	91.2	Very high	79.7	Confident	12 Å²	12	63.5 Å²	63.5	8%	0.081	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	132.2	178.7	179.2	0	0	0	0	108.3	C370 F376 F401	C355-C370 HydrophobicContact CB-CB 3.62Å; C355-C370 WeakPolarHBondContact CB-SG 3.25Å; C355-C370 PolarHBondContact O-N 2.83Å; C355-C370 PolarHBondContact O-SG 2.82Å; C355-C370 VanDerWaalsContact O-SG 3.42Å; C355-C370 WeakPolarHBondContact SG-CB 3.17Å; C355-C370 CovalentContact SG-SG 2.03Å; C355-C370 PolarHBondContact SG-SG 3.32Å; C355-F376 HydrophobicContact CB-CE1 4.5Å; C355-F376 HydrophobicContact CB-CZ 3.73Å; C355-F401 HydrophobicContact CB-CD1 3.98Å; C355-F401 HydrophobicContact CB-CE1 3.86Å; C355-F401 WeakPolarHBondContact SG-CE1 3.37Å
356	S	91.4	Very high	78.6	Confident	18 Å²	18	64.9 Å²	64.9	13%	0.126	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143.1	170.1	57.7	0	0	0	0	111	S368 C370 Y399 M400	S356-S368 CarbonylContact C-O 3.59Å; S356-S368 WeakPolarHBondContact CA-O 3.39Å; S356-S368 WeakPolarHBondContact CB-O 3.35Å; S356-C370 VanDerWaalsContact C-SG 3.59Å; S356-C370 PolarHBondContact N-SG 3.19Å; S356-Y399 CarbonylContact O-C 3.4Å; S356-Y399 WeakPolarHBondContact O-CA 3.33Å; S356-M400 PolarHBondContact N-O 2.96Å; S356-M400 PolarHBondContact O-N 2.81Å; S356-M400 WeakPolarHBondContact OG-CE 3.39Å; S356-M400 PolarHBondContact OG-O 2.95Å
357	A	86.5	Confident	78	Confident	7 Å²	7	65.9 Å²	65.9	6%	0.058	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	128.5	176	0	0	0	0	0	109.1	C367 S368 T397 Y399	A357-C367 CarbonylContact O-C 3.43Å; A357-C367 VanDerWaalsContact O-CA 3.3Å; A357-C367 WeakPolarHBondContact O-CA 3.5Å; A357-S368 PolarHBondContact N-O 3.43Å; A357-S368 PolarHBondContact O-N 2.74Å; A357-T397 HydrophobicContact CB-CG2 4.26Å; A357-Y399 HydrophobicContact CB-CD1 4.01Å; A357-Y399 HydrophobicContact CB-CE1 3.86Å
358	C	82.9	Confident	77.7	Confident	14 Å²	14	65.6 Å²	65.6	10%	0.095	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	129.6	-179.1	-45.3	0	0	0	0	108.8	C367 R398	C358-C367 HydrophobicContact CB-CB 4.12Å; C358-C367 WeakPolarHBondContact CB-SG 3.07Å; C358-C367 WeakPolarHBondContact SG-CB 3.41Å; C358-C367 CovalentContact SG-SG 2.04Å; C358-C367 PolarHBondContact SG-SG 3.23Å; C358-R398 PolarHBondContact N-O 2.79Å
359	G	69.1	Low	77.4	Confident	62 Å²	62	67.9 Å²	67.9	64%	0.639	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-75.7	166.7	178.1	0	0	0	0	0	113.9
360	E	58.8	Low	76.9	Confident	184 Å²	184	68.6 Å²	68.6	86%	0.86	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-75.8	158.2	167	-81.2	-165.9	150.2	0	0	112.3
361	A	54.6	Low	76	Confident	113 Å²	113	71.3 Å²	71.3	93%	0.934	46%	0.463	S	S	*	.	S	Bend	trans	-70.5	130.5	-157.8	0	0	0	0	0	114.5
362	G	46.6	Very low	75	Confident	70 Å²	70	78.4 Å²	78.4	72%	0.722	50%	0.501	S	S	*	.	S	Bend	trans	-151.5	-55.7	168.8	0	0	0	0	0	111.9
363	L	47.8	Very low	73.8	Confident	167 Å²	167	75.6 Å²	75.6	87%	0.874	50%	0.498	S	S	*	.	S	Bend	trans	-138.6	143.3	168	-74	112.9	0	0	0	109.2	G365	L363-G365 PolarHBondContact O-N 3.17Å
364	V	46.8	Very low	73.1	Confident	144 Å²	144	76 Å²	76	87%	0.873	50%	0.501	S	S	*	.	S	Bend	trans	7.7	100.6	176.1	-172.3	0	0	0	0	114.8	S366	V364-S366 PolarHBondContact O-N 3.37Å
365	G	57.1	Low	72.5	Confident	69 Å²	69	77.7 Å²	77.7	71%	0.711	51%	0.509	S	S	*	.			trans	-61.3	91.5	-173.1	0	0	0	0	0	114.1	L363	L363-G365 PolarHBondContact O-N 3.17Å
366	S	68.1	Low	72.4	Confident	98 Å²	98	78.7 Å²	78.7	69%	0.685	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-79.4	123.2	167.5	56.9	0	0	0	0	109.4	V364	V364-S366 PolarHBondContact O-N 3.37Å
367	C	80.3	Confident	72.2	Confident	56 Å²	56	86.7 Å²	86.7	38%	0.378	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	118.1	168.2	-56.7	0	0	0	0	107.8	A357 C358	A357-C367 CarbonylContact O-C 3.43Å; A357-C367 VanDerWaalsContact O-CA 3.3Å; A357-C367 WeakPolarHBondContact O-CA 3.5Å; C358-C367 HydrophobicContact CB-CB 4.12Å; C358-C367 WeakPolarHBondContact CB-SG 3.07Å; C358-C367 WeakPolarHBondContact SG-CB 3.41Å; C358-C367 CovalentContact SG-SG 2.04Å; C358-C367 PolarHBondContact SG-SG 3.23Å
368	S	85.9	Confident	72.2	Confident	66 Å²	66	91.2 Å²	91.2	46%	0.462	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.7	155.7	174.2	56.7	0	0	0	0	110.6	S356 A357	S356-S368 CarbonylContact C-O 3.59Å; S356-S368 WeakPolarHBondContact CA-O 3.39Å; S356-S368 WeakPolarHBondContact CB-O 3.35Å; A357-S368 PolarHBondContact N-O 3.43Å; A357-S368 PolarHBondContact O-N 2.74Å
369	P	87.9	Confident	72.7	Confident	113 Å²	113	92.6 Å²	92.6	73%	0.734	58%	0.578	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-52.2	144.7	169.8	-25.4	35.1	0	0	0	111.5
370	C	84.6	Confident	73.8	Confident	29 Å²	29	93.9 Å²	93.9	20%	0.196	57%	0.568	C	S	.	*	P	Polyproline II helix	trans	-62.9	143.6	175	-66.5	0	0	0	0	111.4	C355 S356 V374	C355-C370 HydrophobicContact CB-CB 3.62Å; C355-C370 WeakPolarHBondContact CB-SG 3.25Å; C355-C370 PolarHBondContact O-N 2.83Å; C355-C370 PolarHBondContact O-SG 2.82Å; C355-C370 VanDerWaalsContact O-SG 3.42Å; C355-C370 WeakPolarHBondContact SG-CB 3.17Å; C355-C370 CovalentContact SG-SG 2.03Å; C355-C370 PolarHBondContact SG-SG 3.32Å; S356-C370 VanDerWaalsContact C-SG 3.59Å; S356-C370 PolarHBondContact N-SG 3.19Å; C370-V374 HydrophobicContact CB-CB 4.28Å; C370-V374 HydrophobicContact CB-CG2 4.08Å
371	D	77	Confident	75.4	Confident	85 Å²	85	87.4 Å²	87.4	46%	0.455	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-74.7	157.9	177.4	171	46.5	0	0	0	111.5	S373 V374 R394	D371-S373 PolarHBondContact O-N 2.82Å; D371-S373 WeakPolarHBondContact OD2-CB 2.94Å; D371-S373 PolarHBondContact OD2-OG 3.4Å; D371-V374 PolarHBondContact O-N 3.38Å; D371-R394 IonicContact OD2-NH1 3.79Å
372	D	74.1	Confident	77.2	Confident	151 Å²	151	84.4 Å²	84.4	81%	0.807	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-13.4	-176.1	-70.5	-27.1	0	0	0	113.4	V374	D372-V374 PolarHBondContact O-N 2.74Å
373	S	70.1	Confident	79.5	Confident	52 Å²	52	81.3 Å²	81.3	36%	0.364	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-20.2	168.5	51.9	0	0	0	0	113.9	D371 G392	D371-S373 PolarHBondContact O-N 2.82Å; D371-S373 WeakPolarHBondContact OD2-CB 2.94Å; D371-S373 PolarHBondContact OD2-OG 3.4Å; S373-G392 WeakPolarHBondContact O-CA 3.33Å
374	V	81.3	Confident	81.7	Confident	9 Å²	9	78.5 Å²	78.5	6%	0.055	48%	0.483	C	S	.	.			trans	-90	109.8	179.3	-176.9	0	0	0	0	111.3	C370 D371 D372 F376 V390 W391 L393 Y399	C370-V374 HydrophobicContact CB-CB 4.28Å; C370-V374 HydrophobicContact CB-CG2 4.08Å; D371-V374 PolarHBondContact O-N 3.38Å; D372-V374 PolarHBondContact O-N 2.74Å; V374-F376 HydrophobicContact CG1-CE2 4.04Å; V374-F376 HydrophobicContact CG1-CZ 4.01Å; V374-V390 HydrophobicContact CG1-CG1 3.4Å; V374-V390 VanDerWaalsContact CG1-CG1 3.4Å; V374-W391 WeakPolarHBondContact CA-O 3.34Å; V374-L393 HydrophobicContact CG1-CD2 4.1Å; V374-L393 HydrophobicContact CG2-CD2 4.4Å; V374-Y399 HydrophobicContact CG2-CE1 4.17Å
375	L	81.4	Confident	83.9	Confident	112 Å²	112	81 Å²	81	59%	0.586	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.3	-173.5	-63.8	174.1	0	0	0	112.6	V390 W391	L375-V390 CarbonylContact O-C 3.6Å; L375-V390 WeakPolarHBondContact O-CA 3.23Å; L375-W391 HydrophobicContact CB-CB 4.42Å; L375-W391 PolarHBondContact N-O 3.03Å; L375-W391 PolarHBondContact O-N 2.87Å
376	F	88.4	Confident	85.6	Confident	33 Å²	33	79.7 Å²	79.7	15%	0.145	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129.6	179.8	-59.6	-96	0	0	0	111.6	L353 C355 V374 Q380 V388 V390 F401	L353-F376 HydrophobicContact CB-CE1 4.31Å; L353-F376 HydrophobicContact CD2-CE1 4.47Å; C355-F376 HydrophobicContact CB-CE1 4.5Å; C355-F376 HydrophobicContact CB-CZ 3.73Å; V374-F376 HydrophobicContact CG1-CE2 4.04Å; V374-F376 HydrophobicContact CG1-CZ 4.01Å; F376-Q380 HydrophobicContact CB-CB 4Å; F376-Q380 HydrophobicContact CD1-CB 4.38Å; F376-Q380 HydrophobicContact CD1-CG 4.22Å; F376-Q380 HydrophobicContact CD2-CB 3.77Å; F376-Q380 HydrophobicContact CD2-CG 3.84Å; F376-Q380 HydrophobicContact CE1-CG 4.33Å; F376-Q380 HydrophobicContact CE2-CB 4.39Å; F376-Q380 HydrophobicContact CE2-CG 3.96Å; F376-Q380 HydrophobicContact CG-CB 3.79Å; F376-Q380 HydrophobicContact CG-CG 4Å; F376-Q380 HydrophobicContact CZ-CG 4.22Å; F376-V388 HydrophobicContact CB-CG2 4.26Å; F376-V388 HydrophobicContact CD1-CG2 4.43Å; F376-V390 HydrophobicContact CD1-CG1 4.42Å; F376-V390 HydrophobicContact CD1-CG2 3.82Å; F376-V390 HydrophobicContact CE1-CG1 4.17Å; F376-V390 HydrophobicContact CE1-CG2 3.88Å; F376-V390 HydrophobicContact CZ-CG1 4.47Å; F376-F401 HydrophobicContact CE1-CD1 4.37Å; F376-F401 HydrophobicContact CE1-CE1 4.08Å; F376-F401 HydrophobicContact CZ-CE1 4.34Å
377	R	86.3	Confident	86.8	Confident	187 Å²	187	80.8 Å²	80.8	71%	0.706	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.8	124.9	176.1	-167.3	173.7	-177.5	155.3	1.8	110.9	V388 T389	R377-V388 VanDerWaalsContact O-CG2 3.3Å; R377-V388 WeakPolarHBondContact O-CG2 3.33Å; R377-T389 PolarHBondContact N-O 2.82Å; R377-T389 PolarHBondContact O-N 2.9Å
378	P	88.4	Confident	87.5	Confident	102 Å²	102	78.2 Å²	78.2	66%	0.662	43%	0.427	S	S	*	.	S	Bend	cis	-77.8	-28.1	9.8	30.8	-35.5	0	0	0	115.3	L383	P378-L383 HydrophobicContact CG-CD2 3.66Å
379	S	91.8	Very high	87.7	Confident	42 Å²	42	76.4 Å²	76.4	29%	0.294	41%	0.413	S	S	.	.			trans	-158.4	170.2	178.5	60.8	0	0	0	0	110.6	A381 L383	S379-A381 WeakPolarHBondContact CB-O 3.11Å; S379-A381 PolarHBondContact OG-O 3.24Å; S379-L383 WeakPolarHBondContact O-CD2 3.44Å
380	Q	92.1	Very high	87.7	Confident	89 Å²	89	71 Å²	71	42%	0.416	38%	0.378	S	S	.	.	S	Bend	trans	-86.8	-26.2	173.1	-171.9	178.4	-2.6	0	0	113	L353 F376	L353-Q380 HydrophobicContact CB-CG 4.49Å; L353-Q380 PolarHBondContact N-O 3.23Å; L353-Q380 WeakPolarHBondContact O-CG 3.37Å; L353-Q380 PolarHBondContact O-NE2 3.11Å; F376-Q380 HydrophobicContact CB-CB 4Å; F376-Q380 HydrophobicContact CD1-CB 4.38Å; F376-Q380 HydrophobicContact CD1-CG 4.22Å; F376-Q380 HydrophobicContact CD2-CB 3.77Å; F376-Q380 HydrophobicContact CD2-CG 3.84Å; F376-Q380 HydrophobicContact CE1-CG 4.33Å; F376-Q380 HydrophobicContact CE2-CB 4.39Å; F376-Q380 HydrophobicContact CE2-CG 3.96Å; F376-Q380 HydrophobicContact CG-CB 3.79Å; F376-Q380 HydrophobicContact CG-CG 4Å; F376-Q380 HydrophobicContact CZ-CG 4.22Å
381	A	93.7	Very high	87.5	Confident	48 Å²	48	75.3 Å²	75.3	40%	0.397	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	162	-179	0	0	0	0	0	111.1	R352 S379 L383	R352-A381 HydrophobicContact CB-CB 4.32Å; R352-A381 HydrophobicContact CG-CB 4.05Å; S379-A381 WeakPolarHBondContact CB-O 3.11Å; S379-A381 PolarHBondContact OG-O 3.24Å; A381-L383 VanDerWaalsContact C-N 3.27Å; A381-L383 PolarHBondContact O-N 3.05Å
382	G	92.3	Very high	87.4	Confident	51 Å²	51	73 Å²	73	53%	0.526	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	71.4	22.5	-176.7	0	0	0	0	0	113.2	Y351 T384	Y351-G382 PolarHBondContact O-N 3.05Å; Y351-G382 VanDerWaalsContact O-N 3.15Å; G382-T384 PolarHBondContact O-N 2.93Å
383	L	94.1	Very high	87.7	Confident	4 Å²	4	66.3 Å²	66.3	2%	0.021	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	117.4	-179.1	-72.1	164.2	0	0	0	109.9	W337 S350 Y351 L353 P378 S379 A381 V388	W337-L383 HydrophobicContact CH2-CD1 4.26Å; S350-L383 CarbonylContact C-O 3.59Å; S350-L383 VanDerWaalsContact CA-O 3.24Å; S350-L383 WeakPolarHBondContact CA-O 3.23Å; Y351-L383 VanDerWaalsContact CD2-O 3.25Å; Y351-L383 WeakPolarHBondContact CD2-O 3.22Å; Y351-L383 PolarHBondContact N-O 3.04Å; Y351-L383 PolarHBondContact O-N 2.93Å; Y351-L383 VanDerWaalsContact O-N 3.08Å; L353-L383 HydrophobicContact CD1-CD1 3.42Å; L353-L383 VanDerWaalsContact CD1-CD1 3.42Å; P378-L383 HydrophobicContact CG-CD2 3.66Å; S379-L383 WeakPolarHBondContact O-CD2 3.44Å; A381-L383 VanDerWaalsContact C-N 3.27Å; A381-L383 PolarHBondContact O-N 3.05Å; L383-V388 HydrophobicContact CD1-CB 4.17Å; L383-V388 HydrophobicContact CD1-CG2 4.27Å; L383-V388 HydrophobicContact CD2-CG2 4.46Å
384	T	93.3	Very high	87.8	Confident	108 Å²	108	68.6 Å²	68.6	66%	0.663	35%	0.351	S	S	*	.			trans	-91.9	-13.3	177.2	53.9	0	0	0	0	113.5	G382	G382-T384 PolarHBondContact O-N 2.93Å
385	R	93.2	Very high	87.4	Confident	197 Å²	197	72.5 Å²	72.5	74%	0.743	38%	0.377	S	S	*	.	S	Bend	trans	-109.5	143.8	175.1	-63.1	-176.3	-176.6	-179.9	0.9	109.5	R387	R385-R387 PolarHBondContact O-N 2.85Å
386	P	93.9	Very high	87	Confident	41 Å²	41	72.1 Å²	72.1	27%	0.266	37%	0.372	S	S	.	.	S	Bend	trans	-83.1	49.1	-177.1	37.5	-38.6	0	0	0	112.2	E336 W337 Y351	E336-P386 WeakPolarHBondContact CA-O 3.21Å; W337-P386 VanDerWaalsContact CD1-CB 3.48Å; W337-P386 HydrophobicContact CD2-CB 4.06Å; W337-P386 HydrophobicContact CG-CB 3.91Å; W337-P386 HydrophobicContact CZ2-CB 4.47Å; W337-P386 PolarHBondContact N-O 3.21Å; W337-P386 VanDerWaalsContact O-CB 3.31Å; W337-P386 WeakPolarHBondContact O-CB 3.38Å; Y351-P386 HydrophobicContact CE2-CB 4.21Å
387	R	93.9	Very high	86.4	Confident	122 Å²	122	71.9 Å²	71.9	46%	0.46	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	134.1	-179.1	178.9	177.9	-178.4	148.7	-6.6	110.7	I334 L335 E336 R385	I334-R387 HydrophobicContact CG2-CG 4.47Å; L335-R387 CarbonylContact O-C 3.59Å; L335-R387 VanDerWaalsContact O-CA 3.3Å; L335-R387 WeakPolarHBondContact O-CA 3.49Å; E336-R387 HydrophobicContact CG-CB 4.05Å; E336-R387 HydrophobicContact CG-CG 3.75Å; E336-R387 WeakPolarHBondContact OE1-CD 3.36Å; E336-R387 IonicContact OE1-CZ 3.16Å; E336-R387 IonicContact OE1-NE 3.31Å; E336-R387 PolarHBondContact OE1-NE 2.67Å; E336-R387 IonicContact OE1-NH1 3.6Å; E336-R387 PolarHBondContact OE1-NH1 2.86Å; R385-R387 PolarHBondContact O-N 2.85Å
388	V	93.9	Very high	86.3	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.006	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	149.3	170.4	70.6	0	0	0	0	110.3	L335 W337 L353 F376 R377 L383 V390	L335-V388 HydrophobicContact CB-CG1 4.01Å; L335-V388 HydrophobicContact CD1-CG1 4.42Å; L335-V388 PolarHBondContact N-O 3.17Å; L335-V388 PolarHBondContact O-N 2.79Å; W337-V388 HydrophobicContact CH2-CB 4.36Å; W337-V388 HydrophobicContact CH2-CG1 4.12Å; W337-V388 HydrophobicContact CZ3-CG1 4Å; L353-V388 HydrophobicContact CD1-CG1 4.1Å; L353-V388 HydrophobicContact CD2-CG1 3.65Å; F376-V388 HydrophobicContact CB-CG2 4.26Å; F376-V388 HydrophobicContact CD1-CG2 4.43Å; R377-V388 VanDerWaalsContact O-CG2 3.3Å; R377-V388 WeakPolarHBondContact O-CG2 3.33Å; L383-V388 HydrophobicContact CD1-CB 4.17Å; L383-V388 HydrophobicContact CD1-CG2 4.27Å; L383-V388 HydrophobicContact CD2-CG2 4.46Å; V388-V390 HydrophobicContact CG1-CG2 4.32Å
389	T	89.6	Confident	86.3	Confident	29 Å²	29	64 Å²	64	18%	0.178	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.7	170.5	-43.4	0	0	0	0	109.4	L333 I334 R377 W391	L333-T389 CarbonylContact O-C 3.57Å; L333-T389 WeakPolarHBondContact O-CA 3.24Å; I334-T389 HydrophobicContact CG1-CG2 3.96Å; R377-T389 PolarHBondContact N-O 2.82Å; R377-T389 PolarHBondContact O-N 2.9Å; T389-W391 HydrophobicContact CG2-CZ2 4.03Å
390	V	88.3	Confident	86.3	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.2	-179	-170.6	0	0	0	0	108.9	S332 L333 L335 V374 L375 F376 V388 L393 F401	S332-V390 CarbonylContact C-O 3.57Å; S332-V390 WeakPolarHBondContact CA-O 3.48Å; L333-V390 HydrophobicContact CB-CB 4.31Å; L333-V390 PolarHBondContact N-O 2.81Å; L333-V390 PolarHBondContact O-N 3.38Å; L335-V390 HydrophobicContact CD1-CG2 4.37Å; V374-V390 HydrophobicContact CG1-CG1 3.4Å; V374-V390 VanDerWaalsContact CG1-CG1 3.4Å; L375-V390 CarbonylContact O-C 3.6Å; L375-V390 WeakPolarHBondContact O-CA 3.23Å; F376-V390 HydrophobicContact CD1-CG1 4.42Å; F376-V390 HydrophobicContact CD1-CG2 3.82Å; F376-V390 HydrophobicContact CE1-CG1 4.17Å; F376-V390 HydrophobicContact CE1-CG2 3.88Å; F376-V390 HydrophobicContact CZ-CG1 4.47Å; V388-V390 HydrophobicContact CG1-CG2 4.32Å; V390-L393 HydrophobicContact CG1-CD2 4Å; V390-F401 HydrophobicContact CG1-CE1 4Å; V390-F401 HydrophobicContact CG1-CZ 4.09Å; V390-F401 HydrophobicContact CG2-CE1 4.11Å
391	W	81.5	Confident	86.3	Confident	119 Å²	119	60.3 Å²	60.3	45%	0.451	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	164.7	-178.6	-61.9	82.5	0	0	0	110.7	V374 L375 T389	V374-W391 WeakPolarHBondContact CA-O 3.34Å; L375-W391 HydrophobicContact CB-CB 4.42Å; L375-W391 PolarHBondContact N-O 3.03Å; L375-W391 PolarHBondContact O-N 2.87Å; T389-W391 HydrophobicContact CG2-CZ2 4.03Å
392	G	74.7	Confident	86.4	Confident	35 Å²	35	59 Å²	59	36%	0.361	30%	0.296	S	S	.	.			trans	79.3	20.1	174.4	0	0	0	0	0	114.2	S373 R394	S373-G392 WeakPolarHBondContact O-CA 3.33Å; G392-R394 PolarHBondContact O-N 2.97Å
393	L	79.5	Confident	86.5	Confident	11 Å²	11	56.6 Å²	56.6	6%	0.058	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-66.1	128.8	174.5	-56.8	-177.1	0	0	0	110.1	L328 L333 V374 V390 Y399 F401	L328-L393 HydrophobicContact CD1-CD1 4.34Å; L333-L393 HydrophobicContact CB-CD1 3.67Å; L333-L393 HydrophobicContact CD2-CD1 4.21Å; V374-L393 HydrophobicContact CG1-CD2 4.1Å; V374-L393 HydrophobicContact CG2-CD2 4.4Å; V390-L393 HydrophobicContact CG1-CD2 4Å; L393-Y399 HydrophobicContact CB-CE2 3.94Å; L393-Y399 HydrophobicContact CD2-CD1 4.34Å; L393-Y399 HydrophobicContact CD2-CD2 4.08Å; L393-Y399 HydrophobicContact CD2-CE1 4.2Å; L393-Y399 HydrophobicContact CD2-CE2 3.93Å; L393-Y399 HydrophobicContact CD2-CG 4.27Å; L393-Y399 HydrophobicContact CG-CE2 4.45Å; L393-F401 HydrophobicContact CD2-CZ 4.06Å
394	R	73.3	Confident	86.6	Confident	101 Å²	101	57.3 Å²	57.3	38%	0.381	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-66.4	139.6	173.8	-69.2	-174	-70.8	-101.2	6.5	109.8	D371 G392 T397 Y399 S426	D371-R394 IonicContact OD2-NH1 3.79Å; G392-R394 PolarHBondContact O-N 2.97Å; R394-T397 WeakPolarHBondContact CB-OG1 3.38Å; R394-Y399 PolarHBondContact N-OH 2.85Å; R394-S426 WeakPolarHBondContact O-CB 3.04Å; R394-S426 PolarHBondContact O-OG 2.89Å
395	P	71.4	Confident	86.8	Confident	91 Å²	91	52.1 Å²	52.1	59%	0.591	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	152.4	173	-24.7	34.8	0	0	0	112.5	T397 S426	P395-T397 PolarHBondContact O-N 2.98Å; P395-T397 PolarHBondContact O-OG1 3.05Å; P395-T397 VanDerWaalsContact O-OG1 3.14Å; P395-S426 VanDerWaalsContact C-OG 3.24Å; P395-S426 WeakPolarHBondContact CA-OG 3.4Å
396	Q	72.6	Confident	86.9	Confident	103 Å²	103	43.7 Å²	43.7	48%	0.481	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	26.2	177.3	-53.2	-164.6	-103.1	0	0	115.4	S426 R428	Q396-S426 PolarHBondContact N-O 3.24Å; Q396-S426 PolarHBondContact N-OG 3.11Å; Q396-R428 VanDerWaalsContact CD-NE 3.26Å; Q396-R428 HydrophobicContact CG-CG 4.38Å; Q396-R428 VanDerWaalsContact OE1-CZ 3.23Å
397	T	76.2	Confident	86.9	Confident	28 Å²	28	42.2 Å²	42.2	17%	0.172	20%	0.203	C	C	.	.			trans	-110.2	133.1	-179.2	-58.9	0	0	0	0	109.5	A357 R394 P395 Y399 S426	A357-T397 HydrophobicContact CB-CG2 4.26Å; R394-T397 WeakPolarHBondContact CB-OG1 3.38Å; P395-T397 PolarHBondContact O-N 2.98Å; P395-T397 PolarHBondContact O-OG1 3.05Å; P395-T397 VanDerWaalsContact O-OG1 3.14Å; T397-Y399 HydrophobicContact CG2-CD2 4.06Å; T397-Y399 HydrophobicContact CG2-CE1 4.39Å; T397-Y399 HydrophobicContact CG2-CE2 3.58Å; T397-Y399 WeakPolarHBondContact O-CD2 3.4Å; T397-S426 PolarHBondContact N-OG 2.81Å
398	R	85.4	Confident	86.8	Confident	123 Å²	123	37.9 Å²	37.9	46%	0.464	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	123.3	173.3	-179.5	177.8	176.5	163.1	0.2	109.4	C358 N423 V424	C358-R398 PolarHBondContact N-O 2.79Å; R398-N423 PolarHBondContact NH2-ND2 2.86Å; R398-N423 VanDerWaalsContact NH2-ND2 3.16Å; R398-V424 WeakPolarHBondContact CA-O 3.41Å
399	Y	87.2	Confident	86.9	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.008	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	137.7	176.1	-70.4	-87.8	0	0	0	110.3	S356 A357 V374 L393 R394 T397 F401 N423 V424	S356-Y399 CarbonylContact O-C 3.4Å; S356-Y399 WeakPolarHBondContact O-CA 3.33Å; A357-Y399 HydrophobicContact CB-CD1 4.01Å; A357-Y399 HydrophobicContact CB-CE1 3.86Å; V374-Y399 HydrophobicContact CG2-CE1 4.17Å; L393-Y399 HydrophobicContact CB-CE2 3.94Å; L393-Y399 HydrophobicContact CD2-CD1 4.34Å; L393-Y399 HydrophobicContact CD2-CD2 4.08Å; L393-Y399 HydrophobicContact CD2-CE1 4.2Å; L393-Y399 HydrophobicContact CD2-CE2 3.93Å; L393-Y399 HydrophobicContact CD2-CG 4.27Å; L393-Y399 HydrophobicContact CG-CE2 4.45Å; R394-Y399 PolarHBondContact N-OH 2.85Å; T397-Y399 HydrophobicContact CG2-CD2 4.06Å; T397-Y399 HydrophobicContact CG2-CE1 4.39Å; T397-Y399 HydrophobicContact CG2-CE2 3.58Å; T397-Y399 WeakPolarHBondContact O-CD2 3.4Å; Y399-F401 VanDerWaalsContact CB-CE2 3.5Å; Y399-F401 HydrophobicContact CG-CE2 4.35Å; Y399-F401 HydrophobicContact CG-CZ 4.46Å; Y399-N423 CarbonylContact O-C 3.58Å; Y399-N423 WeakPolarHBondContact O-CA 3.5Å; Y399-V424 PolarHBondContact N-O 3.41Å; Y399-V424 PolarHBondContact O-N 2.72Å
400	M	91.3	Very high	87.1	Confident	53 Å²	53	37.1 Å²	37.1	26%	0.261	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	121.5	168.7	-177.8	177.3	67	0	0	109	S356 I422 N423	S356-M400 PolarHBondContact N-O 2.96Å; S356-M400 PolarHBondContact O-N 2.81Å; S356-M400 WeakPolarHBondContact OG-CE 3.39Å; S356-M400 PolarHBondContact OG-O 2.95Å; M400-I422 WeakPolarHBondContact CA-O 3.44Å; M400-N423 WeakPolarHBondContact CB-OD1 3.29Å
401	F	93.1	Very high	87.1	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.1	175.8	-66.2	-86.9	0	0	0	109.6	L333 L335 L353 L354 C355 F376 V390 L393 Y399 S421 I422 V424	L333-F401 HydrophobicContact CD2-CD2 3.81Å; L333-F401 HydrophobicContact CD2-CE2 3.27Å; L333-F401 HydrophobicContact CD2-CZ 3.74Å; L335-F401 HydrophobicContact CD1-CB 3.8Å; L335-F401 HydrophobicContact CD1-CD1 3.92Å; L335-F401 HydrophobicContact CD1-CD2 4.19Å; L335-F401 HydrophobicContact CD1-CG 3.7Å; L353-F401 HydrophobicContact CD2-CD1 4.4Å; L354-F401 CarbonylContact O-C 3.55Å; L354-F401 WeakPolarHBondContact O-CA 3.09Å; C355-F401 HydrophobicContact CB-CD1 3.98Å; C355-F401 HydrophobicContact CB-CE1 3.86Å; C355-F401 WeakPolarHBondContact SG-CE1 3.37Å; F376-F401 HydrophobicContact CE1-CD1 4.37Å; F376-F401 HydrophobicContact CE1-CE1 4.08Å; F376-F401 HydrophobicContact CZ-CE1 4.34Å; V390-F401 HydrophobicContact CG1-CE1 4Å; V390-F401 HydrophobicContact CG1-CZ 4.09Å; V390-F401 HydrophobicContact CG2-CE1 4.11Å; L393-F401 HydrophobicContact CD2-CZ 4.06Å; Y399-F401 VanDerWaalsContact CB-CE2 3.5Å; Y399-F401 HydrophobicContact CG-CE2 4.35Å; Y399-F401 HydrophobicContact CG-CZ 4.46Å; F401-S421 CarbonylContact O-C 3.56Å; F401-S421 VanDerWaalsContact O-CA 3.28Å; F401-S421 WeakPolarHBondContact O-CA 3.06Å; F401-I422 HydrophobicContact CB-CG2 4.07Å; F401-I422 PolarHBondContact N-O 2.86Å; F401-I422 PolarHBondContact O-N 2.78Å; F401-V424 HydrophobicContact CD2-CG2 4.45Å
402	T	94.8	Very high	87.6	Confident	20 Å²	20	39.7 Å²	39.7	12%	0.123	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	116.2	175	-59.5	0	0	0	0	109.2	L353 L354 V420 S421	L353-T402 WeakPolarHBondContact CA-O 3.42Å; L354-T402 PolarHBondContact N-O 3.42Å; L354-T402 PolarHBondContact O-N 3.39Å; T402-V420 WeakPolarHBondContact CA-O 3.35Å; T402-S421 PolarHBondContact OG1-OG 3.49Å
403	I	95.8	Very high	88.3	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	109.6	-179.3	-52	163.5	0	0	0	107.3	P321 P324 W337 L353 S419 V420	P321-I403 HydrophobicContact CB-CG2 4.42Å; P321-I403 HydrophobicContact CG-CB 4.45Å; P321-I403 HydrophobicContact CG-CG2 3.92Å; P324-I403 HydrophobicContact CB-CD1 3.95Å; W337-I403 HydrophobicContact CB-CD1 4.48Å; W337-I403 HydrophobicContact CD2-CD1 3.99Å; W337-I403 HydrophobicContact CD2-CG2 4.01Å; W337-I403 HydrophobicContact CE3-CD1 3.68Å; W337-I403 HydrophobicContact CE3-CG2 4.43Å; W337-I403 HydrophobicContact CG-CD1 4.37Å; W337-I403 HydrophobicContact CG-CG2 4.46Å; W337-I403 HydrophobicContact CH2-CG2 4.47Å; W337-I403 HydrophobicContact CZ2-CG2 4.01Å; W337-I403 HydrophobicContact CZ3-CD1 4.26Å; L353-I403 HydrophobicContact CD1-CG2 4.49Å; L353-I403 HydrophobicContact CD2-CG1 4.28Å; L353-I403 HydrophobicContact CG-CG1 4.13Å; I403-S419 WeakPolarHBondContact O-CA 3.34Å; I403-S419 WeakPolarHBondContact O-CB 3.42Å; I403-V420 HydrophobicContact CB-CG1 4.27Å; I403-V420 HydrophobicContact CD1-CG1 4.49Å; I403-V420 PolarHBondContact N-O 3.5Å; I403-V420 PolarHBondContact O-N 2.82Å
404	Q	96.4	Very high	88.6	Confident	19 Å²	19	47.7 Å²	47.7	9%	0.089	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	136.6	173	-73.4	179.1	-37.3	0	0	110.4	Y351 R352 P417	Y351-Q404 VanDerWaalsContact CA-O 3.26Å; Y351-Q404 WeakPolarHBondContact CA-O 3.44Å; R352-Q404 HydrophobicContact CB-CB 4.37Å; R352-Q404 PolarHBondContact N-O 3.03Å; R352-Q404 PolarHBondContact O-N 3.24Å; Q404-P417 HydrophobicContact CB-CB 4.26Å; Q404-P417 HydrophobicContact CG-CB 4.21Å
405	S	96	Very high	89.3	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130.2	164.3	47.5	0	0	0	0	109.9	P318 S319 A418	P318-S405 WeakPolarHBondContact CG-O 3.34Å; S319-S405 PolarHBondContact O-OG 3.49Å; S405-A418 PolarHBondContact N-O 2.94Å; S405-A418 PolarHBondContact OG-O 3.01Å; S405-A418 VanDerWaalsContact OG-O 3.04Å
406	V	95.6	Very high	90.1	Very high	19 Å²	19	49.3 Å²	49.3	12%	0.115	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	148.9	-179.8	-69.3	0	0	0	0	111.1	S350 P417	S350-V406 PolarHBondContact N-O 3.16Å; S350-V406 WeakPolarHBondContact O-CG2 3.28Å; S350-V406 PolarHBondContact O-N 2.86Å; V406-P417 HydrophobicContact CG1-CB 3.88Å; V406-P417 HydrophobicContact CG1-CG 4.13Å
407	N	94.7	Very high	91	Very high	11 Å²	11	45.4 Å²	45.4	6%	0.059	26%	0.255	C	S	.	.			trans	-136.8	179.4	174.1	70.6	4.5	0	0	0	109.6	R316 R343 D348 V409 S410	R316-N407 PolarHBondContact O-ND2 2.99Å; R343-N407 PolarHBondContact O-ND2 3.35Å; R343-N407 VanDerWaalsContact O-ND2 3.15Å; D348-N407 WeakPolarHBondContact OD1-CB 3.23Å; N407-V409 PolarHBondContact O-N 3.01Å; N407-V409 VanDerWaalsContact O-N 3.09Å; N407-V409 WeakPolarHBondContact OD1-CG2 3.13Å; N407-V409 PolarHBondContact OD1-N 3.14Å; N407-S410 PolarHBondContact N-OG 2.85Å; N407-S410 WeakPolarHBondContact O-CB 3.44Å; N407-S410 PolarHBondContact O-N 3.47Å; N407-S410 PolarHBondContact O-OG 2.83Å; N407-S410 PolarHBondContact OD1-N 2.85Å; N407-S410 PolarHBondContact OD1-OG 2.77Å
408	G	92.5	Very high	91.9	Very high	30 Å²	30	45.6 Å²	45.6	31%	0.309	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-55.3	-31.1	-174	0	0	0	0	0	115.4	D348	D348-G408 PolarHBondContact OD1-N 2.79Å; D348-G408 WeakPolarHBondContact OD2-CA 3.45Å; D348-G408 PolarHBondContact OD2-N 2.91Å; D348-G408 VanDerWaalsContact OD2-N 3.14Å
409	V	94.6	Very high	92.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-88	-12	178.6	-63.9	0	0	0	0	114.3	D303 A305 T315 R316 N407 A411 V412 S413	D303-V409 HydrophobicContact CB-CB 4.09Å; D303-V409 HydrophobicContact CB-CG1 4.19Å; A305-V409 HydrophobicContact CB-CG1 4.39Å; T315-V409 WeakPolarHBondContact OG1-CG1 2.98Å; R316-V409 VanDerWaalsContact C-CG2 3.44Å; R316-V409 WeakPolarHBondContact O-CG2 3.01Å; N407-V409 PolarHBondContact O-N 3.01Å; N407-V409 VanDerWaalsContact O-N 3.09Å; N407-V409 WeakPolarHBondContact OD1-CG2 3.13Å; N407-V409 PolarHBondContact OD1-N 3.14Å; V409-A411 PolarHBondContact O-N 3Å; V409-V412 PolarHBondContact O-N 3.23Å; V409-S413 WeakPolarHBondContact O-CB 3.36Å; V409-S413 PolarHBondContact O-N 3.22Å
410	S	93.6	Very high	92.7	Very high	14 Å²	14	44 Å²	44	10%	0.098	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-65.8	-11.2	-177.8	-57.7	0	0	0	0	114.1	P318 N407	P318-S410 WeakPolarHBondContact CD-OG 3.43Å; N407-S410 PolarHBondContact N-OG 2.85Å; N407-S410 WeakPolarHBondContact O-CB 3.44Å; N407-S410 PolarHBondContact O-N 3.47Å; N407-S410 PolarHBondContact O-OG 2.83Å; N407-S410 PolarHBondContact OD1-N 2.85Å; N407-S410 PolarHBondContact OD1-OG 2.77Å
411	A	89.9	Confident	92.8	Very high	98 Å²	98	44.3 Å²	44.3	81%	0.81	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-93.1	-20.5	174.3	0	0	0	0	0	113.8	V409	V409-A411 PolarHBondContact O-N 3Å
412	V	91.5	Very high	92.7	Very high	75 Å²	75	45.5 Å²	45.5	46%	0.455	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-28	-179.2	-174.6	0	0	0	0	110.9	V409	V409-V412 PolarHBondContact O-N 3.23Å
413	S	89.6	Confident	92.5	Very high	21 Å²	21	48.3 Å²	48.3	15%	0.147	29%	0.293	C	S	.	.	S	Bend	trans	-67.9	148.5	-178.7	-148.8	0	0	0	0	113	D303 P317 V409 S415	D303-S413 WeakPolarHBondContact OD2-CA 3.42Å; D303-S413 WeakPolarHBondContact OD2-CB 3.34Å; D303-S413 PolarHBondContact OD2-OG 3.02Å; P317-S413 VanDerWaalsContact CG-CB 3.46Å; P317-S413 WeakPolarHBondContact CG-OG 3.35Å; V409-S413 WeakPolarHBondContact O-CB 3.36Å; V409-S413 PolarHBondContact O-N 3.22Å; S413-S415 VanDerWaalsContact C-N 3.29Å; S413-S415 PolarHBondContact O-N 3.44Å
414	Q	86.4	Confident	92	Very high	193 Å²	193	49 Å²	49	90%	0.902	30%	0.297	S	S	*	.	S	Bend	trans	-81	-6	-177.8	-61.4	178.3	3.8	0	0	113.7
415	S	86.5	Confident	91.3	Very high	62 Å²	62	52.1 Å²	52.1	43%	0.434	32%	0.318	S	S	.	.	S	Bend	trans	-96.6	134.6	178.8	61.9	0	0	0	0	112.2	S413	S413-S415 VanDerWaalsContact C-N 3.29Å; S413-S415 PolarHBondContact O-N 3.44Å
416	E	88.5	Confident	90.2	Very high	164 Å²	164	52.8 Å²	52.8	77%	0.766	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-53.3	141.8	171.2	-77	-67.2	163.7	0	0	112.7	A418	E416-A418 PolarHBondContact O-N 3.34Å
417	P	92.5	Very high	88.7	Confident	21 Å²	21	55 Å²	55	14%	0.136	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-59.1	126.3	179.7	-25.8	35.3	0	0	0	113	Q404 V406 S419	Q404-P417 HydrophobicContact CB-CB 4.26Å; Q404-P417 HydrophobicContact CG-CB 4.21Å; V406-P417 HydrophobicContact CG1-CB 3.88Å; V406-P417 HydrophobicContact CG1-CG 4.13Å; P417-S419 PolarHBondContact O-N 2.83Å
418	A	94.2	Very high	86.9	Confident	32 Å²	32	62.8 Å²	62.8	26%	0.264	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-58.8	137	178	0	0	0	0	0	111.1	P318 A320 S405 E416	P318-A418 VanDerWaalsContact O-CB 3.27Å; P318-A418 WeakPolarHBondContact O-CB 3.29Å; A320-A418 HydrophobicContact CB-CB 4.04Å; S405-A418 PolarHBondContact N-O 2.94Å; S405-A418 PolarHBondContact OG-O 3.01Å; S405-A418 VanDerWaalsContact OG-O 3.04Å; E416-A418 PolarHBondContact O-N 3.34Å
419	S	95	Very high	85	Confident	54 Å²	54	67.4 Å²	67.4	38%	0.378	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	162.6	-169.7	67.2	0	0	0	0	114.2	I403 P417	I403-S419 WeakPolarHBondContact O-CA 3.34Å; I403-S419 WeakPolarHBondContact O-CB 3.42Å; P417-S419 PolarHBondContact O-N 2.83Å
420	V	95.3	Very high	83.1	Confident	37 Å²	37	70.9 Å²	70.9	22%	0.224	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	139.7	173.6	68.6	0	0	0	0	109.8	P321 P324 T402 I403	P321-V420 HydrophobicContact CB-CG1 3.97Å; P321-V420 HydrophobicContact CG-CG1 4.32Å; P324-V420 HydrophobicContact CB-CG1 4.37Å; P324-V420 HydrophobicContact CG-CG1 4.01Å; P324-V420 HydrophobicContact CG-CG2 3.85Å; T402-V420 WeakPolarHBondContact CA-O 3.35Å; I403-V420 HydrophobicContact CB-CG1 4.27Å; I403-V420 HydrophobicContact CD1-CG1 4.49Å; I403-V420 PolarHBondContact N-O 3.5Å; I403-V420 PolarHBondContact O-N 2.82Å
421	S	92.7	Very high	81.6	Confident	61 Å²	61	70.5 Å²	70.5	43%	0.427	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	142.7	-176.8	-54.9	0	0	0	0	112.6	F401 T402	F401-S421 CarbonylContact O-C 3.56Å; F401-S421 VanDerWaalsContact O-CA 3.28Å; F401-S421 WeakPolarHBondContact O-CA 3.06Å; T402-S421 PolarHBondContact OG1-OG 3.49Å
422	I	91.7	Very high	80.6	Confident	25 Å²	25	68.7 Å²	68.7	13%	0.128	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	140.9	174.8	-171.2	165.6	0	0	0	110.8	P324 L335 M400 F401	P324-I422 HydrophobicContact CB-CB 4.49Å; P324-I422 HydrophobicContact CB-CD1 4.39Å; L335-I422 HydrophobicContact CD2-CG2 3.84Å; M400-I422 WeakPolarHBondContact CA-O 3.44Å; F401-I422 HydrophobicContact CB-CG2 4.07Å; F401-I422 PolarHBondContact N-O 2.86Å; F401-I422 PolarHBondContact O-N 2.78Å
423	N	89.9	Confident	79.8	Confident	79 Å²	79	68.5 Å²	68.5	42%	0.422	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	135.9	-179.3	-71.6	-50.6	0	0	0	110.8	R398 Y399 M400	R398-N423 PolarHBondContact NH2-ND2 2.86Å; R398-N423 VanDerWaalsContact NH2-ND2 3.16Å; Y399-N423 CarbonylContact O-C 3.58Å; Y399-N423 WeakPolarHBondContact O-CA 3.5Å; M400-N423 WeakPolarHBondContact CB-OD1 3.29Å
424	V	85.5	Confident	79.4	Confident	13 Å²	13	67.8 Å²	67.8	8%	0.079	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	144.5	-177.5	-175.5	0	0	0	0	110.7	L328 L333 R398 Y399 F401	L328-V424 HydrophobicContact CD1-CG1 4.35Å; L333-V424 HydrophobicContact CD1-CG1 4.13Å; L333-V424 HydrophobicContact CD1-CG2 4.18Å; L333-V424 HydrophobicContact CD2-CB 4.22Å; L333-V424 HydrophobicContact CD2-CG1 4.15Å; L333-V424 HydrophobicContact CD2-CG2 3.93Å; R398-V424 WeakPolarHBondContact CA-O 3.41Å; Y399-V424 PolarHBondContact N-O 3.41Å; Y399-V424 PolarHBondContact O-N 2.72Å; F401-V424 HydrophobicContact CD2-CG2 4.45Å
425	T	81.6	Confident	79.2	Confident	85 Å²	85	61.9 Å²	61.9	52%	0.521	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	140.9	176.7	-50.2	0	0	0	0	110.5	L328	L328-T425 WeakPolarHBondContact CD2-O 3.36Å
426	S	73.4	Confident	79	Confident	14 Å²	14	60.9 Å²	60.9	10%	0.098	37%	0.365	C	S	.	.			trans	-97.7	153.1	-171.6	47.6	0	0	0	0	115.2	R394 P395 Q396 T397	R394-S426 WeakPolarHBondContact O-CB 3.04Å; R394-S426 PolarHBondContact O-OG 2.89Å; P395-S426 VanDerWaalsContact C-OG 3.24Å; P395-S426 WeakPolarHBondContact CA-OG 3.4Å; Q396-S426 PolarHBondContact N-O 3.24Å; Q396-S426 PolarHBondContact N-OG 3.11Å; T397-S426 PolarHBondContact N-OG 2.81Å
427	S	63.3	Low	79.1	Confident	65 Å²	65	54.6 Å²	54.6	46%	0.455	34%	0.337	S	S	.	.			trans	-94.9	-173.1	-170.2	70.2	0	0	0	0	115.6
428	R	56.2	Low	79	Confident	175 Å²	175	60.2 Å²	60.2	66%	0.66	36%	0.356	S	S	*	.			trans	-126.5	-12.9	-155.5	-130.7	-175.3	-168.2	-163.4	5.1	119.7	Q396	Q396-R428 VanDerWaalsContact CD-NE 3.26Å; Q396-R428 HydrophobicContact CG-CG 4.38Å; Q396-R428 VanDerWaalsContact OE1-CZ 3.23Å
429	D	53.6	Low	78.8	Confident	127 Å²	127	64.9 Å²	64.9	68%	0.679	37%	0.366	S	S	*	.			trans	-121.5	51.8	-150.6	-60.2	-59.2	0	0	0	118.8
430	A	54.1	Low	78.4	Confident	74 Å²	74	65.5 Å²	65.5	61%	0.612	37%	0.374	S	S	*	.			trans	-116.5	136.9	177.2	0	0	0	0	0	114.4
431	P	63	Low	77.9	Confident	6 Å²	6	66.2 Å²	66.2	4%	0.039	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-77.4	151.3	178.9	29.1	-31.9	0	0	0	113.2	L456 T508	P431-L456 HydrophobicContact CB-CD2 4.25Å; P431-T508 HydrophobicContact CB-CG2 4.18Å; P431-T508 HydrophobicContact CG-CG2 4.17Å
432	P	67.3	Low	77.6	Confident	60 Å²	60	64.7 Å²	64.7	39%	0.39	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-68.9	154.2	-175	27.7	-35.2	0	0	0	113.6	P454 L456	P432-P454 HydrophobicContact CG-CB 4.27Å; P432-L456 HydrophobicContact CG-CD2 4.28Å
433	P	75.9	Confident	77.2	Confident	70 Å²	70	65.3 Å²	65.3	46%	0.455	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-66.5	145.2	-176.7	25.8	-33.2	0	0	0	113.1	S514	P433-S514 WeakPolarHBondContact CB-OG 3.32Å
434	V	81.6	Confident	76.9	Confident	6 Å²	6	64.9 Å²	64.9	4%	0.036	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-67	139.2	179.3	178	0	0	0	0	111.2	W451 Y465 V504 A506 S516	V434-W451 HydrophobicContact CG1-CB 3.87Å; V434-W451 HydrophobicContact CG1-CG 3.78Å; V434-Y465 HydrophobicContact CG2-CD1 4.1Å; V434-Y465 HydrophobicContact CG2-CE1 4.12Å; V434-V504 HydrophobicContact CB-CB 4.46Å; V434-V504 HydrophobicContact CG1-CB 4.32Å; V434-V504 HydrophobicContact CG1-CG1 4.33Å; V434-V504 HydrophobicContact CG2-CG1 4.48Å; V434-A506 HydrophobicContact CG2-CB 3.9Å; V434-S516 WeakPolarHBondContact O-CB 3.5Å
435	S	82.3	Confident	76.9	Confident	69 Å²	69	67 Å²	67	48%	0.483	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	169.1	-177.9	69.6	0	0	0	0	112.7	L437 T452	S435-L437 PolarHBondContact O-N 3.31Å; S435-T452 PolarHBondContact O-N 2.78Å
436	G	81.8	Confident	77.3	Confident	41 Å²	41	64.2 Å²	64.2	42%	0.423	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	73.4	17.5	171.4	0	0	0	0	0	116.8	R438	G436-R438 PolarHBondContact O-N 2.89Å
437	L	91	Very high	78.2	Confident	32 Å²	32	63.5 Å²	63.5	17%	0.168	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	117	179.6	179.9	62.7	0	0	0	112.3	S435 L449 S450 W451 V504 F521	S435-L437 PolarHBondContact O-N 3.31Å; L437-L449 HydrophobicContact CD1-CB 4.44Å; L437-S450 CarbonylContact C-O 3.51Å; L437-S450 WeakPolarHBondContact CA-O 3.46Å; L437-W451 HydrophobicContact CB-CB 4.46Å; L437-W451 HydrophobicContact CD1-CB 4.33Å; L437-W451 HydrophobicContact CD1-CE3 3.97Å; L437-V504 HydrophobicContact CD1-CG2 3.68Å; L437-V504 HydrophobicContact CD2-CG2 4.02Å; L437-V504 HydrophobicContact CG-CG2 4.39Å; L437-F521 HydrophobicContact CD2-CE2 4.11Å; L437-F521 HydrophobicContact CD2-CZ 4.47Å; L437-F521 HydrophobicContact CG-CE2 4.04Å; L437-F521 HydrophobicContact CG-CZ 4.06Å
438	R	89.8	Confident	79.5	Confident	140 Å²	140	61.8 Å²	61.8	53%	0.528	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	155.2	-176.7	62.6	-178.4	179.8	-98.6	5.5	112.6	G436 L449 S450	G436-R438 PolarHBondContact O-N 2.89Å; R438-L449 WeakPolarHBondContact O-CA 3.44Å; R438-S450 WeakPolarHBondContact CG-OG 3.34Å; R438-S450 PolarHBondContact N-O 3.44Å; R438-S450 PolarHBondContact O-N 3.42Å
439	R	89.8	Confident	81.3	Confident	130 Å²	130	53.5 Å²	53.5	49%	0.491	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	123.8	173.4	-177.7	-172	71.2	172.2	0.8	110.4	A441 L449 F521	R439-A441 WeakPolarHBondContact CG-O 3.28Å; R439-L449 HydrophobicContact CB-CD2 4.28Å; R439-F521 HydrophobicContact CB-CD1 3.76Å; R439-F521 HydrophobicContact CB-CE1 4.07Å; R439-F521 HydrophobicContact CB-CG 4.43Å
440	A	86.8	Confident	83.2	Confident	66 Å²	66	48.3 Å²	48.3	55%	0.545	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-41.9	172.8	0	0	0	0	0	112.1	S448	A440-S448 PolarHBondContact N-O 3.39Å
441	A	83.8	Confident	85	Confident	53 Å²	53	45.2 Å²	45.2	44%	0.438	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	164.7	176.8	0	0	0	0	0	111.5	R439 S448	R439-A441 WeakPolarHBondContact CG-O 3.28Å; A441-S448 PolarHBondContact N-O 2.98Å; A441-S448 PolarHBondContact O-N 2.72Å
442	A	86.3	Confident	86.1	Confident	28 Å²	28	48.1 Å²	48.1	23%	0.231	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	150.1	171.5	0	0	0	0	0	110.4	S446 L447 L524	A442-S446 WeakPolarHBondContact CA-O 3.3Å; A442-L447 HydrophobicContact CB-CD2 3.73Å; A442-L524 HydrophobicContact CB-CG 4.23Å; A442-L524 WeakPolarHBondContact O-CD1 3.47Å
443	S	85.3	Confident	86.8	Confident	39 Å²	39	47.4 Å²	47.4	27%	0.273	29%	0.292	S	S	.	.			trans	-123.9	-172.6	165.4	76.6	0	0	0	0	109.7	S445 S446 T523 L524	S443-S445 PolarHBondContact O-N 3.43Å; S443-S445 PolarHBondContact OG-N 3.22Å; S443-S445 VanDerWaalsContact OG-N 3.16Å; S443-S446 PolarHBondContact N-O 2.91Å; S443-S446 PolarHBondContact OG-N 2.98Å; S443-S446 PolarHBondContact OG-OG 2.63Å; S443-T523 WeakPolarHBondContact O-CA 3.27Å; S443-T523 WeakPolarHBondContact O-CB 3.37Å; S443-L524 PolarHBondContact O-N 3.45Å
444	E	83.5	Confident	86.8	Confident	70 Å²	70	44.9 Å²	44.9	33%	0.327	28%	0.275	S	S	.	.	S	Bend	trans	-60	-31.5	170.4	-66.9	163.3	-159.6	0	0	112.7	R496 L524	E444-R496 HydrophobicContact CB-CG 4.36Å; E444-R496 VanDerWaalsContact O-CA 3.27Å; E444-R496 WeakPolarHBondContact O-CA 3.44Å; E444-R496 WeakPolarHBondContact O-CG 3.01Å; E444-R496 IonicContact OE2-NH1 2.68Å; E444-L524 WeakPolarHBondContact CA-O 3.44Å
445	S	85.3	Confident	86.3	Confident	56 Å²	56	50.9 Å²	50.9	39%	0.392	31%	0.312	S	S	.	.	S	Bend	trans	-131.6	9.4	-172.3	64.9	0	0	0	0	115	S443 G493 L494	S443-S445 PolarHBondContact O-N 3.43Å; S443-S445 PolarHBondContact OG-N 3.22Å; S443-S445 VanDerWaalsContact OG-N 3.16Å; S445-G493 PolarHBondContact O-N 3.3Å; S445-G493 VanDerWaalsContact O-N 3.08Å; S445-L494 WeakPolarHBondContact CA-O 3.23Å; S445-L494 PolarHBondContact O-N 3.35Å
446	S	88.8	Confident	85.6	Confident	27 Å²	27	49.3 Å²	49.3	19%	0.189	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	154.7	179.4	69.8	0	0	0	0	114.6	A442 S443 L491	A442-S446 WeakPolarHBondContact CA-O 3.3Å; S443-S446 PolarHBondContact N-O 2.91Å; S443-S446 PolarHBondContact OG-N 2.98Å; S443-S446 PolarHBondContact OG-OG 2.63Å; S446-L491 CarbonylContact C-O 3.6Å; S446-L491 WeakPolarHBondContact CA-O 3.42Å; S446-L491 WeakPolarHBondContact CB-O 3.43Å
447	L	92.3	Very high	84.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	120.9	175.3	-73.4	176.1	0	0	0	109.9	A442 V490 L491 L494 F521 S522 T523	A442-L447 HydrophobicContact CB-CD2 3.73Å; L447-V490 CarbonylContact O-C 3.59Å; L447-V490 WeakPolarHBondContact O-CA 3.4Å; L447-L491 PolarHBondContact N-O 3.12Å; L447-L491 PolarHBondContact O-N 3.49Å; L447-L494 HydrophobicContact CB-CD1 3.87Å; L447-L494 HydrophobicContact CD1-CD1 3.66Å; L447-L494 HydrophobicContact CG-CD1 3.61Å; L447-F521 HydrophobicContact CD1-CB 3.91Å; L447-F521 HydrophobicContact CD2-CB 4.41Å; L447-S522 WeakPolarHBondContact CD2-O 3.34Å; L447-T523 HydrophobicContact CD2-CG2 4.45Å; L447-T523 HydrophobicContact CG-CG2 4.15Å
448	S	91.3	Very high	82.9	Confident	29 Å²	29	62 Å²	62	20%	0.203	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	122.7	170.2	-178.3	0	0	0	0	109.7	A440 A441	A440-S448 PolarHBondContact N-O 3.39Å; A441-S448 PolarHBondContact N-O 2.98Å; A441-S448 PolarHBondContact O-N 2.72Å
449	L	94.3	Very high	81.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	149	-175.5	-57.5	178.9	0	0	0	110.7	L437 R438 R439 W451 L467 S488 L489 L491 V502 F521	L437-L449 HydrophobicContact CD1-CB 4.44Å; R438-L449 WeakPolarHBondContact O-CA 3.44Å; R439-L449 HydrophobicContact CB-CD2 4.28Å; L449-W451 HydrophobicContact CB-CZ3 4.36Å; L449-L467 HydrophobicContact CD1-CD2 4.3Å; L449-S488 CarbonylContact O-C 3.55Å; L449-S488 WeakPolarHBondContact O-CA 3.32Å; L449-S488 WeakPolarHBondContact O-CB 3.05Å; L449-L489 PolarHBondContact N-O 2.82Å; L449-L489 PolarHBondContact O-N 3.49Å; L449-L491 HydrophobicContact CD1-CD1 3.89Å; L449-L491 HydrophobicContact CD1-CG 4.43Å; L449-V502 HydrophobicContact CD1-CB 4.3Å; L449-V502 HydrophobicContact CD1-CG1 3.72Å; L449-V502 HydrophobicContact CD1-CG2 4.17Å; L449-F521 HydrophobicContact CD1-CD2 4.39Å; L449-F521 HydrophobicContact CD2-CD2 3.62Å; L449-F521 HydrophobicContact CD2-CE2 3.84Å; L449-F521 HydrophobicContact CD2-CG 3.98Å; L449-F521 HydrophobicContact CD2-CZ 4.38Å
450	S	92.7	Very high	80	Confident	19 Å²	19	55.6 Å²	55.6	13%	0.133	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	151.5	175	57.5	0	0	0	0	110.9	L437 R438 C487	L437-S450 CarbonylContact C-O 3.51Å; L437-S450 WeakPolarHBondContact CA-O 3.46Å; R438-S450 WeakPolarHBondContact CG-OG 3.34Å; R438-S450 PolarHBondContact N-O 3.44Å; R438-S450 PolarHBondContact O-N 3.42Å; S450-C487 WeakPolarHBondContact CA-O 3.4Å
451	W	92.1	Very high	79.3	Confident	8 Å²	8	57.2 Å²	57.2	3%	0.03	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	177	179.7	52.5	91	0	0	0	110.6	V434 L437 L449 Y465 L467 S486 C487 L489 V504	V434-W451 HydrophobicContact CG1-CB 3.87Å; V434-W451 HydrophobicContact CG1-CG 3.78Å; L437-W451 HydrophobicContact CB-CB 4.46Å; L437-W451 HydrophobicContact CD1-CB 4.33Å; L437-W451 HydrophobicContact CD1-CE3 3.97Å; L449-W451 HydrophobicContact CB-CZ3 4.36Å; W451-Y465 AromaticContact CD1-CD1 3.96Å; W451-Y465 AromaticContact CD1-CE1 3.97Å; W451-Y465 AromaticContact CE2-CG 3.85Å; W451-Y465 HydrophobicContact CZ2-CD2 4.17Å; W451-Y465 AromaticContact CZ2-CG 3.87Å; W451-Y465 HydrophobicContact CZ2-CG 3.87Å; W451-Y465 AromaticContact NE1-CD1 3.16Å; W451-Y465 AromaticContact NE1-CD2 3.68Å; W451-Y465 AromaticContact NE1-CE1 3.49Å; W451-Y465 AromaticContact NE1-CE2 3.99Å; W451-Y465 AromaticContact NE1-CG 3.26Å; W451-Y465 VanDerWaalsContact NE1-CG 3.26Å; W451-Y465 AromaticContact NE1-CZ 3.91Å; W451-L467 HydrophobicContact CE3-CD2 4.4Å; W451-L467 HydrophobicContact CH2-CD1 3.48Å; W451-L467 VanDerWaalsContact CH2-CD1 3.48Å; W451-L467 HydrophobicContact CH2-CD2 3.99Å; W451-L467 HydrophobicContact CH2-CG 4.25Å; W451-L467 HydrophobicContact CZ2-CD1 3.92Å; W451-L467 HydrophobicContact CZ3-CD1 4.08Å; W451-L467 HydrophobicContact CZ3-CD2 3.68Å; W451-L467 HydrophobicContact CZ3-CG 4.37Å; W451-S486 WeakPolarHBondContact CZ2-O 3.5Å; W451-C487 PolarHBondContact N-O 2.78Å; W451-C487 WeakPolarHBondContact O-CB 3.04Å; W451-L489 HydrophobicContact CH2-CB 3.83Å; W451-L489 HydrophobicContact CZ3-CB 4.18Å; W451-V504 HydrophobicContact CD2-CG1 4.09Å; W451-V504 HydrophobicContact CD2-CG2 4.27Å; W451-V504 HydrophobicContact CE3-CG2 4.16Å; W451-V504 HydrophobicContact CG-CG1 4.43Å; W451-V504 HydrophobicContact CZ2-CG1 4.25Å
452	T	86.9	Confident	79.1	Confident	67 Å²	67	56.3 Å²	56.3	41%	0.411	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137.6	177.5	-51.2	0	0	0	0	109.6	S435	S435-T452 PolarHBondContact O-N 2.78Å
453	A	81.3	Confident	78.9	Confident	46 Å²	46	59.9 Å²	59.9	38%	0.38	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-62.8	138.5	173.7	0	0	0	0	0	111	Y465	A453-Y465 WeakPolarHBondContact CA-OH 3.3Å; A453-Y465 VanDerWaalsContact CB-OH 3.24Å; A453-Y465 WeakPolarHBondContact CB-OH 3.34Å
454	P	76.8	Confident	78.9	Confident	16 Å²	16	60.3 Å²	60.3	10%	0.104	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-65.6	140.5	173.5	27.6	-32.9	0	0	0	110.5	P432 L456 V462 A506	P432-P454 HydrophobicContact CG-CB 4.27Å; P454-L456 HydrophobicContact CB-CD2 4.49Å; P454-L456 HydrophobicContact CG-CG 4.49Å; P454-L456 PolarHBondContact O-N 2.81Å; P454-V462 HydrophobicContact CG-CG2 3.96Å; P454-A506 HydrophobicContact CG-CB 4.02Å
455	V	69.8	Low	79.1	Confident	132 Å²	132	57.6 Å²	57.6	80%	0.8	33%	0.33	S	S	*	.			trans	-77.2	107.9	176	-179.1	0	0	0	0	108.7
456	L	67.8	Low	79.4	Confident	36 Å²	36	56.1 Å²	56.1	19%	0.188	32%	0.317	C	S	.	.			trans	-100.9	87.7	-177.5	-67.1	-175	0	0	0	110.4	P431 P432 P454 N458 Q459 P460 V462 T508	P431-L456 HydrophobicContact CB-CD2 4.25Å; P432-L456 HydrophobicContact CG-CD2 4.28Å; P454-L456 HydrophobicContact CB-CD2 4.49Å; P454-L456 HydrophobicContact CG-CG 4.49Å; P454-L456 PolarHBondContact O-N 2.81Å; L456-N458 PolarHBondContact O-N 3.01Å; L456-Q459 HydrophobicContact CB-CB 4.17Å; L456-P460 WeakPolarHBondContact CD1-O 3.46Å; L456-V462 HydrophobicContact CD1-CG2 3.75Å; L456-T508 HydrophobicContact CD1-CG2 3.86Å
457	Q	58.2	Low	79.5	Confident	166 Å²	166	54.8 Å²	54.8	78%	0.776	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	123.5	168.9	-82.1	-179.3	-34.7	0	0	109.7	Q459	Q457-Q459 PolarHBondContact O-N 3.38Å
458	N	57.2	Low	79.4	Confident	175 Å²	175	57.3 Å²	57.3	94%	0.936	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	23.7	175.3	-52.9	-25	0	0	0	115.9	L456	L456-N458 PolarHBondContact O-N 3.01Å
459	Q	58.8	Low	79.4	Confident	79 Å²	79	56 Å²	56	37%	0.369	31%	0.309	S	S	.	.	S	Bend	trans	-118	154.5	173.7	-72.2	-170.9	-2.6	0	0	111.3	L456 Q457	L456-Q459 HydrophobicContact CB-CB 4.17Å; Q457-Q459 PolarHBondContact O-N 3.38Å
460	P	61.5	Low	79.2	Confident	55 Å²	55	57.8 Å²	57.8	36%	0.357	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-60.9	152.3	174.9	25.3	-34.3	0	0	0	111.7	L456 Q509	L456-P460 WeakPolarHBondContact CD1-O 3.46Å; P460-Q509 HydrophobicContact CG-CB 4.17Å
461	P	71.8	Confident	78.9	Confident	100 Å²	100	57.9 Å²	57.9	65%	0.649	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-61.5	155.7	-176.7	26.6	-35.4	0	0	0	112.4	L463	P461-L463 PolarHBondContact O-N 2.78Å
462	V	79.5	Confident	78.6	Confident	35 Å²	35	59.7 Å²	59.7	21%	0.212	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-62.8	125	174.1	-178	0	0	0	0	109.3	P454 L456 E464 Y465 A506 Q507	P454-V462 HydrophobicContact CG-CG2 3.96Å; L456-V462 HydrophobicContact CD1-CG2 3.75Å; V462-E464 VanDerWaalsContact CG1-O 3.29Å; V462-E464 WeakPolarHBondContact CG1-O 3.26Å; V462-Y465 HydrophobicContact CG1-CD1 4.3Å; V462-Y465 HydrophobicContact CG1-CD2 4.34Å; V462-Y465 HydrophobicContact CG1-CE1 3.89Å; V462-Y465 HydrophobicContact CG1-CE2 3.92Å; V462-A506 HydrophobicContact CG1-CB 3.81Å; V462-A506 HydrophobicContact CG2-CB 4.03Å; V462-Q507 CarbonylContact C-O 3.48Å; V462-Q507 WeakPolarHBondContact CA-O 3.4Å; V462-Q507 WeakPolarHBondContact CG1-O 3.19Å
463	L	82.1	Confident	78	Confident	103 Å²	103	61.6 Å²	61.6	54%	0.539	35%	0.348	S	S	.	.			trans	-83.8	-45.8	-179.5	-59.6	177.1	0	0	0	111.4	P461 Q507	P461-L463 PolarHBondContact O-N 2.78Å; L463-Q507 PolarHBondContact N-O 3.1Å
464	E	84.4	Confident	77.7	Confident	48 Å²	48	63.1 Å²	63.1	22%	0.224	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	162	173.6	64.1	161.7	-128.2	0	0	111.8	V462 S483 Q507 Y512	V462-E464 VanDerWaalsContact CG1-O 3.29Å; V462-E464 WeakPolarHBondContact CG1-O 3.26Å; E464-S483 PolarHBondContact OE1-OG 2.79Å; E464-S483 PolarHBondContact OE2-OG 2.89Å; E464-Q507 VanDerWaalsContact CD-OE1 3.26Å; E464-Q507 HydrophobicContact CG-CB 3.79Å; E464-Q507 HydrophobicContact CG-CG 4.49Å; E464-Q507 PolarHBondContact O-N 3.47Å; E464-Q507 PolarHBondContact OE1-OE1 3.01Å; E464-Y512 PolarHBondContact OE1-OH 2.87Å
465	Y	88.2	Confident	77.2	Confident	12 Å²	12	68.8 Å²	68.8	5%	0.047	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	133.3	166	-63.8	-83.1	0	0	0	109.6	V434 W451 A453 V462 S483 S484 S486 V504 R505 A506	V434-Y465 HydrophobicContact CG2-CD1 4.1Å; V434-Y465 HydrophobicContact CG2-CE1 4.12Å; W451-Y465 AromaticContact CD1-CD1 3.96Å; W451-Y465 AromaticContact CD1-CE1 3.97Å; W451-Y465 AromaticContact CE2-CG 3.85Å; W451-Y465 HydrophobicContact CZ2-CD2 4.17Å; W451-Y465 AromaticContact CZ2-CG 3.87Å; W451-Y465 HydrophobicContact CZ2-CG 3.87Å; W451-Y465 AromaticContact NE1-CD1 3.16Å; W451-Y465 AromaticContact NE1-CD2 3.68Å; W451-Y465 AromaticContact NE1-CE1 3.49Å; W451-Y465 AromaticContact NE1-CE2 3.99Å; W451-Y465 AromaticContact NE1-CG 3.26Å; W451-Y465 VanDerWaalsContact NE1-CG 3.26Å; W451-Y465 AromaticContact NE1-CZ 3.91Å; A453-Y465 WeakPolarHBondContact CA-OH 3.3Å; A453-Y465 VanDerWaalsContact CB-OH 3.24Å; A453-Y465 WeakPolarHBondContact CB-OH 3.34Å; V462-Y465 HydrophobicContact CG1-CD1 4.3Å; V462-Y465 HydrophobicContact CG1-CD2 4.34Å; V462-Y465 HydrophobicContact CG1-CE1 3.89Å; V462-Y465 HydrophobicContact CG1-CE2 3.92Å; Y465-S483 CarbonylContact O-C 3.57Å; Y465-S483 VanDerWaalsContact O-CA 3.23Å; Y465-S483 WeakPolarHBondContact O-CA 3.2Å; Y465-S484 PolarHBondContact N-O 3.22Å; Y465-S484 PolarHBondContact O-N 2.97Å; Y465-S486 WeakPolarHBondContact CD2-O 3.31Å; Y465-V504 HydrophobicContact CD1-CG1 4.32Å; Y465-R505 CarbonylContact C-O 3.57Å; Y465-R505 WeakPolarHBondContact CA-O 3.43Å; Y465-A506 HydrophobicContact CD1-CB 4.08Å; Y465-A506 HydrophobicContact CE1-CB 3.93Å
466	Q	90.8	Very high	77.2	Confident	25 Å²	25	71.4 Å²	71.4	12%	0.117	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.7	175.2	-172.1	177	81.1	0	0	110.5	Y481 V504 R505 Y512	Q466-Y481 HydrophobicContact CG-CD1 4.27Å; Q466-V504 WeakPolarHBondContact O-CA 3.49Å; Q466-R505 HydrophobicContact CB-CG 4.15Å; Q466-R505 PolarHBondContact N-O 3.43Å; Q466-R505 PolarHBondContact O-N 2.92Å; Q466-R505 VanDerWaalsContact OE1-NE 3.1Å; Q466-Y512 HydrophobicContact CB-CD1 4.42Å; Q466-Y512 HydrophobicContact CB-CE1 3.81Å; Q466-Y512 PolarHBondContact NE2-OH 3.45Å; Q466-Y512 VanDerWaalsContact NE2-OH 3.1Å
467	L	91.3	Very high	77.6	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	141.6	178.1	-69.2	88.4	0	0	0	109.7	L449 W451 Y481 R482 L489 V502 Q503 V504	L449-L467 HydrophobicContact CD1-CD2 4.3Å; W451-L467 HydrophobicContact CE3-CD2 4.4Å; W451-L467 HydrophobicContact CH2-CD1 3.48Å; W451-L467 VanDerWaalsContact CH2-CD1 3.48Å; W451-L467 HydrophobicContact CH2-CD2 3.99Å; W451-L467 HydrophobicContact CH2-CG 4.25Å; W451-L467 HydrophobicContact CZ2-CD1 3.92Å; W451-L467 HydrophobicContact CZ3-CD1 4.08Å; W451-L467 HydrophobicContact CZ3-CD2 3.68Å; W451-L467 HydrophobicContact CZ3-CG 4.37Å; L467-Y481 VanDerWaalsContact O-CA 3.31Å; L467-Y481 WeakPolarHBondContact O-CA 3.41Å; L467-R482 PolarHBondContact N-O 2.83Å; L467-R482 PolarHBondContact O-N 2.92Å; L467-L489 HydrophobicContact CB-CD2 4.46Å; L467-L489 HydrophobicContact CD1-CB 4.26Å; L467-L489 HydrophobicContact CD1-CD2 3.8Å; L467-L489 HydrophobicContact CD2-CB 4.42Å; L467-L489 HydrophobicContact CD2-CD2 4.25Å; L467-L489 HydrophobicContact CG-CD2 4.36Å; L467-V502 HydrophobicContact CD2-CG1 4.32Å; L467-Q503 CarbonylContact C-O 3.57Å; L467-Q503 WeakPolarHBondContact CA-O 3.3Å; L467-V504 HydrophobicContact CD1-CG1 4.18Å; L467-V504 HydrophobicContact CD2-CG2 3.78Å; L467-V504 HydrophobicContact CG-CB 4.32Å; L467-V504 HydrophobicContact CG-CG1 4.01Å; L467-V504 HydrophobicContact CG-CG2 3.74Å
468	R	90.9	Very high	78.5	Confident	53 Å²	53	67.8 Å²	67.8	20%	0.2	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	138.4	164.4	70.1	175.9	-173.9	-166	-0.4	111	W479 E480 Y481 V502 Q503 F515	R468-W479 HydrophobicContact CB-CB 4.43Å; R468-W479 HydrophobicContact CB-CD2 4.36Å; R468-W479 HydrophobicContact CB-CE3 3.79Å; R468-W479 HydrophobicContact CB-CZ3 4.41Å; R468-W479 HydrophobicContact CG-CD2 4.11Å; R468-W479 HydrophobicContact CG-CE3 3.56Å; R468-W479 HydrophobicContact CG-CZ3 3.79Å; R468-E480 CarbonylContact C-O 3.47Å; R468-E480 VanDerWaalsContact CA-O 3.23Å; R468-E480 WeakPolarHBondContact CA-O 3.16Å; R468-Y481 HydrophobicContact CB-CD1 3.84Å; R468-Y481 HydrophobicContact CB-CE1 3.65Å; R468-V502 WeakPolarHBondContact O-CA 3.18Å; R468-Q503 HydrophobicContact CG-CB 4.04Å; R468-Q503 VanDerWaalsContact CZ-OE1 3.3Å; R468-Q503 PolarHBondContact N-O 2.93Å; R468-Q503 PolarHBondContact O-N 3.02Å; R468-F515 HydrophobicContact CB-CE1 4.23Å; R468-F515 HydrophobicContact CG-CD1 4.1Å; R468-F515 HydrophobicContact CG-CE1 3.71Å; R468-F515 HydrophobicContact CG-CZ 4.12Å
469	F	90.4	Very high	79.7	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.009	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	156.4	177	66	-80.9	0	0	0	112.8	E480 R482 L491 L494 Y500 Q501 V502	F469-E480 HydrophobicContact CD1-CB 4.13Å; F469-E480 WeakPolarHBondContact CD1-O 3.26Å; F469-E480 HydrophobicContact CD2-CB 4.25Å; F469-E480 HydrophobicContact CE1-CB 3.62Å; F469-E480 HydrophobicContact CE2-CB 3.77Å; F469-E480 HydrophobicContact CE2-CG 4.29Å; F469-E480 HydrophobicContact CG-CB 4.41Å; F469-E480 HydrophobicContact CZ-CB 3.43Å; F469-E480 VanDerWaalsContact CZ-CB 3.43Å; F469-E480 HydrophobicContact CZ-CG 4.22Å; F469-E480 WeakPolarHBondContact CZ-OE2 3.08Å; F469-E480 PolarHBondContact N-O 2.71Å; F469-E480 PolarHBondContact O-N 3.36Å; F469-R482 HydrophobicContact CE1-CG 4.02Å; F469-L491 HydrophobicContact CB-CD1 4.15Å; F469-L491 HydrophobicContact CD1-CD1 3.87Å; F469-L491 HydrophobicContact CD1-CD2 3.86Å; F469-L491 HydrophobicContact CD1-CG 4.5Å; F469-L491 HydrophobicContact CD2-CD1 4.38Å; F469-L491 HydrophobicContact CE1-CD1 4.4Å; F469-L491 HydrophobicContact CE1-CD2 3.77Å; F469-L491 HydrophobicContact CG-CD1 3.87Å; F469-L491 HydrophobicContact CZ-CD2 4.48Å; F469-L494 HydrophobicContact CD2-CD2 4.03Å; F469-L494 HydrophobicContact CE2-CD2 3.61Å; F469-L494 HydrophobicContact CZ-CD2 4.42Å; F469-Y500 AromaticContact CD2-CD1 3.97Å; F469-Y500 HydrophobicContact CD2-CD1 3.97Å; F469-Y500 HydrophobicContact CD2-CE1 4.22Å; F469-Q501 WeakPolarHBondContact CA-O 3.32Å; F469-V502 HydrophobicContact CB-CB 4.45Å; F469-V502 HydrophobicContact CB-CG1 4.29Å; F469-V502 HydrophobicContact CB-CG2 3.9Å
470	R	90.1	Very high	80.9	Confident	36 Å²	36	62.9 Å²	62.9	14%	0.136	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	158.5	172.5	65.7	179.1	-176.5	152.9	4.2	111.4	L472 H475 W479 Y500 Q501	R470-L472 PolarHBondContact O-N 3.49Å; R470-H475 PolarHBondContact NH1-O 3.09Å; R470-W479 HydrophobicContact CB-CE3 4.16Å; R470-W479 HydrophobicContact CB-CZ3 4.46Å; R470-W479 HydrophobicContact CG-CD2 4.22Å; R470-W479 HydrophobicContact CG-CE3 3.89Å; R470-W479 HydrophobicContact CG-CH2 4.02Å; R470-W479 HydrophobicContact CG-CZ2 4.31Å; R470-W479 HydrophobicContact CG-CZ3 3.79Å; R470-Y500 VanDerWaalsContact C-CD1 3.43Å; R470-Y500 CarbonylContact O-C 3.58Å; R470-Y500 WeakPolarHBondContact O-CA 3.32Å; R470-Y500 WeakPolarHBondContact O-CD1 3.34Å; R470-Q501 HydrophobicContact CG-CB 4.34Å; R470-Q501 PolarHBondContact N-O 3.03Å; R470-Q501 VanDerWaalsContact N-O 3.08Å; R470-Q501 VanDerWaalsContact NE-OE1 3.08Å; R470-Q501 PolarHBondContact O-N 3.32Å
471	P	86.9	Confident	82.1	Confident	21 Å²	21	65.3 Å²	65.3	14%	0.136	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	135.4	171.5	-20.4	32.8	0	0	0	111	A473 T498 Y500	P471-A473 VanDerWaalsContact C-N 3.34Å; P471-T498 HydrophobicContact CB-CG2 4.45Å; P471-Y500 HydrophobicContact CB-CE1 4.46Å; P471-Y500 HydrophobicContact CG-CD1 4.47Å; P471-Y500 HydrophobicContact CG-CE1 3.89Å
472	L	85.1	Confident	82.9	Confident	46 Å²	46	66 Å²	66	24%	0.241	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-30.1	-178.7	-172.6	70	0	0	0	112.3	R470 D474 H475 R499 Q501	R470-L472 PolarHBondContact O-N 3.49Å; L472-D474 VanDerWaalsContact C-N 3.25Å; L472-D474 PolarHBondContact O-N 2.81Å; L472-H475 PolarHBondContact O-CE1 2.97Å; L472-R499 HydrophobicContact CB-CB 4.41Å; L472-R499 HydrophobicContact CB-CG 4.41Å; L472-R499 WeakPolarHBondContact CB-O 3.41Å; L472-R499 HydrophobicContact CD2-CG 3.97Å; L472-R499 PolarHBondContact N-O 3.1Å; L472-Q501 HydrophobicContact CD1-CB 4.01Å; L472-Q501 HydrophobicContact CD1-CG 4.43Å
473	A	75.4	Confident	83.3	Confident	107 Å²	107	66.9 Å²	66.9	88%	0.884	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-12.2	-179.6	0	0	0	0	0	113.9	P471	P471-A473 VanDerWaalsContact C-N 3.34Å
474	D	75.4	Confident	83.5	Confident	78 Å²	78	62.4 Å²	62.4	42%	0.417	32%	0.319	S	S	.	.			trans	-122.8	98.6	179.3	-174.4	-12.6	0	0	0	109.6	L472 Q476 A477	L472-D474 VanDerWaalsContact C-N 3.25Å; L472-D474 PolarHBondContact O-N 2.81Å; D474-Q476 PolarHBondContact O-N 3.4Å; D474-Q476 WeakPolarHBondContact OD1-CA 3.44Å; D474-Q476 PolarHBondContact OD1-N 3.15Å; D474-A477 HydrophobicContact CB-CB 3.97Å; D474-A477 PolarHBondContact OD1-N 2.79Å
475	H	65.1	Low	83.6	Confident	135 Å²	135	65.8 Å²	65.8	63%	0.625	35%	0.345	S	S	*	.	S	Bend	trans	-75.6	-9.7	178.2	-70.2	-39.3	0	0	0	114	R470 L472	R470-H475 PolarHBondContact NH1-O 3.09Å; L472-H475 PolarHBondContact O-CE1 2.97Å
476	Q	69.2	Low	83.5	Confident	187 Å²	187	67.7 Å²	67.7	87%	0.874	36%	0.36	S	S	*	.	S	Bend	trans	-98.1	-16.7	177.2	-65.3	-175.7	-4.2	0	0	112.7	D474	D474-Q476 PolarHBondContact O-N 3.4Å; D474-Q476 WeakPolarHBondContact OD1-CA 3.44Å; D474-Q476 PolarHBondContact OD1-N 3.15Å
477	A	77.1	Confident	83.4	Confident	16 Å²	16	68.7 Å²	68.7	13%	0.132	37%	0.369	C	S	.	.	S	Bend	trans	-52.7	133.5	173.5	0	0	0	0	0	112.1	D474	D474-A477 HydrophobicContact CB-CB 3.97Å; D474-A477 PolarHBondContact OD1-N 2.79Å
478	P	77.5	Confident	83.3	Confident	110 Å²	110	71.4 Å²	71.4	71%	0.714	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-64.6	152.3	176.6	28.4	-34.8	0	0	0	111
479	W	82.9	Confident	83.4	Confident	64 Å²	64	70.4 Å²	70.4	24%	0.242	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-73.9	125.9	173.9	-72.3	98.4	0	0	0	110.6	R468 R470 Y481 Q501	R468-W479 HydrophobicContact CB-CB 4.43Å; R468-W479 HydrophobicContact CB-CD2 4.36Å; R468-W479 HydrophobicContact CB-CE3 3.79Å; R468-W479 HydrophobicContact CB-CZ3 4.41Å; R468-W479 HydrophobicContact CG-CD2 4.11Å; R468-W479 HydrophobicContact CG-CE3 3.56Å; R468-W479 HydrophobicContact CG-CZ3 3.79Å; R470-W479 HydrophobicContact CB-CE3 4.16Å; R470-W479 HydrophobicContact CB-CZ3 4.46Å; R470-W479 HydrophobicContact CG-CD2 4.22Å; R470-W479 HydrophobicContact CG-CE3 3.89Å; R470-W479 HydrophobicContact CG-CH2 4.02Å; R470-W479 HydrophobicContact CG-CZ2 4.31Å; R470-W479 HydrophobicContact CG-CZ3 3.79Å; W479-Y481 HydrophobicContact CB-CE2 3.73Å; W479-Y481 VanDerWaalsContact O-CD2 3.29Å; W479-Y481 WeakPolarHBondContact O-CD2 3.18Å; W479-Y481 VanDerWaalsContact O-CE2 3.22Å; W479-Y481 WeakPolarHBondContact O-CE2 3.41Å; W479-Q501 HydrophobicContact CH2-CB 4.43Å; W479-Q501 HydrophobicContact CH2-CG 4.07Å
480	E	83.6	Confident	83.5	Confident	87 Å²	87	74 Å²	74	41%	0.407	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	141.7	169.3	-70	-175.7	-121.6	0	0	110.4	R468 F469	R468-E480 CarbonylContact C-O 3.47Å; R468-E480 VanDerWaalsContact CA-O 3.23Å; R468-E480 WeakPolarHBondContact CA-O 3.16Å; F469-E480 HydrophobicContact CD1-CB 4.13Å; F469-E480 WeakPolarHBondContact CD1-O 3.26Å; F469-E480 HydrophobicContact CD2-CB 4.25Å; F469-E480 HydrophobicContact CE1-CB 3.62Å; F469-E480 HydrophobicContact CE2-CB 3.77Å; F469-E480 HydrophobicContact CE2-CG 4.29Å; F469-E480 HydrophobicContact CG-CB 4.41Å; F469-E480 HydrophobicContact CZ-CB 3.43Å; F469-E480 VanDerWaalsContact CZ-CB 3.43Å; F469-E480 HydrophobicContact CZ-CG 4.22Å; F469-E480 WeakPolarHBondContact CZ-OE2 3.08Å; F469-E480 PolarHBondContact N-O 2.71Å; F469-E480 PolarHBondContact O-N 3.36Å
481	Y	86.8	Confident	83.5	Confident	106 Å²	106	72.3 Å²	72.3	42%	0.416	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	145.2	-175.2	-64.9	-97.4	0	0	0	112.6	Q466 L467 R468 W479 F515	Q466-Y481 HydrophobicContact CG-CD1 4.27Å; L467-Y481 VanDerWaalsContact O-CA 3.31Å; L467-Y481 WeakPolarHBondContact O-CA 3.41Å; R468-Y481 HydrophobicContact CB-CD1 3.84Å; R468-Y481 HydrophobicContact CB-CE1 3.65Å; W479-Y481 HydrophobicContact CB-CE2 3.73Å; W479-Y481 VanDerWaalsContact O-CD2 3.29Å; W479-Y481 WeakPolarHBondContact O-CD2 3.18Å; W479-Y481 VanDerWaalsContact O-CE2 3.22Å; W479-Y481 WeakPolarHBondContact O-CE2 3.41Å; Y481-F515 HydrophobicContact CE1-CZ 4.16Å
482	R	87.4	Confident	83.5	Confident	115 Å²	115	75.6 Å²	75.6	43%	0.434	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	137.7	172.2	-66.8	-71.6	-176	-94.3	-1	109.6	L467 F469 L489 L491	L467-R482 PolarHBondContact N-O 2.83Å; L467-R482 PolarHBondContact O-N 2.92Å; F469-R482 HydrophobicContact CE1-CG 4.02Å; R482-L489 HydrophobicContact CB-CD2 3.46Å; R482-L489 VanDerWaalsContact CB-CD2 3.46Å; R482-L489 HydrophobicContact CG-CD2 4.25Å; R482-L491 HydrophobicContact CB-CD2 4.37Å; R482-L491 HydrophobicContact CG-CD2 4Å
483	S	87.8	Confident	83.4	Confident	54 Å²	54	76.9 Å²	76.9	38%	0.378	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	152.9	171.2	-66.1	0	0	0	0	111.4	E464 Y465	E464-S483 PolarHBondContact OE1-OG 2.79Å; E464-S483 PolarHBondContact OE2-OG 2.89Å; Y465-S483 CarbonylContact O-C 3.57Å; Y465-S483 VanDerWaalsContact O-CA 3.23Å; Y465-S483 WeakPolarHBondContact O-CA 3.2Å
484	S	87.1	Confident	84	Confident	9 Å²	9	72.2 Å²	72.2	6%	0.063	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	134.8	172.1	-174.1	0	0	0	0	110.1	Y465 S486 S488	Y465-S484 PolarHBondContact N-O 3.22Å; Y465-S484 PolarHBondContact O-N 2.97Å; S484-S486 PolarHBondContact O-N 2.81Å; S484-S486 PolarHBondContact OG-N 3.47Å; S484-S486 PolarHBondContact OG-O 2.84Å; S484-S486 PolarHBondContact OG-OG 3.03Å; S484-S488 WeakPolarHBondContact CB-O 3.27Å; S484-S488 PolarHBondContact OG-O 3.4Å
485	P	85.9	Confident	84.5	Confident	118 Å²	118	77.3 Å²	77.3	77%	0.766	42%	0.42	S	S	*	.	S	Bend	trans	-76.6	-3.8	172.2	33.5	-36	0	0	0	112.9
486	S	87.4	Confident	85.4	Confident	52 Å²	52	77.7 Å²	77.7	36%	0.364	42%	0.416	S	S	.	.	S	Bend	trans	-120.8	167.7	-178.2	74.8	0	0	0	0	111.8	W451 Y465 S484 S488	W451-S486 WeakPolarHBondContact CZ2-O 3.5Å; Y465-S486 WeakPolarHBondContact CD2-O 3.31Å; S484-S486 PolarHBondContact O-N 2.81Å; S484-S486 PolarHBondContact OG-N 3.47Å; S484-S486 PolarHBondContact OG-O 2.84Å; S484-S486 PolarHBondContact OG-OG 3.03Å; S486-S488 PolarHBondContact O-N 2.94Å; S486-S488 PolarHBondContact OG-N 3.38Å; S486-S488 PolarHBondContact OG-O 3.5Å; S486-S488 VanDerWaalsContact OG-O 3.13Å
487	C	88.7	Confident	86	Confident	47 Å²	47	72.1 Å²	72.1	32%	0.318	40%	0.402	S	S	.	.	S	Bend	trans	-76.5	22	177.5	-59.5	0	0	0	0	114	S450 W451	S450-C487 WeakPolarHBondContact CA-O 3.4Å; W451-C487 PolarHBondContact N-O 2.78Å; W451-C487 WeakPolarHBondContact O-CB 3.04Å
488	S	89.1	Confident	86.5	Confident	56 Å²	56	72.9 Å²	72.9	39%	0.392	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	155	176.1	62.2	0	0	0	0	111.9	L449 S484 S486	L449-S488 CarbonylContact O-C 3.55Å; L449-S488 WeakPolarHBondContact O-CA 3.32Å; L449-S488 WeakPolarHBondContact O-CB 3.05Å; S484-S488 WeakPolarHBondContact CB-O 3.27Å; S484-S488 PolarHBondContact OG-O 3.4Å; S486-S488 PolarHBondContact O-N 2.94Å; S486-S488 PolarHBondContact OG-N 3.38Å; S486-S488 PolarHBondContact OG-O 3.5Å; S486-S488 VanDerWaalsContact OG-O 3.13Å
489	L	92.8	Very high	87.2	Confident	33 Å²	33	74.2 Å²	74.2	17%	0.173	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	142.4	173.8	-179.8	65.2	0	0	0	110.7	L449 W451 L467 R482 L491	L449-L489 PolarHBondContact N-O 2.82Å; L449-L489 PolarHBondContact O-N 3.49Å; W451-L489 HydrophobicContact CH2-CB 3.83Å; W451-L489 HydrophobicContact CZ3-CB 4.18Å; L467-L489 HydrophobicContact CB-CD2 4.46Å; L467-L489 HydrophobicContact CD1-CB 4.26Å; L467-L489 HydrophobicContact CD1-CD2 3.8Å; L467-L489 HydrophobicContact CD2-CB 4.42Å; L467-L489 HydrophobicContact CD2-CD2 4.25Å; L467-L489 HydrophobicContact CG-CD2 4.36Å; R482-L489 HydrophobicContact CB-CD2 3.46Å; R482-L489 VanDerWaalsContact CB-CD2 3.46Å; R482-L489 HydrophobicContact CG-CD2 4.25Å; L489-L491 HydrophobicContact CD2-CD2 3.73Å; L489-L491 HydrophobicContact CG-CD2 4.32Å
490	V	91.3	Very high	87.6	Confident	76 Å²	76	71.6 Å²	71.6	46%	0.461	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	116	167.6	-171.7	0	0	0	0	109.4	L447 T492	L447-V490 CarbonylContact O-C 3.59Å; L447-V490 WeakPolarHBondContact O-CA 3.4Å; V490-T492 HydrophobicContact CG1-CG2 4.03Å
491	L	90.9	Very high	88	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.01	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	123.4	169.3	-58.8	179.5	0	0	0	108.5	S446 L447 L449 F469 R482 L489 L494 V502	S446-L491 CarbonylContact C-O 3.6Å; S446-L491 WeakPolarHBondContact CA-O 3.42Å; S446-L491 WeakPolarHBondContact CB-O 3.43Å; L447-L491 PolarHBondContact N-O 3.12Å; L447-L491 PolarHBondContact O-N 3.49Å; L449-L491 HydrophobicContact CD1-CD1 3.89Å; L449-L491 HydrophobicContact CD1-CG 4.43Å; F469-L491 HydrophobicContact CB-CD1 4.15Å; F469-L491 HydrophobicContact CD1-CD1 3.87Å; F469-L491 HydrophobicContact CD1-CD2 3.86Å; F469-L491 HydrophobicContact CD1-CG 4.5Å; F469-L491 HydrophobicContact CD2-CD1 4.38Å; F469-L491 HydrophobicContact CE1-CD1 4.4Å; F469-L491 HydrophobicContact CE1-CD2 3.77Å; F469-L491 HydrophobicContact CG-CD1 3.87Å; F469-L491 HydrophobicContact CZ-CD2 4.48Å; R482-L491 HydrophobicContact CB-CD2 4.37Å; R482-L491 HydrophobicContact CG-CD2 4Å; L489-L491 HydrophobicContact CD2-CD2 3.73Å; L489-L491 HydrophobicContact CG-CD2 4.32Å; L491-L494 HydrophobicContact CB-CD1 3.99Å; L491-L494 HydrophobicContact CB-CD2 4.46Å; L491-L494 HydrophobicContact CB-CG 4.4Å; L491-V502 HydrophobicContact CD1-CG2 4.48Å
492	T	88.1	Confident	88.2	Confident	89 Å²	89	64.2 Å²	64.2	55%	0.546	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	160.7	-179.3	54.6	0	0	0	0	111.3	V490	V490-T492 HydrophobicContact CG1-CG2 4.03Å
493	G	82.9	Confident	88.4	Confident	73 Å²	73	60 Å²	60	75%	0.753	34%	0.34	S	S	*	.	S	Bend	trans	78.6	18.8	-178.9	0	0	0	0	0	114.1	S445	S445-G493 PolarHBondContact O-N 3.3Å; S445-G493 VanDerWaalsContact O-N 3.08Å
494	L	88.1	Confident	88.5	Confident	10 Å²	10	57.4 Å²	57.4	5%	0.052	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-77	153.7	-179.9	-58.6	-178	0	0	0	111.6	S445 L447 F469 L491 Y500 T523	S445-L494 WeakPolarHBondContact CA-O 3.23Å; S445-L494 PolarHBondContact O-N 3.35Å; L447-L494 HydrophobicContact CB-CD1 3.87Å; L447-L494 HydrophobicContact CD1-CD1 3.66Å; L447-L494 HydrophobicContact CG-CD1 3.61Å; F469-L494 HydrophobicContact CD2-CD2 4.03Å; F469-L494 HydrophobicContact CE2-CD2 3.61Å; F469-L494 HydrophobicContact CZ-CD2 4.42Å; L491-L494 HydrophobicContact CB-CD1 3.99Å; L491-L494 HydrophobicContact CB-CD2 4.46Å; L491-L494 HydrophobicContact CB-CG 4.4Å; L494-Y500 HydrophobicContact CB-CE2 3.9Å; L494-Y500 HydrophobicContact CD1-CD2 4.39Å; L494-Y500 HydrophobicContact CD1-CE2 4.38Å; L494-Y500 HydrophobicContact CD2-CD1 4.36Å; L494-Y500 HydrophobicContact CD2-CE1 3.9Å; L494-Y500 HydrophobicContact CD2-CE2 4.2Å; L494-Y500 HydrophobicContact CG-CE2 4.39Å; L494-T523 HydrophobicContact CB-CG2 3.9Å; L494-T523 HydrophobicContact CD1-CG2 4.13Å
495	R	84.9	Confident	88.5	Confident	184 Å²	184	59.5 Å²	59.5	69%	0.694	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-69.1	142.5	175.3	-63.3	-176.7	-174.7	-164.9	3.2	110.3	T498 Y500 T523	R495-T498 HydrophobicContact CB-CG2 4.33Å; R495-T498 WeakPolarHBondContact CB-OG1 3.42Å; R495-T498 WeakPolarHBondContact O-CB 3.31Å; R495-Y500 PolarHBondContact N-OH 3.32Å; R495-T523 PolarHBondContact O-OG1 3.1Å
496	R	84.5	Confident	88.4	Confident	143 Å²	143	54 Å²	54	54%	0.54	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	150.4	178.8	-54.3	-169.5	-173.7	-177.2	1.5	111.6	E444 T498 D526	E444-R496 HydrophobicContact CB-CG 4.36Å; E444-R496 VanDerWaalsContact O-CA 3.27Å; E444-R496 WeakPolarHBondContact O-CA 3.44Å; E444-R496 WeakPolarHBondContact O-CG 3.01Å; E444-R496 IonicContact OE2-NH1 2.68Å; R496-T498 PolarHBondContact O-N 2.98Å; R496-T498 PolarHBondContact O-OG1 3.22Å; R496-D526 IonicContact NH1-OD1 2.65Å; R496-D526 PolarHBondContact NH1-OD1 2.83Å; R496-D526 IonicContact NH1-OD2 2.7Å; R496-D526 PolarHBondContact NH1-OD2 2.75Å; R496-D526 VanDerWaalsContact NH1-OD2 3.11Å
497	A	82.1	Confident	88	Confident	70 Å²	70	53.8 Å²	53.8	58%	0.579	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.3	30.3	179.9	0	0	0	0	0	115.4	T523 L524 P525	A497-T523 PolarHBondContact N-OG1 2.94Å; A497-L524 PolarHBondContact N-O 2.97Å; A497-P525 HydrophobicContact CB-CB 4.44Å
498	T	87.6	Confident	87.4	Confident	33 Å²	33	51.7 Å²	51.7	20%	0.202	27%	0.272	C	S	.	.			trans	-112.4	136.3	-170.5	-62.5	0	0	0	0	110.7	P471 R495 R496 Y500 S522 T523	P471-T498 HydrophobicContact CB-CG2 4.45Å; R495-T498 HydrophobicContact CB-CG2 4.33Å; R495-T498 WeakPolarHBondContact CB-OG1 3.42Å; R495-T498 WeakPolarHBondContact O-CB 3.31Å; R496-T498 PolarHBondContact O-N 2.98Å; R496-T498 PolarHBondContact O-OG1 3.22Å; T498-Y500 HydrophobicContact CG2-CD2 4.05Å; T498-Y500 HydrophobicContact CG2-CE2 3.56Å; T498-S522 WeakPolarHBondContact O-CA 3.48Å; T498-T523 PolarHBondContact N-OG1 2.97Å; T498-T523 PolarHBondContact O-N 2.87Å; T498-T523 PolarHBondContact O-OG1 2.94Å
499	R	90.9	Very high	86.3	Confident	138 Å²	138	56.8 Å²	56.8	52%	0.521	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	128.2	175.5	-166.3	169	-172.4	-169.9	1.6	110.4	L472 F521 S522	L472-R499 HydrophobicContact CB-CB 4.41Å; L472-R499 HydrophobicContact CB-CG 4.41Å; L472-R499 WeakPolarHBondContact CB-O 3.41Å; L472-R499 HydrophobicContact CD2-CG 3.97Å; L472-R499 PolarHBondContact N-O 3.1Å; R499-F521 CarbonylContact C-O 3.46Å; R499-F521 WeakPolarHBondContact CA-O 3.03Å; R499-S522 WeakPolarHBondContact CG-OG 3.26Å
500	Y	90.9	Very high	84.6	Confident	8 Å²	8	58.7 Å²	58.7	3%	0.031	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.3	-178.9	-76.6	-94.8	0	0	0	111.2	F469 R470 P471 L494 R495 T498 S520 F521	F469-Y500 AromaticContact CD2-CD1 3.97Å; F469-Y500 HydrophobicContact CD2-CD1 3.97Å; F469-Y500 HydrophobicContact CD2-CE1 4.22Å; R470-Y500 VanDerWaalsContact C-CD1 3.43Å; R470-Y500 CarbonylContact O-C 3.58Å; R470-Y500 WeakPolarHBondContact O-CA 3.32Å; R470-Y500 WeakPolarHBondContact O-CD1 3.34Å; P471-Y500 HydrophobicContact CB-CE1 4.46Å; P471-Y500 HydrophobicContact CG-CD1 4.47Å; P471-Y500 HydrophobicContact CG-CE1 3.89Å; L494-Y500 HydrophobicContact CB-CE2 3.9Å; L494-Y500 HydrophobicContact CD1-CD2 4.39Å; L494-Y500 HydrophobicContact CD1-CE2 4.38Å; L494-Y500 HydrophobicContact CD2-CD1 4.36Å; L494-Y500 HydrophobicContact CD2-CE1 3.9Å; L494-Y500 HydrophobicContact CD2-CE2 4.2Å; L494-Y500 HydrophobicContact CG-CE2 4.39Å; R495-Y500 PolarHBondContact N-OH 3.32Å; T498-Y500 HydrophobicContact CG2-CD2 4.05Å; T498-Y500 HydrophobicContact CG2-CE2 3.56Å; Y500-S520 WeakPolarHBondContact O-CA 3.29Å; Y500-F521 PolarHBondContact N-O 2.9Å; Y500-F521 PolarHBondContact O-N 2.99Å
501	Q	92	Very high	83.3	Confident	38 Å²	38	56.2 Å²	56.2	18%	0.178	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	130.6	167.7	-168.1	177.6	31.2	0	0	108.5	F469 R470 L472 W479 A518 G519	F469-Q501 WeakPolarHBondContact CA-O 3.32Å; R470-Q501 HydrophobicContact CG-CB 4.34Å; R470-Q501 PolarHBondContact N-O 3.03Å; R470-Q501 VanDerWaalsContact N-O 3.08Å; R470-Q501 VanDerWaalsContact NE-OE1 3.08Å; R470-Q501 PolarHBondContact O-N 3.32Å; L472-Q501 HydrophobicContact CD1-CB 4.01Å; L472-Q501 HydrophobicContact CD1-CG 4.43Å; W479-Q501 HydrophobicContact CH2-CB 4.43Å; W479-Q501 HydrophobicContact CH2-CG 4.07Å; Q501-A518 HydrophobicContact CG-CB 3.99Å; Q501-G519 CarbonylContact C-O 3.6Å; Q501-G519 WeakPolarHBondContact CA-O 3.46Å
502	V	91.8	Very high	82.3	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	139	-176.1	-168.3	0	0	0	0	111.5	L449 L467 R468 F469 L491 G519 F521	L449-V502 HydrophobicContact CD1-CB 4.3Å; L449-V502 HydrophobicContact CD1-CG1 3.72Å; L449-V502 HydrophobicContact CD1-CG2 4.17Å; L467-V502 HydrophobicContact CD2-CG1 4.32Å; R468-V502 WeakPolarHBondContact O-CA 3.18Å; F469-V502 HydrophobicContact CB-CB 4.45Å; F469-V502 HydrophobicContact CB-CG1 4.29Å; F469-V502 HydrophobicContact CB-CG2 3.9Å; L491-V502 HydrophobicContact CD1-CG2 4.48Å; V502-G519 PolarHBondContact N-O 2.59Å; V502-G519 PolarHBondContact O-N 2.99Å; V502-F521 HydrophobicContact CB-CD2 4.23Å; V502-F521 HydrophobicContact CB-CE2 4.3Å; V502-F521 HydrophobicContact CG2-CD2 3.95Å
503	Q	91.4	Very high	81.5	Confident	27 Å²	27	56.2 Å²	56.2	13%	0.126	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	151.1	173.8	-70.1	177.8	-71.1	0	0	111	L467 R468 F515 S516 A518	L467-Q503 CarbonylContact C-O 3.57Å; L467-Q503 WeakPolarHBondContact CA-O 3.3Å; R468-Q503 HydrophobicContact CG-CB 4.04Å; R468-Q503 VanDerWaalsContact CZ-OE1 3.3Å; R468-Q503 PolarHBondContact N-O 2.93Å; R468-Q503 PolarHBondContact O-N 3.02Å; Q503-F515 HydrophobicContact CB-CB 4.19Å; Q503-F515 HydrophobicContact CB-CD1 3.94Å; Q503-F515 HydrophobicContact CB-CG 4.39Å; Q503-S516 WeakPolarHBondContact CG-O 3.42Å; Q503-S516 PolarHBondContact NE2-O 3.07Å; Q503-A518 HydrophobicContact CG-CB 3.95Å
504	V	89.8	Confident	81.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142.2	-178.6	-167.6	0	0	0	0	110.4	V434 L437 W451 Y465 Q466 L467 S516	V434-V504 HydrophobicContact CB-CB 4.46Å; V434-V504 HydrophobicContact CG1-CB 4.32Å; V434-V504 HydrophobicContact CG1-CG1 4.33Å; V434-V504 HydrophobicContact CG2-CG1 4.48Å; L437-V504 HydrophobicContact CD1-CG2 3.68Å; L437-V504 HydrophobicContact CD2-CG2 4.02Å; L437-V504 HydrophobicContact CG-CG2 4.39Å; W451-V504 HydrophobicContact CD2-CG1 4.09Å; W451-V504 HydrophobicContact CD2-CG2 4.27Å; W451-V504 HydrophobicContact CE3-CG2 4.16Å; W451-V504 HydrophobicContact CG-CG1 4.43Å; W451-V504 HydrophobicContact CZ2-CG1 4.25Å; Y465-V504 HydrophobicContact CD1-CG1 4.32Å; Q466-V504 WeakPolarHBondContact O-CA 3.49Å; L467-V504 HydrophobicContact CD1-CG1 4.18Å; L467-V504 HydrophobicContact CD2-CG2 3.78Å; L467-V504 HydrophobicContact CG-CB 4.32Å; L467-V504 HydrophobicContact CG-CG1 4.01Å; L467-V504 HydrophobicContact CG-CG2 3.74Å; V504-S516 PolarHBondContact N-OG 3.09Å; V504-S516 WeakPolarHBondContact O-CB 3.32Å; V504-S516 PolarHBondContact O-N 2.83Å
505	R	87.3	Confident	80.8	Confident	53 Å²	53	57.5 Å²	57.5	20%	0.2	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	154.7	167.1	63.9	-178.1	-178.9	165.6	0.2	110.9	Y465 Q466 Y512 G513 F515	Y465-R505 CarbonylContact C-O 3.57Å; Y465-R505 WeakPolarHBondContact CA-O 3.43Å; Q466-R505 HydrophobicContact CB-CG 4.15Å; Q466-R505 PolarHBondContact N-O 3.43Å; Q466-R505 PolarHBondContact O-N 2.92Å; Q466-R505 VanDerWaalsContact OE1-NE 3.1Å; R505-Y512 HydrophobicContact CG-CD1 4.14Å; R505-Y512 VanDerWaalsContact CZ-CB 3.46Å; R505-Y512 VanDerWaalsContact CZ-CG 3.4Å; R505-Y512 VanDerWaalsContact NH1-CB 3.29Å; R505-G513 WeakPolarHBondContact CD-O 3.02Å; R505-F515 HydrophobicContact CB-CD1 3.93Å; R505-F515 HydrophobicContact CB-CE1 4.15Å; R505-F515 HydrophobicContact CB-CG 4.3Å; R505-F515 VanDerWaalsContact CD-CZ 3.43Å; R505-F515 HydrophobicContact CG-CD1 3.98Å; R505-F515 HydrophobicContact CG-CE1 3.66Å; R505-F515 HydrophobicContact CG-CZ 3.98Å
506	A	83.8	Confident	80.8	Confident	2 Å²	2	49 Å²	49	2%	0.017	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	150.4	173.3	0	0	0	0	0	110.6	V434 P454 V462 Y465 G513	V434-A506 HydrophobicContact CG2-CB 3.9Å; P454-A506 HydrophobicContact CG-CB 4.02Å; V462-A506 HydrophobicContact CG1-CB 3.81Å; V462-A506 HydrophobicContact CG2-CB 4.03Å; Y465-A506 HydrophobicContact CD1-CB 4.08Å; Y465-A506 HydrophobicContact CE1-CB 3.93Å; A506-G513 PolarHBondContact O-N 3Å
507	Q	80.3	Confident	80.7	Confident	47 Å²	47	45.2 Å²	45.2	22%	0.22	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	133.5	169.6	-169.1	176.1	-5.1	0	0	110.5	V462 L463 E464 G511 Y512	V462-Q507 CarbonylContact C-O 3.48Å; V462-Q507 WeakPolarHBondContact CA-O 3.4Å; V462-Q507 WeakPolarHBondContact CG1-O 3.19Å; L463-Q507 PolarHBondContact N-O 3.1Å; E464-Q507 VanDerWaalsContact CD-OE1 3.26Å; E464-Q507 HydrophobicContact CG-CB 3.79Å; E464-Q507 HydrophobicContact CG-CG 4.49Å; E464-Q507 PolarHBondContact O-N 3.47Å; E464-Q507 PolarHBondContact OE1-OE1 3.01Å; Q507-G511 WeakPolarHBondContact CA-O 3.07Å; Q507-Y512 HydrophobicContact CB-CD1 3.64Å; Q507-Y512 HydrophobicContact CB-CE1 3.67Å; Q507-Y512 HydrophobicContact CB-CG 4.44Å; Q507-Y512 HydrophobicContact CG-CD1 3.93Å; Q507-Y512 HydrophobicContact CG-CE1 3.94Å; Q507-Y512 HydrophobicContact CG-CG 4.31Å; Q507-Y512 PolarHBondContact OE1-OH 3.47Å; Q507-Y512 VanDerWaalsContact OE1-OH 3.1Å
508	T	74.4	Confident	80.8	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.018	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	-178.1	166.9	67	0	0	0	0	109.4	P431 L456 A510 G511	P431-T508 HydrophobicContact CB-CG2 4.18Å; P431-T508 HydrophobicContact CG-CG2 4.17Å; L456-T508 HydrophobicContact CD1-CG2 3.86Å; T508-A510 PolarHBondContact O-N 3.42Å; T508-A510 VanDerWaalsContact O-N 3.14Å; T508-A510 PolarHBondContact OG1-N 2.88Å; T508-G511 PolarHBondContact N-O 3.1Å; T508-G511 PolarHBondContact O-N 2.69Å
509	Q	66.4	Low	80.7	Confident	164 Å²	164	43.3 Å²	43.3	77%	0.766	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.4	174.3	-169.4	174.4	-2.1	0	0	113.3	P460	P460-Q509 HydrophobicContact CG-CB 4.17Å
510	A	57	Low	80.7	Confident	73 Å²	73	38.8 Å²	38.8	60%	0.603	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-8.1	174.7	0	0	0	0	0	113.9	T508	T508-A510 PolarHBondContact O-N 3.42Å; T508-A510 VanDerWaalsContact O-N 3.14Å; T508-A510 PolarHBondContact OG1-N 2.88Å
511	G	65.4	Low	80.7	Confident	23 Å²	23	39.8 Å²	39.8	24%	0.237	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	117.4	-161.7	-179.2	0	0	0	0	0	113.7	Q507 T508	Q507-G511 WeakPolarHBondContact CA-O 3.07Å; T508-G511 PolarHBondContact N-O 3.1Å; T508-G511 PolarHBondContact O-N 2.69Å
512	Y	69.3	Low	80.5	Confident	85 Å²	85	40.1 Å²	40.1	33%	0.333	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	131.6	-175.8	-73.1	-71.4	0	0	0	112.4	E464 Q466 R505 Q507	E464-Y512 PolarHBondContact OE1-OH 2.87Å; Q466-Y512 HydrophobicContact CB-CD1 4.42Å; Q466-Y512 HydrophobicContact CB-CE1 3.81Å; Q466-Y512 PolarHBondContact NE2-OH 3.45Å; Q466-Y512 VanDerWaalsContact NE2-OH 3.1Å; R505-Y512 HydrophobicContact CG-CD1 4.14Å; R505-Y512 VanDerWaalsContact CZ-CB 3.46Å; R505-Y512 VanDerWaalsContact CZ-CG 3.4Å; R505-Y512 VanDerWaalsContact NH1-CB 3.29Å; Q507-Y512 HydrophobicContact CB-CD1 3.64Å; Q507-Y512 HydrophobicContact CB-CE1 3.67Å; Q507-Y512 HydrophobicContact CB-CG 4.44Å; Q507-Y512 HydrophobicContact CG-CD1 3.93Å; Q507-Y512 HydrophobicContact CG-CE1 3.94Å; Q507-Y512 HydrophobicContact CG-CG 4.31Å; Q507-Y512 PolarHBondContact OE1-OH 3.47Å; Q507-Y512 VanDerWaalsContact OE1-OH 3.1Å
513	G	71.7	Confident	80.3	Confident	6 Å²	6	40.5 Å²	40.5	6%	0.062	25%	0.251	C	S	.	.			trans	-73.1	-178.8	170	0	0	0	0	0	114.2	R505 A506	R505-G513 WeakPolarHBondContact CD-O 3.02Å; A506-G513 PolarHBondContact O-N 3Å
514	S	74.4	Confident	79.9	Confident	66 Å²	66	43 Å²	43	46%	0.462	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-69.2	151.8	173.7	54.1	0	0	0	0	112.3	P433	P433-S514 WeakPolarHBondContact CB-OG 3.32Å
515	F	80.9	Confident	79	Confident	44 Å²	44	47.5 Å²	47.5	19%	0.193	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-72.9	144	176.7	-78.4	-77.3	0	0	0	111.7	R468 Y481 Q503 R505	R468-F515 HydrophobicContact CB-CE1 4.23Å; R468-F515 HydrophobicContact CG-CD1 4.1Å; R468-F515 HydrophobicContact CG-CE1 3.71Å; R468-F515 HydrophobicContact CG-CZ 4.12Å; Y481-F515 HydrophobicContact CE1-CZ 4.16Å; Q503-F515 HydrophobicContact CB-CB 4.19Å; Q503-F515 HydrophobicContact CB-CD1 3.94Å; Q503-F515 HydrophobicContact CB-CG 4.39Å; R505-F515 HydrophobicContact CB-CD1 3.93Å; R505-F515 HydrophobicContact CB-CE1 4.15Å; R505-F515 HydrophobicContact CB-CG 4.3Å; R505-F515 VanDerWaalsContact CD-CZ 3.43Å; R505-F515 HydrophobicContact CG-CD1 3.98Å; R505-F515 HydrophobicContact CG-CE1 3.66Å; R505-F515 HydrophobicContact CG-CZ 3.98Å
516	S	85.8	Confident	77.8	Confident	5 Å²	5	49.2 Å²	49.2	4%	0.035	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-55.7	165.2	171.3	72.6	0	0	0	0	112.8	V434 Q503 V504	V434-S516 WeakPolarHBondContact O-CB 3.5Å; Q503-S516 WeakPolarHBondContact CG-O 3.42Å; Q503-S516 PolarHBondContact NE2-O 3.07Å; V504-S516 PolarHBondContact N-OG 3.09Å; V504-S516 WeakPolarHBondContact O-CB 3.32Å; V504-S516 PolarHBondContact O-N 2.83Å
517	G	81.1	Confident	76.2	Confident	64 Å²	64	52.7 Å²	52.7	66%	0.66	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-51.6	149.4	159.9	0	0	0	0	0	111.7	G519	G517-G519 PolarHBondContact O-N 3.44Å
518	A	84.4	Confident	74.6	Confident	49 Å²	49	57.4 Å²	57.4	41%	0.405	38%	0.376	S	S	.	.			trans	-78.2	108.7	-174.6	0	0	0	0	0	112.2	Q501 Q503	Q501-A518 HydrophobicContact CG-CB 3.99Å; Q503-A518 HydrophobicContact CG-CB 3.95Å
519	G	85.7	Confident	72.6	Confident	14 Å²	14	60.6 Å²	60.6	14%	0.144	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	151.1	168	0	0	0	0	0	111.2	Q501 V502 G517	Q501-G519 CarbonylContact C-O 3.6Å; Q501-G519 WeakPolarHBondContact CA-O 3.46Å; V502-G519 PolarHBondContact N-O 2.59Å; V502-G519 PolarHBondContact O-N 2.99Å; G517-G519 PolarHBondContact O-N 3.44Å
520	S	90	Very high	71.8	Confident	44 Å²	44	59 Å²	59	31%	0.308	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	113.7	177.9	-68.3	0	0	0	0	110.7	Y500	Y500-S520 WeakPolarHBondContact O-CA 3.29Å
521	F	91.6	Very high	71.3	Confident	28 Å²	28	59.5 Å²	59.5	12%	0.123	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	147.2	-169.2	-52.6	-66	0	0	0	111.3	L437 R439 L447 L449 R499 Y500 V502	L437-F521 HydrophobicContact CD2-CE2 4.11Å; L437-F521 HydrophobicContact CD2-CZ 4.47Å; L437-F521 HydrophobicContact CG-CE2 4.04Å; L437-F521 HydrophobicContact CG-CZ 4.06Å; R439-F521 HydrophobicContact CB-CD1 3.76Å; R439-F521 HydrophobicContact CB-CE1 4.07Å; R439-F521 HydrophobicContact CB-CG 4.43Å; L447-F521 HydrophobicContact CD1-CB 3.91Å; L447-F521 HydrophobicContact CD2-CB 4.41Å; L449-F521 HydrophobicContact CD1-CD2 4.39Å; L449-F521 HydrophobicContact CD2-CD2 3.62Å; L449-F521 HydrophobicContact CD2-CE2 3.84Å; L449-F521 HydrophobicContact CD2-CG 3.98Å; L449-F521 HydrophobicContact CD2-CZ 4.38Å; R499-F521 CarbonylContact C-O 3.46Å; R499-F521 WeakPolarHBondContact CA-O 3.03Å; Y500-F521 PolarHBondContact N-O 2.9Å; Y500-F521 PolarHBondContact O-N 2.99Å; V502-F521 HydrophobicContact CB-CD2 4.23Å; V502-F521 HydrophobicContact CB-CE2 4.3Å; V502-F521 HydrophobicContact CG2-CD2 3.95Å
522	S	88.4	Confident	70.3	Confident	46 Å²	46	66.5 Å²	66.5	32%	0.322	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	140.5	-176	-52.2	0	0	0	0	112.9	L447 T498 R499	L447-S522 WeakPolarHBondContact CD2-O 3.34Å; T498-S522 WeakPolarHBondContact O-CA 3.48Å; R499-S522 WeakPolarHBondContact CG-OG 3.26Å
523	T	87.7	Confident	69.3	Low	7 Å²	7	68.1 Å²	68.1	4%	0.043	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-72	158.3	166.6	47.1	0	0	0	0	111.5	S443 L447 L494 R495 A497 T498	S443-T523 WeakPolarHBondContact O-CA 3.27Å; S443-T523 WeakPolarHBondContact O-CB 3.37Å; L447-T523 HydrophobicContact CD2-CG2 4.45Å; L447-T523 HydrophobicContact CG-CG2 4.15Å; L494-T523 HydrophobicContact CB-CG2 3.9Å; L494-T523 HydrophobicContact CD1-CG2 4.13Å; R495-T523 PolarHBondContact O-OG1 3.1Å; A497-T523 PolarHBondContact N-OG1 2.94Å; T498-T523 PolarHBondContact N-OG1 2.97Å; T498-T523 PolarHBondContact O-N 2.87Å; T498-T523 PolarHBondContact O-OG1 2.94Å
524	L	82.4	Confident	68.1	Low	81 Å²	81	75.7 Å²	75.7	42%	0.424	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-80.3	154.9	-179.3	-64.9	175.4	0	0	0	112.1	A442 S443 E444 A497	A442-L524 HydrophobicContact CB-CG 4.23Å; A442-L524 WeakPolarHBondContact O-CD1 3.47Å; S443-L524 PolarHBondContact O-N 3.45Å; E444-L524 WeakPolarHBondContact CA-O 3.44Å; A497-L524 PolarHBondContact N-O 2.97Å
525	P	71.6	Confident	67	Low	93 Å²	93	78.6 Å²	78.6	60%	0.604	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-86.1	155.3	159.1	35.3	-31.7	0	0	0	111.3	A497	A497-P525 HydrophobicContact CB-CB 4.44Å
526	D	62.1	Low	65.7	Low	90 Å²	90	81.7 Å²	81.7	48%	0.481	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-52.1	136.9	-174.6	-58.7	15.4	0	0	0	113.7	R496	R496-D526 IonicContact NH1-OD1 2.65Å; R496-D526 PolarHBondContact NH1-OD1 2.83Å; R496-D526 IonicContact NH1-OD2 2.7Å; R496-D526 PolarHBondContact NH1-OD2 2.75Å; R496-D526 VanDerWaalsContact NH1-OD2 3.11Å
527	G	49.9	Very low	63.9	Low	75 Å²	75	87.7 Å²	87.7	77%	0.773	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-71.9	138.3	177.9	0	0	0	0	0	113.2
528	T	45.5	Very low	62.7	Low	146 Å²	146	88.2 Å²	88.2	90%	0.896	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-95.8	137.9	-165.2	50.7	0	0	0	0	116
529	G	33.2	Very low	61.4	Low	69 Å²	69	88.4 Å²	88.4	71%	0.711	56%	0.556	S	S	*	*			trans	160.3	146.1	152	0	0	0	0	0	114.6
530	P	49	Very low	60.2	Low	130 Å²	130	91.6 Å²	91.6	84%	0.844	57%	0.572	S	S	*	*	S	Bend		-109.4	-177.5	-52.9	38.5	-30.1	0	0	0	111.6
531	A	47.7	Very low	58.7	Low	84 Å²	84	94.9 Å²	94.9	69%	0.694	59%	0.585	S	S	*	*	S	Bend	trans	67.2	89.5	172.8	0	0	0	0	0	117.6
532	H	42.8	Very low	57.5	Low	171 Å²	171	97.8 Å²	97.8	79%	0.792	61%	0.605	S	S	*	*				-167.8	30.6	127.5	-101.5	-61.3	0	0	0	113.3	Q534	H532-Q534 PolarHBondContact O-N 2.87Å; H532-Q534 VanDerWaalsContact O-N 3.11Å
533	S	49.7	Very low	56.4	Low	118 Å²	118	99.2 Å²	99.2	83%	0.825	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	53.4	-175.2	55.9	0	0	0	0	114.3
534	Q	46.4	Very low	55.6	Low	166 Å²	166	102.5 Å²	102.5	78%	0.776	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.6	-9.4	170.7	-80.7	-158.8	-20.5	0	0	116.7	H532 T538	H532-Q534 PolarHBondContact O-N 2.87Å; H532-Q534 VanDerWaalsContact O-N 3.11Å; Q534-T538 PolarHBondContact O-OG1 3.19Å
535	L	50.9	Low	55	Low	126 Å²	126	100.9 Å²	100.9	66%	0.66	63%	0.631	S	S	*	*	H	α-helix	trans	-96.2	-25.7	-177.4	-82.3	158.7	0	0	0	115.1	T538 A539	L535-T538 PolarHBondContact O-OG1 2.96Å; L535-T538 VanDerWaalsContact O-OG1 3.1Å; L535-A539 WeakPolarHBondContact O-CB 3.21Å; L535-A539 PolarHBondContact O-N 2.88Å
536	V	53.9	Low	55.1	Low	110 Å²	110	99.8 Å²	99.8	67%	0.667	62%	0.622	S	S	*	*	H	α-helix	trans	-81.9	-39.6	-178.5	-178.9	0	0	0	0	112	T538 A539 V540	V536-T538 VanDerWaalsContact C-N 3.33Å; V536-T538 PolarHBondContact O-N 3.06Å; V536-A539 PolarHBondContact O-N 2.03Å; V536-V540 HydrophobicContact CG1-CG2 4.39Å; V536-V540 WeakPolarHBondContact O-CG2 3.24Å; V536-V540 PolarHBondContact O-N 2.82Å
537	L	48.4	Very low	55.7	Low	131 Å²	131	101.3 Å²	101.3	69%	0.686	63%	0.63	S	S	*	*	H	α-helix	trans	-66.3	-37.3	-179.3	-157.8	76.8	0	0	0	111.7	L541	L537-L541 HydrophobicContact CG-CD1 4.29Å; L537-L541 WeakPolarHBondContact O-CB 3.24Å; L537-L541 VanDerWaalsContact O-CG 3.26Å; L537-L541 WeakPolarHBondContact O-CG 3.38Å; L537-L541 PolarHBondContact O-N 3.04Å
538	T	54.8	Low	57	Low	75 Å²	75	102.8 Å²	102.8	46%	0.46	62%	0.62	S	S	.	*	H	α-helix	trans	-68.1	-43.3	174.5	45.4	0	0	0	0	111.6	Q534 L535 V536 V540 L541 V542	Q534-T538 PolarHBondContact O-OG1 3.19Å; L535-T538 PolarHBondContact O-OG1 2.96Å; L535-T538 VanDerWaalsContact O-OG1 3.1Å; V536-T538 VanDerWaalsContact C-N 3.33Å; V536-T538 PolarHBondContact O-N 3.06Å; T538-V540 PolarHBondContact O-N 2.82Å; T538-L541 PolarHBondContact O-N 2.92Å; T538-V542 WeakPolarHBondContact O-CB 3.04Å; T538-V542 VanDerWaalsContact O-CG2 3.23Å; T538-V542 WeakPolarHBondContact O-CG2 3.47Å; T538-V542 PolarHBondContact O-N 3.46Å
539	A	56.9	Low	58.5	Low	53 Å²	53	101.3 Å²	101.3	44%	0.438	61%	0.605	S	S	.	*	H	α-helix	trans	-62.5	-40.1	176	0	0	0	0	0	113.4	L535 V536 T543	L535-A539 WeakPolarHBondContact O-CB 3.21Å; L535-A539 PolarHBondContact O-N 2.88Å; V536-A539 PolarHBondContact O-N 2.03Å; A539-T543 WeakPolarHBondContact O-CB 3.16Å; A539-T543 WeakPolarHBondContact O-CG2 3.42Å; A539-T543 PolarHBondContact O-N 2.68Å; A539-T543 PolarHBondContact O-OG1 3.34Å
540	V	60.9	Low	60.7	Low	80 Å²	80	102.3 Å²	102.3	49%	0.485	60%	0.597	S	S	.	*	H	α-helix	trans	-71.2	-41.7	177.4	175.2	0	0	0	0	111.3	V536 T538 T543 V544	V536-V540 HydrophobicContact CG1-CG2 4.39Å; V536-V540 WeakPolarHBondContact O-CG2 3.24Å; V536-V540 PolarHBondContact O-N 2.82Å; T538-V540 PolarHBondContact O-N 2.82Å; V540-T543 WeakPolarHBondContact CA-OG1 3.37Å; V540-T543 PolarHBondContact O-N 2.67Å; V540-T543 PolarHBondContact O-OG1 2.78Å; V540-T543 VanDerWaalsContact O-OG1 3.12Å; V540-V544 HydrophobicContact CG1-CG2 4.45Å; V540-V544 WeakPolarHBondContact O-CB 3.18Å; V540-V544 WeakPolarHBondContact O-CG2 3Å; V540-V544 PolarHBondContact O-N 2.95Å
541	L	58.8	Low	61.9	Low	113 Å²	113	98.6 Å²	98.6	59%	0.592	58%	0.578	S	S	*	*	H	α-helix	trans	-65.6	-38.6	175.6	-72.5	169.7	0	0	0	112.1	L537 T538 A545	L537-L541 HydrophobicContact CG-CD1 4.29Å; L537-L541 WeakPolarHBondContact O-CB 3.24Å; L537-L541 VanDerWaalsContact O-CG 3.26Å; L537-L541 WeakPolarHBondContact O-CG 3.38Å; L537-L541 PolarHBondContact O-N 3.04Å; T538-L541 PolarHBondContact O-N 2.92Å; L541-A545 WeakPolarHBondContact O-CB 3.3Å; L541-A545 PolarHBondContact O-N 2.82Å
542	V	66.9	Low	63.2	Low	89 Å²	89	98.8 Å²	98.8	54%	0.539	57%	0.571	S	S	.	*	H	α-helix	trans	-69.3	-38.7	176.5	170.2	0	0	0	0	112	T538 T546	T538-V542 WeakPolarHBondContact O-CB 3.04Å; T538-V542 VanDerWaalsContact O-CG2 3.23Å; T538-V542 WeakPolarHBondContact O-CG2 3.47Å; T538-V542 PolarHBondContact O-N 3.46Å; V542-T546 HydrophobicContact CG1-CG2 4.43Å; V542-T546 WeakPolarHBondContact O-CB 3.27Å; V542-T546 WeakPolarHBondContact O-CG2 3.43Å; V542-T546 PolarHBondContact O-N 3.35Å; V542-T546 PolarHBondContact O-OG1 3Å
543	T	64.5	Low	64.8	Low	77 Å²	77	93.6 Å²	93.6	47%	0.472	56%	0.557	S	S	.	*	H	α-helix	trans	-71.1	-40.2	177.2	47.5	0	0	0	0	112.3	A539 V540 T546 L547	A539-T543 WeakPolarHBondContact O-CB 3.16Å; A539-T543 WeakPolarHBondContact O-CG2 3.42Å; A539-T543 PolarHBondContact O-N 2.68Å; A539-T543 PolarHBondContact O-OG1 3.34Å; V540-T543 WeakPolarHBondContact CA-OG1 3.37Å; V540-T543 PolarHBondContact O-N 2.67Å; V540-T543 PolarHBondContact O-OG1 2.78Å; V540-T543 VanDerWaalsContact O-OG1 3.12Å; T543-T546 WeakPolarHBondContact CA-OG1 3.28Å; T543-T546 PolarHBondContact O-OG1 3.32Å; T543-T546 VanDerWaalsContact O-OG1 3.1Å; T543-L547 WeakPolarHBondContact O-CB 3.33Å; T543-L547 WeakPolarHBondContact O-CG 3.45Å; T543-L547 PolarHBondContact O-N 3.44Å
544	V	71.3	Confident	66	Low	75 Å²	75	91.5 Å²	91.5	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-67.2	-41.8	173.3	174.8	0	0	0	0	111.3	V540 L547 L548	V540-V544 HydrophobicContact CG1-CG2 4.45Å; V540-V544 WeakPolarHBondContact O-CB 3.18Å; V540-V544 WeakPolarHBondContact O-CG2 3Å; V540-V544 PolarHBondContact O-N 2.95Å; V544-L547 PolarHBondContact O-N 3.12Å; V544-L548 HydrophobicContact CG1-CD1 3.94Å; V544-L548 WeakPolarHBondContact O-CB 3.37Å; V544-L548 WeakPolarHBondContact O-CG 3.29Å; V544-L548 PolarHBondContact O-N 2.83Å
545	A	68.8	Low	67.1	Low	48 Å²	48	86 Å²	86	40%	0.397	52%	0.523	S	S	.	.	H	α-helix	trans	-65.4	-39.1	176.4	0	0	0	0	0	112.8	L541 L548 L549	L541-A545 WeakPolarHBondContact O-CB 3.3Å; L541-A545 PolarHBondContact O-N 2.82Å; A545-L548 PolarHBondContact O-N 3.44Å; A545-L549 VanDerWaalsContact O-CB 3.29Å; A545-L549 WeakPolarHBondContact O-CB 3.42Å; A545-L549 PolarHBondContact O-N 3.03Å
546	T	73.8	Confident	68.2	Low	69 Å²	69	81.7 Å²	81.7	42%	0.423	51%	0.509	S	S	.	.	H	α-helix	trans	-71.1	-38	176.1	46.8	0	0	0	0	112.2	V542 T543 L549 V550	V542-T546 HydrophobicContact CG1-CG2 4.43Å; V542-T546 WeakPolarHBondContact O-CB 3.27Å; V542-T546 WeakPolarHBondContact O-CG2 3.43Å; V542-T546 PolarHBondContact O-N 3.35Å; V542-T546 PolarHBondContact O-OG1 3Å; T543-T546 WeakPolarHBondContact CA-OG1 3.28Å; T543-T546 PolarHBondContact O-OG1 3.32Å; T543-T546 VanDerWaalsContact O-OG1 3.1Å; T546-L549 PolarHBondContact O-N 3.1Å; T546-V550 WeakPolarHBondContact O-CB 3.49Å; T546-V550 VanDerWaalsContact O-CG2 3.3Å; T546-V550 WeakPolarHBondContact O-CG2 3.45Å; T546-V550 PolarHBondContact O-N 3.35Å
547	L	75.9	Confident	69.2	Low	122 Å²	122	81.9 Å²	81.9	64%	0.639	50%	0.5	S	S	*	.	H	α-helix	trans	-64.1	-41.1	172.2	-75.1	168.8	0	0	0	112.1	T543 V544 V550 A551	T543-L547 WeakPolarHBondContact O-CB 3.33Å; T543-L547 WeakPolarHBondContact O-CG 3.45Å; T543-L547 PolarHBondContact O-N 3.44Å; V544-L547 PolarHBondContact O-N 3.12Å; L547-V550 PolarHBondContact O-N 3.1Å; L547-A551 VanDerWaalsContact O-CB 3.29Å; L547-A551 WeakPolarHBondContact O-CB 3.46Å; L547-A551 PolarHBondContact O-N 2.73Å
548	L	76.1	Confident	70.1	Confident	107 Å²	107	80 Å²	80	56%	0.56	49%	0.49	S	S	*	.	H	α-helix	trans	-68.3	-36.3	173.9	-72.5	170.8	0	0	0	112.5	V544 A545 T552	V544-L548 HydrophobicContact CG1-CD1 3.94Å; V544-L548 WeakPolarHBondContact O-CB 3.37Å; V544-L548 WeakPolarHBondContact O-CG 3.29Å; V544-L548 PolarHBondContact O-N 2.83Å; A545-L548 PolarHBondContact O-N 3.44Å; L548-T552 WeakPolarHBondContact O-CB 3.39Å; L548-T552 VanDerWaalsContact O-CG2 3.31Å; L548-T552 WeakPolarHBondContact O-CG2 3.5Å; L548-T552 PolarHBondContact O-N 2.75Å; L548-T552 PolarHBondContact O-OG1 3.49Å
549	L	77.4	Confident	70.7	Confident	114 Å²	114	80.1 Å²	80.1	60%	0.597	49%	0.493	S	S	*	.	H	α-helix	trans	-66.5	-40	172	-90.3	163	0	0	0	112.1	A545 T546 T552 A553	A545-L549 VanDerWaalsContact O-CB 3.29Å; A545-L549 WeakPolarHBondContact O-CB 3.42Å; A545-L549 PolarHBondContact O-N 3.03Å; T546-L549 PolarHBondContact O-N 3.1Å; L549-T552 WeakPolarHBondContact CA-OG1 3.46Å; L549-T552 PolarHBondContact O-OG1 3.27Å; L549-A553 WeakPolarHBondContact O-CA 3.47Å; L549-A553 WeakPolarHBondContact O-CB 3.18Å; L549-A553 PolarHBondContact O-N 3.39Å
550	V	80.1	Confident	71.1	Confident	90 Å²	90	83.3 Å²	83.3	55%	0.545	50%	0.495	S	S	.	.	H	α-helix	trans	-69.6	-39.6	175.8	170.7	0	0	0	0	110.8	T546 L547 A553 T554	T546-V550 WeakPolarHBondContact O-CB 3.49Å; T546-V550 VanDerWaalsContact O-CG2 3.3Å; T546-V550 WeakPolarHBondContact O-CG2 3.45Å; T546-V550 PolarHBondContact O-N 3.35Å; L547-V550 PolarHBondContact O-N 3.1Å; V550-A553 PolarHBondContact O-N 2.75Å; V550-T554 HydrophobicContact CG1-CG2 4.41Å; V550-T554 WeakPolarHBondContact O-CB 3.41Å; V550-T554 WeakPolarHBondContact O-CG2 3.39Å; V550-T554 PolarHBondContact O-N 3.05Å; V550-T554 PolarHBondContact O-OG1 2.87Å
551	A	73.9	Confident	71.3	Confident	52 Å²	52	86.9 Å²	86.9	43%	0.43	50%	0.5	S	S	.	.	H	α-helix	trans	-65.2	-43.5	175	0	0	0	0	0	112.1	L547 T554 A555	L547-A551 VanDerWaalsContact O-CB 3.29Å; L547-A551 WeakPolarHBondContact O-CB 3.46Å; L547-A551 PolarHBondContact O-N 2.73Å; A551-T554 WeakPolarHBondContact CA-OG1 3.35Å; A551-T554 PolarHBondContact O-OG1 3.35Å; A551-T554 VanDerWaalsContact O-OG1 3.11Å; A551-A555 WeakPolarHBondContact O-CB 3.32Å; A551-A555 PolarHBondContact O-N 2.9Å
552	T	74.9	Confident	71.2	Confident	89 Å²	89	90.4 Å²	90.4	55%	0.546	51%	0.505	S	S	.	.	H	α-helix	trans	-74.3	-30.9	177	53.5	0	0	0	0	112.6	L548 L549 G556	L548-T552 WeakPolarHBondContact O-CB 3.39Å; L548-T552 VanDerWaalsContact O-CG2 3.31Å; L548-T552 WeakPolarHBondContact O-CG2 3.5Å; L548-T552 PolarHBondContact O-N 2.75Å; L548-T552 PolarHBondContact O-OG1 3.49Å; L549-T552 WeakPolarHBondContact CA-OG1 3.46Å; L549-T552 PolarHBondContact O-OG1 3.27Å; T552-G556 VanDerWaalsContact O-CA 3.25Å; T552-G556 WeakPolarHBondContact O-CA 3.17Å; T552-G556 PolarHBondContact O-N 3.11Å
553	A	77.1	Confident	70.5	Confident	62 Å²	62	94.1 Å²	94.1	51%	0.512	51%	0.514	S	S	.	.	H	α-helix	trans	-73.5	-34.8	172.4	0	0	0	0	0	112.5	L549 V550 F557	L549-A553 WeakPolarHBondContact O-CA 3.47Å; L549-A553 WeakPolarHBondContact O-CB 3.18Å; L549-A553 PolarHBondContact O-N 3.39Å; V550-A553 PolarHBondContact O-N 2.75Å; A553-F557 WeakPolarHBondContact O-CB 3.41Å; A553-F557 PolarHBondContact O-N 3.12Å
554	T	73.8	Confident	69.8	Low	73 Å²	73	99 Å²	99	45%	0.448	52%	0.524	S	S	.	.	H	α-helix	trans	-74.9	-45.3	174	48.9	0	0	0	0	111.6	V550 A551 G556 F557 I558	V550-T554 HydrophobicContact CG1-CG2 4.41Å; V550-T554 WeakPolarHBondContact O-CB 3.41Å; V550-T554 WeakPolarHBondContact O-CG2 3.39Å; V550-T554 PolarHBondContact O-N 3.05Å; V550-T554 PolarHBondContact O-OG1 2.87Å; A551-T554 WeakPolarHBondContact CA-OG1 3.35Å; A551-T554 PolarHBondContact O-OG1 3.35Å; A551-T554 VanDerWaalsContact O-OG1 3.11Å; T554-G556 VanDerWaalsContact C-N 3.29Å; T554-G556 PolarHBondContact O-N 3.11Å; T554-F557 PolarHBondContact O-N 2.9Å; T554-I558 WeakPolarHBondContact O-CB 3.39Å; T554-I558 WeakPolarHBondContact O-CD1 3.48Å; T554-I558 WeakPolarHBondContact O-CG1 3.31Å; T554-I558 PolarHBondContact O-N 3.5Å
555	A	70.9	Confident	68.8	Low	52 Å²	52	105.9 Å²	105.9	43%	0.43	54%	0.542	S	S	.	.	H	α-helix	trans	-59.7	-41.6	169.6	0	0	0	0	0	111.3	A551 I558 C559	A551-A555 WeakPolarHBondContact O-CB 3.32Å; A551-A555 PolarHBondContact O-N 2.9Å; A555-I558 PolarHBondContact O-N 2.79Å; A555-C559 VanDerWaalsContact O-CB 3.24Å; A555-C559 WeakPolarHBondContact O-CB 3.02Å; A555-C559 PolarHBondContact O-N 2.04Å; A555-C559 PolarHBondContact O-SG 3.26Å; A555-C559 VanDerWaalsContact O-SG 3.38Å
556	G	73.7	Confident	68	Low	35 Å²	35	114.5 Å²	114.5	36%	0.361	56%	0.564	S	S	.	*	H	α-helix	trans	-63.1	-39.5	174.1	0	0	0	0	0	113	T552 T554 Y560	T552-G556 VanDerWaalsContact O-CA 3.25Å; T552-G556 WeakPolarHBondContact O-CA 3.17Å; T552-G556 PolarHBondContact O-N 3.11Å; T554-G556 VanDerWaalsContact C-N 3.29Å; T554-G556 PolarHBondContact O-N 3.11Å; G556-Y560 WeakPolarHBondContact O-CA 3.15Å; G556-Y560 WeakPolarHBondContact O-CB 3.37Å; G556-Y560 PolarHBondContact O-N 3.46Å
557	F	73.6	Confident	66.4	Low	113 Å²	113	121.7 Å²	121.7	50%	0.496	58%	0.583	S	S	.	*	H	α-helix	trans	-72.4	-37.1	175.6	-179.2	-108.8	0	0	0	112	A553 T554 Y560 R561	A553-F557 WeakPolarHBondContact O-CB 3.41Å; A553-F557 PolarHBondContact O-N 3.12Å; T554-F557 PolarHBondContact O-N 2.9Å; F557-Y560 PolarHBondContact O-N 2.94Å; F557-R561 HydrophobicContact CE1-CG 4.4Å; F557-R561 HydrophobicContact CE2-CG 4.38Å; F557-R561 HydrophobicContact CZ-CG 4.31Å; F557-R561 WeakPolarHBondContact O-CB 3.35Å; F557-R561 WeakPolarHBondContact O-CG 3.33Å; F557-R561 PolarHBondContact O-N 3.18Å
558	I	68.6	Low	64.3	Low	92 Å²	92	127 Å²	127	47%	0.472	60%	0.595	S	S	.	*	H	α-helix	trans	-66.2	-45.1	173.2	-69.8	163.5	0	0	0	110	T554 A555 R561 R562	T554-I558 WeakPolarHBondContact O-CB 3.39Å; T554-I558 WeakPolarHBondContact O-CD1 3.48Å; T554-I558 WeakPolarHBondContact O-CG1 3.31Å; T554-I558 PolarHBondContact O-N 3.5Å; A555-I558 PolarHBondContact O-N 2.79Å; I558-R561 PolarHBondContact O-N 2.72Å; I558-R562 WeakPolarHBondContact O-CB 3.35Å; I558-R562 WeakPolarHBondContact O-CG 3.44Å; I558-R562 PolarHBondContact O-N 2.64Å
559	C	66.9	Low	62.8	Low	78 Å²	78	127.7 Å²	127.7	53%	0.527	61%	0.605	S	S	.	*	H	α-helix	trans	-66.9	-37.2	173.6	-76.2	0	0	0	0	112.4	A555 R562 K563	A555-C559 VanDerWaalsContact O-CB 3.24Å; A555-C559 WeakPolarHBondContact O-CB 3.02Å; A555-C559 PolarHBondContact O-N 2.04Å; A555-C559 PolarHBondContact O-SG 3.26Å; A555-C559 VanDerWaalsContact O-SG 3.38Å; C559-R562 CarbonylContact O-C 3.42Å; C559-R562 PolarHBondContact O-N 2.66Å; C559-K563 WeakPolarHBondContact O-CB 3.16Å; C559-K563 PolarHBondContact O-N 2.78Å
560	Y	65.6	Low	60.8	Low	119 Å²	119	127.5 Å²	127.5	47%	0.467	61%	0.614	S	S	.	*	H	α-helix	trans	-69.4	-40.1	175.2	-179.6	-104.2	0	0	0	111.3	G556 F557 K563 R564	G556-Y560 WeakPolarHBondContact O-CA 3.15Å; G556-Y560 WeakPolarHBondContact O-CB 3.37Å; G556-Y560 PolarHBondContact O-N 3.46Å; F557-Y560 PolarHBondContact O-N 2.94Å; Y560-K563 PolarHBondContact O-N 2.92Å; Y560-R564 WeakPolarHBondContact O-CA 3.25Å; Y560-R564 WeakPolarHBondContact O-CB 3.07Å; Y560-R564 PolarHBondContact O-N 3.48Å; Y560-R564 PolarHBondContact OH-NE 3.22Å; Y560-R564 PolarHBondContact OH-NH1 3.49Å
561	R	64.4	Low	58.4	Low	155 Å²	155	135 Å²	135	59%	0.585	63%	0.632	S	S	*	*	H	α-helix	trans	-66.1	-37.8	171.2	-73.3	-175.4	79.5	162.6	5.2	111.8	F557 I558 R565	F557-R561 HydrophobicContact CE1-CG 4.4Å; F557-R561 HydrophobicContact CE2-CG 4.38Å; F557-R561 HydrophobicContact CZ-CG 4.31Å; F557-R561 WeakPolarHBondContact O-CB 3.35Å; F557-R561 WeakPolarHBondContact O-CG 3.33Å; F557-R561 PolarHBondContact O-N 3.18Å; I558-R561 PolarHBondContact O-N 2.72Å; R561-R565 WeakPolarHBondContact O-CB 3.2Å; R561-R565 WeakPolarHBondContact O-CG 3.42Å; R561-R565 PolarHBondContact O-N 2.81Å
562	R	57.9	Low	56.6	Low	188 Å²	188	136.4 Å²	136.4	71%	0.709	64%	0.644	S	S	*	*	H	α-helix	trans	-66.7	-35.4	171.9	-82.3	179.1	156.8	159.5	-5.8	113	I558 C559	I558-R562 WeakPolarHBondContact O-CB 3.35Å; I558-R562 WeakPolarHBondContact O-CG 3.44Å; I558-R562 PolarHBondContact O-N 2.64Å; C559-R562 CarbonylContact O-C 3.42Å; C559-R562 PolarHBondContact O-N 2.66Å
563	K	51.2	Low	54.6	Low	167 Å²	167	138 Å²	138	73%	0.726	65%	0.649	S	S	*	*	H	α-helix	trans	-85.8	-36.8	-177.7	-161	170.2	-174.2	176.6	0	113	C559 Y560 R565 R566 R567	C559-K563 WeakPolarHBondContact O-CB 3.16Å; C559-K563 PolarHBondContact O-N 2.78Å; Y560-K563 PolarHBondContact O-N 2.92Å; K563-R565 VanDerWaalsContact C-N 3.26Å; K563-R565 PolarHBondContact O-N 3.16Å; K563-R566 PolarHBondContact O-N 3.42Å; K563-R567 PolarHBondContact O-N 3.41Å
564	R	50.4	Low	52.6	Low	178 Å²	178	143.1 Å²	143.1	67%	0.672	66%	0.66	S	S	*	*	H	α-helix	trans	-70.9	-19.1	172.5	-159.6	-179.8	-165.5	-178	5.1	112.5	Y560 R566	Y560-R564 WeakPolarHBondContact O-CA 3.25Å; Y560-R564 WeakPolarHBondContact O-CB 3.07Å; Y560-R564 PolarHBondContact O-N 3.48Å; Y560-R564 PolarHBondContact OH-NE 3.22Å; Y560-R564 PolarHBondContact OH-NH1 3.49Å; R564-R566 VanDerWaalsContact C-N 3.32Å
565	R	50.6	Low	50.5	Low	221 Å²	221	144.4 Å²	144.4	83%	0.834	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-5.6	163.7	-85.7	-172.1	170.6	-171.8	-2.2	114.6	R561 K563	R561-R565 WeakPolarHBondContact O-CB 3.2Å; R561-R565 WeakPolarHBondContact O-CG 3.42Å; R561-R565 PolarHBondContact O-N 2.81Å; K563-R565 VanDerWaalsContact C-N 3.26Å; K563-R565 PolarHBondContact O-N 3.16Å
566	R	52.1	Low	48.5	Very low	229 Å²	229	145.2 Å²	145.2	86%	0.864	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.2	-6.9	-174	-93.4	-172.5	170.1	-166.4	-3.4	116.9	K563 R564	K563-R566 PolarHBondContact O-N 3.42Å; R564-R566 VanDerWaalsContact C-N 3.32Å
567	R	38.3	Very low	46.5	Very low	220 Å²	220	151.9 Å²	151.9	83%	0.83	71%	0.712	S	S	*	*	S	Bend	trans	-152.2	136.6	169.1	-62.4	-174.1	174.4	175.6	-3.5	107.1	K563	K563-R567 PolarHBondContact O-N 3.41Å
568	R	33.7	Very low	44.4	Very low	234 Å²	234	157.6 Å²	157.6	88%	0.883	73%	0.732	S	S	*	*			cis	-157.6	-167.6	16.6	-148.1	-175.5	-169.6	-177	2.5	109
569	P	43.9	Very low	42.6	Very low	120 Å²	120	162.1 Å²	162.1	78%	0.779	75%	0.752	S	S	*	*				-98.9	-179.1	-108.8	42.4	-29.3	0	0	0	117.5
570	S	35.8	Very low	41	Very low	110 Å²	110	164.4 Å²	164.4	77%	0.769	76%	0.756	S	S	*	*			trans	-65.9	151	-175.2	178.5	0	0	0	0	117.5
571	R	29.9	Very low	39.2	Very low	247 Å²	247	161.8 Å²	161.8	93%	0.932	77%	0.765	S	S	*	*				-147.2	141.1	126.6	-132.4	170.3	-178.8	160.1	-0.2	111.3
572	A	36.1	Very low	37.8	Very low	83 Å²	83	163.8 Å²	163.8	69%	0.686	78%	0.781	S	S	*	*			trans	-55.4	162.2	-171.6	0	0	0	0	0	114.7
573	D	32.3	Very low	36.9	Very low	122 Å²	122	158.3 Å²	158.3	65%	0.652	78%	0.776	S	S	*	*			cis	-157	168.5	33	-125.7	-11.2	0	0	0	109.2
574	K	34.3	Very low	36.4	Very low	170 Å²	170	158.6 Å²	158.6	74%	0.739	78%	0.782	S	S	*	*			cis	-160.9	178.3	-5.4	-150.3	157.5	-139.2	140.9	0	109.2
575	A	29.3	Very low	36.7	Very low	100 Å²	100	156.5 Å²	156.5	83%	0.826	78%	0.778	S	S	*	*			trans	58.2	110.3	166.1	0	0	0	0	0	118.6
576	G	30.7	Very low	37.6	Very low	68 Å²	68	150.8 Å²	150.8	70%	0.701	77%	0.767	S	S	*	*			trans	-85.8	145.6	-168	0	0	0	0	0	117.3
577	H	31.6	Very low	39	Very low	175 Å²	175	140 Å²	140	81%	0.81	73%	0.727	S	S	*	*			trans	-138.7	121.8	154.2	-97.3	44.3	0	0	0	107.3
578	Y	29.5	Very low	41.2	Very low	233 Å²	233	132.8 Å²	132.8	91%	0.914	70%	0.703	S	S	*	*			trans	-125.3	99.4	171.8	-88.7	-74	0	0	0	110.3
579	Q	30.9	Very low	43.4	Very low	188 Å²	188	122.8 Å²	122.8	88%	0.879	67%	0.668	S	S	*	*			trans	-106.3	150.4	151.9	-75.4	177.3	-30.9	0	0	107.3
580	M	32.6	Very low	45.2	Very low	126 Å²	126	117.4 Å²	117.4	62%	0.621	63%	0.633	S	S	*	*			cis	-160.4	135.4	-21.6	174.5	64.6	172.9	0	0	104.8
581	G	28.5	Very low	47.3	Very low	63 Å²	63	117 Å²	117	65%	0.649	62%	0.617	S	S	*	*			trans	-110.6	124.2	162.2	0	0	0	0	0	107.2	A583	G581-A583 PolarHBondContact O-N 2.78Å
582	Q	34.8	Very low	49.7	Very low	197 Å²	197	110.2 Å²	110.2	92%	0.921	60%	0.603	S	S	*	*			trans	-71	77.7	-178.4	-71.5	174.9	-56.5	0	0	111.5
583	A	37.4	Very low	51.8	Low	73 Å²	73	108.6 Å²	108.6	60%	0.603	58%	0.58	S	S	*	*			trans	-88.6	148	141.2	0	0	0	0	0	107.4	G581 K585	G581-A583 PolarHBondContact O-N 2.78Å; A583-K585 PolarHBondContact O-N 3.38Å
584	M	42.3	Very low	53.9	Low	174 Å²	174	112.4 Å²	112.4	86%	0.857	59%	0.594	S	S	*	*			trans	-59.1	124.9	165.4	-67.9	167.7	62.2	0	0	107.4	V586	M584-V586 PolarHBondContact O-N 2.03Å
585	K	57	Low	56.2	Low	134 Å²	134	106.9 Å²	106.9	58%	0.583	57%	0.572	S	S	*	*			trans	-70.6	98.1	170.7	-85.1	-168.9	168.3	-166	0	107.1	A583 M731	A583-K585 PolarHBondContact O-N 3.38Å; K585-M731 HydrophobicContact CB-CE 3.98Å; K585-M731 HydrophobicContact CB-SD 3.99Å; K585-M731 VanDerWaalsContact O-CE 3.31Å; K585-M731 WeakPolarHBondContact O-CE 3.46Å
586	V	68.3	Low	58.7	Low	100 Å²	100	103.2 Å²	103.2	61%	0.606	54%	0.54	S	S	*	.			trans	-77.4	133	169.3	-173	0	0	0	0	107.1	M584	M584-V586 PolarHBondContact O-N 2.03Å
587	Y	82.6	Confident	61.2	Low	4 Å²	4	101.4 Å²	101.4	2%	0.016	51%	0.514	C	S	.	.			trans	-61.1	137.7	170.2	165	-87.4	0	0	0	110.1	D589 P590 I664 F668 M731 F733 F761	Y587-D589 HydrophobicContact CE1-CB 3.94Å; Y587-P590 VanDerWaalsContact OH-CD 3.23Å; Y587-P590 WeakPolarHBondContact OH-CD 3.32Å; Y587-I664 HydrophobicContact CE2-CG2 4.4Å; Y587-F668 HydrophobicContact CD2-CE1 4.22Å; Y587-F668 AromaticContact CD2-CZ 3.71Å; Y587-F668 HydrophobicContact CD2-CZ 3.71Å; Y587-F668 HydrophobicContact CE2-CZ 4.1Å; Y587-M731 WeakPolarHBondContact CB-O 3.41Å; Y587-F733 HydrophobicContact CD1-CD2 4.02Å; Y587-F733 AromaticContact CD2-CD2 3.61Å; Y587-F733 HydrophobicContact CD2-CD2 3.61Å; Y587-F733 HydrophobicContact CD2-CE2 4.11Å; Y587-F733 HydrophobicContact CD2-CG 4.45Å; Y587-F733 AromaticContact CE1-CD2 3.87Å; Y587-F733 HydrophobicContact CE1-CD2 3.87Å; Y587-F733 HydrophobicContact CE1-CE2 4.16Å; Y587-F733 AromaticContact CE2-CD2 3.44Å; Y587-F733 HydrophobicContact CE2-CD2 3.44Å; Y587-F733 VanDerWaalsContact CE2-CD2 3.44Å; Y587-F733 AromaticContact CE2-CE2 3.45Å; Y587-F733 HydrophobicContact CE2-CE2 3.45Å; Y587-F733 VanDerWaalsContact CE2-CE2 3.45Å; Y587-F733 AromaticContact CG-CD2 3.9Å; Y587-F733 HydrophobicContact CG-CD2 3.9Å; Y587-F733 AromaticContact CZ-CD2 3.58Å; Y587-F733 AromaticContact CZ-CE2 3.48Å; Y587-F733 VanDerWaalsContact CZ-CE2 3.48Å; Y587-F761 AromaticContact CD1-CD2 3.65Å; Y587-F761 HydrophobicContact CD1-CD2 3.65Å; Y587-F761 HydrophobicContact CD1-CE2 4.16Å; Y587-F761 HydrophobicContact CE1-CB 4.26Å; Y587-F761 AromaticContact CE1-CD2 3.94Å; Y587-F761 HydrophobicContact CE1-CD2 3.94Å; Y587-F761 HydrophobicContact CE1-CG 4.49Å
588	I	82.9	Confident	63.8	Low	67 Å²	67	98 Å²	98	34%	0.344	50%	0.499	S	S	.	.			trans	-109.6	125.6	176.7	-57	178.4	0	0	0	107.6	P590 Y593 F603 Q667	I588-P590 VanDerWaalsContact O-CD 3.24Å; I588-P590 WeakPolarHBondContact O-CD 3.35Å; I588-Y593 HydrophobicContact CG2-CE2 4.09Å; I588-F603 HydrophobicContact CB-CE1 4.43Å; I588-F603 HydrophobicContact CB-CZ 3.84Å; I588-F603 HydrophobicContact CD1-CE1 4.24Å; I588-F603 HydrophobicContact CD1-CZ 4.08Å; I588-F603 HydrophobicContact CG1-CZ 4.48Å; I588-F603 HydrophobicContact CG2-CZ 3.99Å; I588-Q667 PolarHBondContact O-NE2 3.5Å; I588-Q667 PolarHBondContact O-OE1 2.91Å
589	D	81.8	Confident	66.5	Low	25 Å²	25	86.9 Å²	86.9	13%	0.134	46%	0.455	C	S	.	.			trans	-72.9	116.4	179.7	-165.8	-24.7	0	0	0	110.8	Y587 F591 T592 F761	Y587-D589 HydrophobicContact CE1-CB 3.94Å; D589-F591 PolarHBondContact O-N 2.84Å; D589-F591 WeakPolarHBondContact OD1-CB 3.48Å; D589-F591 WeakPolarHBondContact OD1-CD2 3.47Å; D589-F591 PolarHBondContact OD1-N 3.3Å; D589-T592 HydrophobicContact CB-CG2 4.3Å; D589-T592 PolarHBondContact O-N 2.84Å; D589-T592 PolarHBondContact O-OG1 2.84Å; D589-F761 HydrophobicContact CB-CB 4Å; D589-F761 HydrophobicContact CB-CG 4.42Å; D589-F761 WeakPolarHBondContact OD2-CB 3.49Å
590	P	80.8	Confident	69.3	Low	7 Å²	7	78.1 Å²	78.1	5%	0.045	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-58.9	-21.3	178.8	-26.4	38.5	0	0	0	113.9	Y587 I588 T592 Y593 A599 S663 I664	Y587-P590 VanDerWaalsContact OH-CD 3.23Å; Y587-P590 WeakPolarHBondContact OH-CD 3.32Å; I588-P590 VanDerWaalsContact O-CD 3.24Å; I588-P590 WeakPolarHBondContact O-CD 3.35Å; P590-T592 PolarHBondContact O-N 3.49Å; P590-Y593 PolarHBondContact O-N 2.9Å; P590-A599 HydrophobicContact CB-CB 4.06Å; P590-S663 VanDerWaalsContact CG-CB 3.49Å; P590-I664 HydrophobicContact CG-CG1 3.97Å
591	F	79.8	Confident	71.9	Confident	100 Å²	100	79.7 Å²	79.7	44%	0.439	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-70.7	-4.4	175.7	-65.3	-68.6	0	0	0	113.9	D589 Y593	D589-F591 PolarHBondContact O-N 2.84Å; D589-F591 WeakPolarHBondContact OD1-CB 3.48Å; D589-F591 WeakPolarHBondContact OD1-CD2 3.47Å; D589-F591 PolarHBondContact OD1-N 3.3Å; F591-Y593 VanDerWaalsContact C-N 3.32Å
592	T	80.4	Confident	74.7	Confident	105 Å²	105	82 Å²	82	64%	0.644	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-81.2	-6.6	170.5	65.5	0	0	0	0	114.2	D589 P590	D589-T592 HydrophobicContact CB-CG2 4.3Å; D589-T592 PolarHBondContact O-N 2.84Å; D589-T592 PolarHBondContact O-OG1 2.84Å; P590-T592 PolarHBondContact O-N 3.49Å
593	Y	79	Confident	77.4	Confident	49 Å²	49	74.3 Å²	74.3	19%	0.192	37%	0.371	C	S	.	.			trans	-95.2	134.6	179.3	-66.9	-108.4	0	0	0	110.4	I588 P590 F591 E598 A599 E602 F603	I588-Y593 HydrophobicContact CG2-CE2 4.09Å; P590-Y593 PolarHBondContact O-N 2.9Å; F591-Y593 VanDerWaalsContact C-N 3.32Å; Y593-E598 HydrophobicContact CD1-CB 4.06Å; Y593-E598 HydrophobicContact CD1-CG 3.95Å; Y593-E598 HydrophobicContact CE1-CG 4.24Å; Y593-A599 HydrophobicContact CD1-CB 4.24Å; Y593-A599 HydrophobicContact CD2-CB 3.83Å; Y593-A599 HydrophobicContact CE2-CB 4.31Å; Y593-A599 HydrophobicContact CG-CB 3.81Å; Y593-E602 VanDerWaalsContact OH-CD 3.26Å; Y593-E602 PolarHBondContact OH-OE2 3.37Å; Y593-F603 AromaticContact CE2-CE2 3.91Å; Y593-F603 HydrophobicContact CE2-CE2 3.91Å; Y593-F603 HydrophobicContact CE2-CZ 4.3Å; Y593-F603 WeakPolarHBondContact OH-CZ 3.5Å
594	E	77.4	Confident	80	Confident	203 Å²	203	71.6 Å²	71.6	95%	0.949	35%	0.348	S	S	*	.	S	Bend	trans	-71.2	-35.9	176.4	-64.2	-174.8	170.4	0	0	112.1
595	D	81.8	Confident	82.3	Confident	53 Å²	53	68 Å²	68	28%	0.283	33%	0.328	S	S	.	.	S	Bend	trans	-104	114.6	172.3	176.1	21.1	0	0	0	110.7	N597 E598 R601	D595-N597 PolarHBondContact O-N 3.11Å; D595-N597 VanDerWaalsContact O-N 3.16Å; D595-N597 WeakPolarHBondContact OD1-CB 3.45Å; D595-N597 PolarHBondContact OD1-N 3.27Å; D595-N597 PolarHBondContact OD1-ND2 2.76Å; D595-N597 WeakPolarHBondContact OD2-CB 3.05Å; D595-E598 HydrophobicContact CB-CB 4.27Å; D595-E598 VanDerWaalsContact O-CB 3.3Å; D595-E598 WeakPolarHBondContact O-CB 3.32Å; D595-E598 PolarHBondContact O-N 2.85Å; D595-R601 IonicContact OD2-CZ 3.68Å; D595-R601 IonicContact OD2-NH1 3.7Å; D595-R601 IonicContact OD2-NH2 3.35Å; D595-R601 PolarHBondContact OD2-NH2 3.39Å
596	P	81.9	Confident	84.1	Confident	23 Å²	23	65.1 Å²	65.1	15%	0.149	32%	0.317	C	S	.	.	H	α-helix	trans	-59	-28.3	175.3	-22.5	32.6	0	0	0	113.3	E598 A599 V600 R656 L659	P596-E598 PolarHBondContact O-N 3.48Å; P596-A599 PolarHBondContact O-N 2.81Å; P596-V600 WeakPolarHBondContact O-CB 3.45Å; P596-V600 VanDerWaalsContact O-CG2 3.28Å; P596-V600 WeakPolarHBondContact O-CG2 3.38Å; P596-V600 PolarHBondContact O-N 2.81Å; P596-R656 HydrophobicContact CG-CB 4.41Å; P596-R656 HydrophobicContact CG-CG 3.55Å; P596-L659 HydrophobicContact CB-CB 4.08Å; P596-L659 HydrophobicContact CB-CD1 4.02Å
597	N	84.1	Confident	85.2	Confident	30 Å²	30	60.6 Å²	60.6	16%	0.16	29%	0.289	C	S	.	.	H	α-helix	trans	-68.2	-22.9	176.5	-52.8	-81.5	0	0	0	111.3	D595 R601 R655	D595-N597 PolarHBondContact O-N 3.11Å; D595-N597 VanDerWaalsContact O-N 3.16Å; D595-N597 WeakPolarHBondContact OD1-CB 3.45Å; D595-N597 PolarHBondContact OD1-N 3.27Å; D595-N597 PolarHBondContact OD1-ND2 2.76Å; D595-N597 WeakPolarHBondContact OD2-CB 3.05Å; N597-R601 VanDerWaalsContact C-CZ 3.45Å; N597-R601 WeakPolarHBondContact O-CB 3.3Å; N597-R601 WeakPolarHBondContact O-CG 3.3Å; N597-R601 VanDerWaalsContact O-CZ 3.23Å; N597-R601 PolarHBondContact O-N 3.37Å; N597-R601 PolarHBondContact O-NE 2.8Å; N597-R601 VanDerWaalsContact O-NE 3.12Å; N597-R655 PolarHBondContact ND2-NH1 2.97Å; N597-R655 PolarHBondContact ND2-NH2 2.81Å; N597-R655 PolarHBondContact OD1-NH2 3.11Å
598	E	86.8	Confident	85.6	Confident	103 Å²	103	64.6 Å²	64.6	48%	0.481	31%	0.311	S	S	.	.	H	α-helix	trans	-72.9	-49.3	175.3	-167.7	168.6	-156.9	0	0	111.3	Y593 D595 P596 V600 R601 E602	Y593-E598 HydrophobicContact CD1-CB 4.06Å; Y593-E598 HydrophobicContact CD1-CG 3.95Å; Y593-E598 HydrophobicContact CE1-CG 4.24Å; D595-E598 HydrophobicContact CB-CB 4.27Å; D595-E598 VanDerWaalsContact O-CB 3.3Å; D595-E598 WeakPolarHBondContact O-CB 3.32Å; D595-E598 PolarHBondContact O-N 2.85Å; P596-E598 PolarHBondContact O-N 3.48Å; E598-V600 VanDerWaalsContact C-N 3.3Å; E598-V600 PolarHBondContact O-N 2.82Å; E598-R601 PolarHBondContact O-N 3.37Å; E598-R601 VanDerWaalsContact O-N 3.11Å; E598-E602 PolarHBondContact O-N 2.94Å
599	A	86	Confident	86	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-55.9	-44.6	172.7	0	0	0	0	0	111.8	P590 Y593 P596 R601 E602 F603	P590-A599 HydrophobicContact CB-CB 4.06Å; Y593-A599 HydrophobicContact CD1-CB 4.24Å; Y593-A599 HydrophobicContact CD2-CB 3.83Å; Y593-A599 HydrophobicContact CE2-CB 4.31Å; Y593-A599 HydrophobicContact CG-CB 3.81Å; P596-A599 PolarHBondContact O-N 2.81Å; A599-R601 PolarHBondContact O-N 2.9Å; A599-E602 PolarHBondContact O-N 2.96Å; A599-F603 HydrophobicContact CB-CD2 4.37Å; A599-F603 HydrophobicContact CB-CE2 4.41Å; A599-F603 WeakPolarHBondContact O-CD2 3.45Å; A599-F603 PolarHBondContact O-N 3.26Å
600	V	88.2	Confident	86.4	Confident	3 Å²	3	66.5 Å²	66.5	2%	0.018	34%	0.335	C	S	.	.	H	α-helix	trans	-63.3	-39.9	176.5	171.1	0	0	0	0	112.1	P596 E598 E602 A604 L659 S663 V679 T681	P596-V600 WeakPolarHBondContact O-CB 3.45Å; P596-V600 VanDerWaalsContact O-CG2 3.28Å; P596-V600 WeakPolarHBondContact O-CG2 3.38Å; P596-V600 PolarHBondContact O-N 2.81Å; E598-V600 VanDerWaalsContact C-N 3.3Å; E598-V600 PolarHBondContact O-N 2.82Å; V600-E602 VanDerWaalsContact C-N 3.26Å; V600-E602 PolarHBondContact O-N 3.2Å; V600-A604 HydrophobicContact CG1-CB 4.16Å; V600-A604 CarbonylContact O-C 3.55Å; V600-A604 WeakPolarHBondContact O-CA 3.35Å; V600-A604 VanDerWaalsContact O-CB 3.32Å; V600-A604 WeakPolarHBondContact O-CB 3.29Å; V600-A604 PolarHBondContact O-N 2.84Å; V600-L659 HydrophobicContact CG2-CB 3.8Å; V600-L659 HydrophobicContact CG2-CD2 4.11Å; V600-L659 HydrophobicContact CG2-CG 4.4Å; V600-L659 VanDerWaalsContact CG2-O 3.31Å; V600-L659 WeakPolarHBondContact CG2-O 3.46Å; V600-S663 WeakPolarHBondContact CG2-OG 3.17Å; V600-S663 PolarHBondContact N-OG 2.94Å; V600-V679 HydrophobicContact CG1-CB 4.42Å; V600-V679 HydrophobicContact CG1-CG1 4.36Å; V600-V679 HydrophobicContact CG1-CG2 3.66Å; V600-T681 HydrophobicContact CG1-CG2 4.04Å
601	R	87.8	Confident	86.9	Confident	160 Å²	160	69.5 Å²	69.5	60%	0.604	35%	0.347	S	S	*	.	H	α-helix	trans	-67.1	-25.3	175.8	-78.2	177.5	-60.7	-110.6	0.4	113.2	D595 N597 E598 A599	D595-R601 IonicContact OD2-CZ 3.68Å; D595-R601 IonicContact OD2-NH1 3.7Å; D595-R601 IonicContact OD2-NH2 3.35Å; D595-R601 PolarHBondContact OD2-NH2 3.39Å; N597-R601 VanDerWaalsContact C-CZ 3.45Å; N597-R601 WeakPolarHBondContact O-CB 3.3Å; N597-R601 WeakPolarHBondContact O-CG 3.3Å; N597-R601 VanDerWaalsContact O-CZ 3.23Å; N597-R601 PolarHBondContact O-N 3.37Å; N597-R601 PolarHBondContact O-NE 2.8Å; N597-R601 VanDerWaalsContact O-NE 3.12Å; E598-R601 PolarHBondContact O-N 3.37Å; E598-R601 VanDerWaalsContact O-N 3.11Å; A599-R601 PolarHBondContact O-N 2.9Å
602	E	87.7	Confident	87.6	Confident	112 Å²	112	66 Å²	66	52%	0.523	33%	0.333	S	S	.	.	H	α-helix	trans	-84.3	-44.4	178	-171.3	168.5	169.5	0	0	112.5	Y593 E598 A599 V600	Y593-E602 VanDerWaalsContact OH-CD 3.26Å; Y593-E602 PolarHBondContact OH-OE2 3.37Å; E598-E602 PolarHBondContact O-N 2.94Å; A599-E602 PolarHBondContact O-N 2.96Å; V600-E602 VanDerWaalsContact C-N 3.26Å; V600-E602 PolarHBondContact O-N 3.2Å
603	F	90.5	Very high	88.2	Confident	34 Å²	34	67.4 Å²	67.4	15%	0.149	33%	0.331	C	S	.	.	H	α-helix	trans	-100.9	-21.1	-171.6	-54.8	-55.3	0	0	0	114.7	I588 Y593 A599 S663 G666 Q667	I588-F603 HydrophobicContact CB-CE1 4.43Å; I588-F603 HydrophobicContact CB-CZ 3.84Å; I588-F603 HydrophobicContact CD1-CE1 4.24Å; I588-F603 HydrophobicContact CD1-CZ 4.08Å; I588-F603 HydrophobicContact CG1-CZ 4.48Å; I588-F603 HydrophobicContact CG2-CZ 3.99Å; Y593-F603 AromaticContact CE2-CE2 3.91Å; Y593-F603 HydrophobicContact CE2-CE2 3.91Å; Y593-F603 HydrophobicContact CE2-CZ 4.3Å; Y593-F603 WeakPolarHBondContact OH-CZ 3.5Å; A599-F603 HydrophobicContact CB-CD2 4.37Å; A599-F603 HydrophobicContact CB-CE2 4.41Å; A599-F603 WeakPolarHBondContact O-CD2 3.45Å; A599-F603 PolarHBondContact O-N 3.26Å; F603-S663 WeakPolarHBondContact CB-O 3.4Å; F603-G666 CarbonylContact O-C 3.57Å; F603-G666 VanDerWaalsContact O-CA 3.28Å; F603-G666 WeakPolarHBondContact O-CA 3.37Å; F603-Q667 HydrophobicContact CB-CG 4.05Å; F603-Q667 HydrophobicContact CD1-CG 3.53Å; F603-Q667 HydrophobicContact CD2-CG 4.43Å; F603-Q667 HydrophobicContact CE1-CG 4.12Å; F603-Q667 HydrophobicContact CG-CG 3.73Å
604	A	92	Very high	88.8	Confident	16 Å²	16	69.1 Å²	69.1	13%	0.132	34%	0.342	C	S	.	.	S	Bend	trans	-117.3	161.5	-179.3	0	0	0	0	0	112.6	V600 L676 V679	V600-A604 HydrophobicContact CG1-CB 4.16Å; V600-A604 CarbonylContact O-C 3.55Å; V600-A604 WeakPolarHBondContact O-CA 3.35Å; V600-A604 VanDerWaalsContact O-CB 3.32Å; V600-A604 WeakPolarHBondContact O-CB 3.29Å; V600-A604 PolarHBondContact O-N 2.84Å; A604-L676 HydrophobicContact CB-CD2 3.68Å; A604-V679 HydrophobicContact CB-CG1 3.96Å; A604-V679 HydrophobicContact CB-CG2 4Å
605	K	92.3	Very high	89.5	Confident	99 Å²	99	62.5 Å²	62.5	43%	0.43	31%	0.312	S	S	.	.			trans	-102.9	117.5	179.1	179.9	-166.8	165.1	-152.3	0	110	I607 L633 G678 V679	K605-I607 PolarHBondContact O-N 2.02Å; K605-L633 VanDerWaalsContact NZ-CD1 3.34Å; K605-G678 CarbonylContact O-C 3.57Å; K605-G678 WeakPolarHBondContact O-CA 3.49Å; K605-V679 PolarHBondContact O-N 2.9Å
606	E	93.6	Very high	89.9	Confident	74 Å²	74	64.7 Å²	64.7	35%	0.346	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-64.5	133.6	169.5	-171.7	73.6	-172.5	0	0	110.3	V679 T681 T682	E606-V679 CarbonylContact C-O 3.55Å; E606-V679 WeakPolarHBondContact CA-O 3.06Å; E606-T681 VanDerWaalsContact CD-OG1 3.29Å; E606-T681 PolarHBondContact OE1-N 2.66Å; E606-T681 PolarHBondContact OE1-OG1 2.64Å; E606-T681 PolarHBondContact OE2-N 2.79Å; E606-T681 VanDerWaalsContact OE2-N 3.11Å; E606-T681 PolarHBondContact OE2-OG1 3.31Å; E606-T682 WeakPolarHBondContact OE1-CB 3.23Å; E606-T682 WeakPolarHBondContact OE1-CG2 3.35Å; E606-T682 PolarHBondContact OE1-N 3.15Å; E606-T682 PolarHBondContact OE1-OG1 3.06Å
607	I	92.7	Very high	90.2	Very high	4 Å²	4	67.7 Å²	67.7	2%	0.021	34%	0.338	C	S	.	.			trans	-115.1	138.6	177.4	-67.1	176	0	0	0	108.1	K605 F611 V612 L631 L633 V679 I680 L689	K605-I607 PolarHBondContact O-N 2.02Å; I607-F611 HydrophobicContact CG2-CB 4.43Å; I607-V612 HydrophobicContact CG2-CG2 3.89Å; I607-L631 HydrophobicContact CD1-CD1 4.11Å; I607-L631 HydrophobicContact CD1-CD2 4.13Å; I607-L631 HydrophobicContact CG2-CD1 3.94Å; I607-L633 HydrophobicContact CG2-CD2 4.48Å; I607-V679 PolarHBondContact N-O 3.21Å; I607-I680 HydrophobicContact CB-CG1 4.16Å; I607-I680 HydrophobicContact CG2-CG1 4.5Å; I607-I680 WeakPolarHBondContact O-CG1 3.48Å; I607-L689 HydrophobicContact CD1-CD2 4.23Å
608	D	90.9	Very high	90.3	Very high	88 Å²	88	70 Å²	70	47%	0.471	35%	0.349	S	S	.	.			trans	-71.5	128.8	171.5	-170.1	-61.2	0	0	0	110	S610 F611	D608-S610 PolarHBondContact O-N 2.86Å; D608-S610 VanDerWaalsContact O-N 3.09Å; D608-S610 VanDerWaalsContact OD1-CB 3.24Å; D608-S610 WeakPolarHBondContact OD1-CB 3.32Å; D608-S610 PolarHBondContact OD1-N 2.96Å; D608-S610 PolarHBondContact OD1-OG 2.8Å; D608-F611 HydrophobicContact CB-CD2 3.73Å; D608-F611 HydrophobicContact CB-CE2 3.69Å; D608-F611 HydrophobicContact CB-CG 4.44Å; D608-F611 HydrophobicContact CB-CZ 4.38Å; D608-F611 WeakPolarHBondContact O-CB 3.33Å; D608-F611 PolarHBondContact O-N 3.23Å
609	A	89.9	Confident	90	Very high	40 Å²	40	66.6 Å²	66.6	33%	0.331	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-56.3	-27.2	-178.3	0	0	0	0	0	113.6	F611 V612 I680	A609-F611 PolarHBondContact O-N 3.01Å; A609-V612 PolarHBondContact O-N 3.12Å; A609-V612 VanDerWaalsContact O-N 3.14Å; A609-I680 HydrophobicContact CB-CD1 4.41Å; A609-I680 HydrophobicContact CB-CG2 4.2Å
610	S	90.2	Very high	89.5	Confident	93 Å²	93	70.6 Å²	70.6	65%	0.65	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-66.6	-17	176.2	66.7	0	0	0	0	114.3	D608 V612	D608-S610 PolarHBondContact O-N 2.86Å; D608-S610 VanDerWaalsContact O-N 3.09Å; D608-S610 VanDerWaalsContact OD1-CB 3.24Å; D608-S610 WeakPolarHBondContact OD1-CB 3.32Å; D608-S610 PolarHBondContact OD1-N 2.96Å; D608-S610 PolarHBondContact OD1-OG 2.8Å; S610-V612 VanDerWaalsContact C-N 3.33Å
611	F	92.8	Very high	88.4	Confident	70 Å²	70	72.2 Å²	72.2	31%	0.307	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-86.3	-1.9	174.9	-58	-35.3	0	0	0	113.7	I607 D608 A609 L631 R632 L633 P634	I607-F611 HydrophobicContact CG2-CB 4.43Å; D608-F611 HydrophobicContact CB-CD2 3.73Å; D608-F611 HydrophobicContact CB-CE2 3.69Å; D608-F611 HydrophobicContact CB-CG 4.44Å; D608-F611 HydrophobicContact CB-CZ 4.38Å; D608-F611 WeakPolarHBondContact O-CB 3.33Å; D608-F611 PolarHBondContact O-N 3.23Å; A609-F611 PolarHBondContact O-N 3.01Å; F611-L631 HydrophobicContact CB-CD1 4.39Å; F611-R632 PolarHBondContact O-N 3.31Å; F611-L633 HydrophobicContact CD2-CD2 4Å; F611-P634 HydrophobicContact CE1-CG 3.76Å; F611-P634 HydrophobicContact CE2-CG 4.1Å; F611-P634 HydrophobicContact CZ-CG 3.52Å
612	V	93.1	Very high	87.4	Confident	25 Å²	25	72.1 Å²	72.1	15%	0.152	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129.4	-173.8	-178.8	0	0	0	0	110.6	I607 A609 S610 R630 L631 I643 I680 L689	I607-V612 HydrophobicContact CG2-CG2 3.89Å; A609-V612 PolarHBondContact O-N 3.12Å; A609-V612 VanDerWaalsContact O-N 3.14Å; S610-V612 VanDerWaalsContact C-N 3.33Å; V612-R630 WeakPolarHBondContact CA-O 3.01Å; V612-L631 HydrophobicContact CG2-CD1 3.78Å; V612-I643 HydrophobicContact CG1-CD1 3.52Å; V612-I680 HydrophobicContact CB-CD1 4.31Å; V612-I680 HydrophobicContact CG2-CD1 3.88Å; V612-L689 HydrophobicContact CB-CD2 4.49Å; V612-L689 HydrophobicContact CG1-CD2 4.06Å; V612-L689 HydrophobicContact CG2-CD2 3.54Å
613	K	92.8	Very high	86.4	Confident	136 Å²	136	67.5 Å²	67.5	59%	0.591	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	113.1	172.2	-174.3	-177.8	177.8	-171.1	0	109.6	G629 R630	K613-G629 CarbonylContact O-C 3.58Å; K613-G629 WeakPolarHBondContact O-CA 3.37Å; K613-R630 PolarHBondContact N-O 2.82Å; K613-R630 PolarHBondContact O-N 3.49Å
614	I	92	Very high	85.9	Confident	84 Å²	84	66 Å²	66	43%	0.431	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	136.2	169.6	-58.4	173.5	0	0	0	108.3	C627 I643 M687	I614-C627 HydrophobicContact CG2-CB 3.63Å; I614-I643 HydrophobicContact CG1-CD1 3.83Å; I614-M687 HydrophobicContact CD1-SD 4.29Å
615	E	92.1	Very high	85.5	Confident	65 Å²	65	69 Å²	69	30%	0.304	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-61.6	177.9	-64.7	-164.3	132.5	0	0	112.3	R628 R630	E615-R628 PolarHBondContact N-O 3.16Å; E615-R628 IonicContact OE2-CZ 3.15Å; E615-R628 IonicContact OE2-NH1 3.93Å; E615-R628 PolarHBondContact OE2-NH1 2.79Å; E615-R628 IonicContact OE2-NH2 3.73Å; E615-R628 PolarHBondContact OE2-NH2 2.71Å; E615-R630 HydrophobicContact CG-CG 4.42Å; E615-R630 IonicContact OE1-CZ 3.67Å; E615-R630 IonicContact OE1-NE 2.8Å; E615-R630 PolarHBondContact OE1-NE 2.9Å; E615-R630 IonicContact OE1-NH2 2.75Å; E615-R630 PolarHBondContact OE1-NH2 2.91Å; E615-R630 IonicContact OE2-NE 3.73Å
616	E	90	Very high	85.3	Confident	98 Å²	98	66 Å²	66	46%	0.458	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	152.3	-171.5	67.3	-162.8	142.2	0	0	111.5	I618 C627 R628	E616-I618 HydrophobicContact CG-CG2 4.14Å; E616-C627 CarbonylContact O-C 3.45Å; E616-C627 WeakPolarHBondContact O-CA 3.46Å; E616-C627 WeakPolarHBondContact O-CB 3.39Å; E616-R628 HydrophobicContact CG-CB 4.03Å; E616-R628 PolarHBondContact N-O 3.29Å; E616-R628 PolarHBondContact O-N 2.91Å; E616-R628 WeakPolarHBondContact OE1-CD 3.47Å; E616-R628 IonicContact OE1-CZ 2.72Å; E616-R628 IonicContact OE1-NE 3.58Å; E616-R628 IonicContact OE1-NH1 3.38Å; E616-R628 PolarHBondContact OE1-NH1 2.96Å
617	V	89.7	Confident	85.2	Confident	86 Å²	86	62.7 Å²	62.7	52%	0.521	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	123.5	174.1	-177.1	0	0	0	0	108.7	E625	V617-E625 HydrophobicContact CG1-CB 4.28Å; V617-E625 HydrophobicContact CG1-CG 4.27Å
618	I	86.2	Confident	85.2	Confident	80 Å²	80	64.7 Å²	64.7	41%	0.41	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-12.2	179.8	58.8	172.9	0	0	0	113.2	E616 V626 R628 A642 F692	E616-I618 HydrophobicContact CG-CG2 4.14Å; I618-V626 HydrophobicContact CD1-CG1 3.98Å; I618-V626 HydrophobicContact CG1-CB 4.23Å; I618-V626 HydrophobicContact CG1-CG1 3.94Å; I618-V626 WeakPolarHBondContact CG1-O 3.37Å; I618-V626 PolarHBondContact N-O 2.83Å; I618-R628 HydrophobicContact CD1-CB 4.27Å; I618-R628 HydrophobicContact CG2-CB 3.56Å; I618-A642 HydrophobicContact CD1-CB 4.49Å; I618-F692 HydrophobicContact CD1-CD2 4.26Å; I618-F692 HydrophobicContact CD1-CE2 3.78Å
619	G	80.3	Confident	85.4	Confident	31 Å²	31	60.5 Å²	60.5	32%	0.32	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.4	172.2	174.9	0	0	0	0	0	113.1	V626	G619-V626 PolarHBondContact N-O 2.93Å; G619-V626 VanDerWaalsContact N-O 3.11Å; G619-V626 PolarHBondContact O-N 3.08Å
620	A	74.7	Confident	85.6	Confident	84 Å²	84	62.4 Å²	62.4	69%	0.694	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.7	137.8	170.4	0	0	0	0	0	108.9
621	G	65.9	Low	85.8	Confident	38 Å²	38	58.2 Å²	58.2	39%	0.392	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	-176.9	175.7	0	0	0	0	0	111.5	F623 G624	G621-F623 VanDerWaalsContact C-N 3.34Å; G621-F623 PolarHBondContact O-N 2.91Å; G621-G624 PolarHBondContact N-O 3.42Å; G621-G624 PolarHBondContact O-N 2.89Å; G621-G624 VanDerWaalsContact O-O 3.06Å
622	E	66.8	Low	85.8	Confident	157 Å²	157	63.1 Å²	63.1	73%	0.734	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-47.3	-174.7	-176.5	177.8	-171.4	0	0	113.9
623	F	66.6	Low	85.6	Confident	15 Å²	15	62.9 Å²	62.9	7%	0.066	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-17	-175.4	-57.1	-71.5	0	0	0	114.4	G621 L646 K647 Q654 D657 F658	G621-F623 VanDerWaalsContact C-N 3.34Å; G621-F623 PolarHBondContact O-N 2.91Å; F623-L646 HydrophobicContact CB-CD1 3.9Å; F623-L646 HydrophobicContact CD1-CD1 4.23Å; F623-L646 HydrophobicContact CG-CD1 4.49Å; F623-K647 PolarHBondContact O-N 2.71Å; F623-Q654 HydrophobicContact CD1-CB 4.23Å; F623-Q654 HydrophobicContact CE1-CB 4.26Å; F623-Q654 WeakPolarHBondContact CE1-O 3.46Å; F623-D657 HydrophobicContact CE1-CB 3.96Å; F623-D657 HydrophobicContact CZ-CB 3.84Å; F623-F658 HydrophobicContact CB-CD2 3.51Å; F623-F658 HydrophobicContact CB-CE2 3.98Å; F623-F658 HydrophobicContact CB-CG 4.45Å; F623-F658 HydrophobicContact CD1-CB 4.03Å; F623-F658 HydrophobicContact CD1-CD2 4.31Å; F623-F658 AromaticContact CD2-CD2 3.97Å; F623-F658 HydrophobicContact CD2-CD2 3.97Å; F623-F658 HydrophobicContact CE1-CB 4.37Å; F623-F658 HydrophobicContact CG-CB 4.2Å; F623-F658 AromaticContact CG-CD2 3.66Å; F623-F658 HydrophobicContact CG-CD2 3.66Å; F623-F658 HydrophobicContact CG-CG 4.4Å
624	G	78.3	Confident	85.2	Confident	2 Å²	2	61 Å²	61	2%	0.021	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.7	-148.1	-176.2	0	0	0	0	0	115.5	G621 T645	G621-G624 PolarHBondContact N-O 3.42Å; G621-G624 PolarHBondContact O-N 2.89Å; G621-G624 VanDerWaalsContact O-O 3.06Å; G624-T645 VanDerWaalsContact CA-O 3.31Å; G624-T645 WeakPolarHBondContact CA-O 3.43Å
625	E	84.1	Confident	84.7	Confident	80 Å²	80	61.3 Å²	61.3	37%	0.374	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	140.5	-178.1	-76.6	162.2	-151.7	0	0	110.5	V617 T645 K647	V617-E625 HydrophobicContact CG1-CB 4.28Å; V617-E625 HydrophobicContact CG1-CG 4.27Å; E625-T645 PolarHBondContact N-OG1 3.15Å; E625-T645 PolarHBondContact O-N 2.75Å; E625-T645 PolarHBondContact O-OG1 2.86Å; E625-K647 IonicContact OE1-NZ 2.63Å
626	V	89.5	Confident	84.3	Confident	35 Å²	35	65.2 Å²	65.2	21%	0.212	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	118.4	170.2	-168.9	0	0	0	0	106.9	I618 G619 A642 I643 K644	I618-V626 HydrophobicContact CD1-CG1 3.98Å; I618-V626 HydrophobicContact CG1-CB 4.23Å; I618-V626 HydrophobicContact CG1-CG1 3.94Å; I618-V626 WeakPolarHBondContact CG1-O 3.37Å; I618-V626 PolarHBondContact N-O 2.83Å; G619-V626 PolarHBondContact N-O 2.93Å; G619-V626 VanDerWaalsContact N-O 3.11Å; G619-V626 PolarHBondContact O-N 3.08Å; V626-A642 HydrophobicContact CG1-CB 4.45Å; V626-I643 WeakPolarHBondContact CA-O 3.44Å; V626-K644 HydrophobicContact CG2-CG 4.32Å
627	C	90.8	Very high	84.1	Confident	6 Å²	6	69 Å²	69	4%	0.041	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	146.3	179.6	-54.4	0	0	0	0	110.7	I614 E616 I643	I614-C627 HydrophobicContact CG2-CB 3.63Å; E616-C627 CarbonylContact O-C 3.45Å; E616-C627 WeakPolarHBondContact O-CA 3.46Å; E616-C627 WeakPolarHBondContact O-CB 3.39Å; C627-I643 HydrophobicContact CB-CB 4.47Å; C627-I643 PolarHBondContact N-O 3.4Å; C627-I643 PolarHBondContact O-N 2.87Å
628	R	93.5	Very high	84.1	Confident	45 Å²	45	68.7 Å²	68.7	17%	0.17	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	139.5	162.6	174.5	173.4	168.4	-74.7	-13.9	108.5	E615 E616 I618 F640 F692	E615-R628 PolarHBondContact N-O 3.16Å; E615-R628 IonicContact OE2-CZ 3.15Å; E615-R628 IonicContact OE2-NH1 3.93Å; E615-R628 PolarHBondContact OE2-NH1 2.79Å; E615-R628 IonicContact OE2-NH2 3.73Å; E615-R628 PolarHBondContact OE2-NH2 2.71Å; E616-R628 HydrophobicContact CG-CB 4.03Å; E616-R628 PolarHBondContact N-O 3.29Å; E616-R628 PolarHBondContact O-N 2.91Å; E616-R628 WeakPolarHBondContact OE1-CD 3.47Å; E616-R628 IonicContact OE1-CZ 2.72Å; E616-R628 IonicContact OE1-NE 3.58Å; E616-R628 IonicContact OE1-NH1 3.38Å; E616-R628 PolarHBondContact OE1-NH1 2.96Å; I618-R628 HydrophobicContact CD1-CB 4.27Å; I618-R628 HydrophobicContact CG2-CB 3.56Å; R628-F640 VanDerWaalsContact NH2-CD1 3.34Å; R628-F692 HydrophobicContact CB-CD2 4.47Å; R628-F692 HydrophobicContact CB-CE2 4.18Å; R628-F692 HydrophobicContact CG-CD2 4.2Å; R628-F692 HydrophobicContact CG-CE2 4.06Å; R628-F692 HydrophobicContact CG-CZ 4.32Å
629	G	94.6	Very high	84.2	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	-176.3	178.8	0	0	0	0	0	113.2	K613 F640 V641	K613-G629 CarbonylContact O-C 3.58Å; K613-G629 WeakPolarHBondContact O-CA 3.37Å; G629-F640 WeakPolarHBondContact O-CA 3.49Å; G629-V641 PolarHBondContact N-O 3.41Å; G629-V641 PolarHBondContact O-N 3.47Å
630	R	93.8	Very high	84.9	Confident	80 Å²	80	71 Å²	71	30%	0.302	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	135.3	177.8	-51.9	-163	-160.2	-178.9	3.9	111.2	V612 K613 E615 E638 N639 F640	V612-R630 WeakPolarHBondContact CA-O 3.01Å; K613-R630 PolarHBondContact N-O 2.82Å; K613-R630 PolarHBondContact O-N 3.49Å; E615-R630 HydrophobicContact CG-CG 4.42Å; E615-R630 IonicContact OE1-CZ 3.67Å; E615-R630 IonicContact OE1-NE 2.8Å; E615-R630 PolarHBondContact OE1-NE 2.9Å; E615-R630 IonicContact OE1-NH2 2.75Å; E615-R630 PolarHBondContact OE1-NH2 2.91Å; E615-R630 IonicContact OE2-NE 3.73Å; R630-E638 HydrophobicContact CB-CG 3.97Å; R630-E638 VanDerWaalsContact CD-CD 3.44Å; R630-E638 WeakPolarHBondContact CD-OE2 3.39Å; R630-E638 IonicContact CZ-OE2 3.52Å; R630-E638 IonicContact NE-OE2 3.04Å; R630-E638 IonicContact NH1-OE2 3.05Å; R630-E638 PolarHBondContact NH1-OE2 2.88Å; R630-N639 WeakPolarHBondContact CA-O 3.03Å; R630-F640 HydrophobicContact CG-CD1 3.98Å; R630-F640 HydrophobicContact CG-CE1 3.83Å
631	L	94.4	Very high	85.9	Confident	5 Å²	5	67.1 Å²	67.1	3%	0.026	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	121.2	174.5	176.2	62.5	0	0	0	109.4	I607 F611 V612 L633 N639 V641 E677 L689	I607-L631 HydrophobicContact CD1-CD1 4.11Å; I607-L631 HydrophobicContact CD1-CD2 4.13Å; I607-L631 HydrophobicContact CG2-CD1 3.94Å; F611-L631 HydrophobicContact CB-CD1 4.39Å; V612-L631 HydrophobicContact CG2-CD1 3.78Å; L631-L633 HydrophobicContact CD1-CD2 4.07Å; L631-L633 HydrophobicContact CD1-CG 3.93Å; L631-L633 HydrophobicContact CD2-CD1 4.1Å; L631-L633 HydrophobicContact CD2-CG 4.27Å; L631-L633 HydrophobicContact CG-CD1 4.36Å; L631-L633 HydrophobicContact CG-CG 3.99Å; L631-N639 PolarHBondContact N-O 3.28Å; L631-N639 PolarHBondContact O-N 3.38Å; L631-N639 VanDerWaalsContact O-N 3.11Å; L631-V641 HydrophobicContact CB-CG1 3.73Å; L631-V641 HydrophobicContact CB-CG2 4.08Å; L631-V641 HydrophobicContact CD2-CG1 4.08Å; L631-E677 HydrophobicContact CD2-CB 3.91Å; L631-E677 HydrophobicContact CD2-CG 4.21Å; L631-L689 HydrophobicContact CD1-CD2 4.26Å
632	R	92.7	Very high	87.2	Confident	173 Å²	173	65.9 Å²	65.9	65%	0.653	33%	0.325	S	S	*	.			trans	-122	76	-179	-171.1	176.7	173.5	175.3	-2.8	111.1	F611	F611-R632 PolarHBondContact O-N 3.31Å
633	L	88.3	Confident	88.5	Confident	20 Å²	20	58.4 Å²	58.4	11%	0.105	29%	0.291	C	S	.	.			trans	-71.3	142.1	175.7	-67.5	170.5	0	0	0	111.7	K605 I607 F611 L631 G635 R636	K605-L633 VanDerWaalsContact NZ-CD1 3.34Å; I607-L633 HydrophobicContact CG2-CD2 4.48Å; F611-L633 HydrophobicContact CD2-CD2 4Å; L631-L633 HydrophobicContact CD1-CD2 4.07Å; L631-L633 HydrophobicContact CD1-CG 3.93Å; L631-L633 HydrophobicContact CD2-CD1 4.1Å; L631-L633 HydrophobicContact CD2-CG 4.27Å; L631-L633 HydrophobicContact CG-CD1 4.36Å; L631-L633 HydrophobicContact CG-CG 3.99Å; L633-G635 PolarHBondContact O-N 3.19Å; L633-R636 HydrophobicContact CB-CB 4.31Å; L633-R636 PolarHBondContact O-N 2.78Å; L633-R636 VanDerWaalsContact O-N 3.07Å
634	P	84.8	Confident	89.7	Confident	97 Å²	97	59.5 Å²	59.5	63%	0.63	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	125.8	174.4	-27.5	35.1	0	0	0	112.5	F611 R636	F611-P634 HydrophobicContact CE1-CG 3.76Å; F611-P634 HydrophobicContact CE2-CG 4.1Å; F611-P634 HydrophobicContact CZ-CG 3.52Å; P634-R636 VanDerWaalsContact C-N 3.32Å; P634-R636 PolarHBondContact O-N 2.83Å
635	G	81.9	Confident	90.2	Very high	90 Å²	90	60.2 Å²	60.2	93%	0.928	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	4.4	179.8	0	0	0	0	0	116	L633	L633-G635 PolarHBondContact O-N 3.19Å
636	R	84.4	Confident	90.3	Very high	147 Å²	147	56.6 Å²	56.6	56%	0.555	28%	0.283	S	S	*	.	S	Bend	trans	-113	160.3	170.6	-69.8	-172.4	173.6	-171.2	-3	111.4	L633 P634 E677	L633-R636 HydrophobicContact CB-CB 4.31Å; L633-R636 PolarHBondContact O-N 2.78Å; L633-R636 VanDerWaalsContact O-N 3.07Å; P634-R636 VanDerWaalsContact C-N 3.32Å; P634-R636 PolarHBondContact O-N 2.83Å; R636-E677 IonicContact NH1-OE2 3.79Å
637	K	85	Confident	89.8	Confident	178 Å²	178	59.8 Å²	59.8	77%	0.774	29%	0.294	S	S	*	.			trans	-67.7	150.6	168.3	-169.7	178.9	174.6	-173.5	0	109.4	N639	K637-N639 PolarHBondContact O-N 3.38Å
638	E	88.9	Confident	89.1	Confident	79 Å²	79	63 Å²	63	37%	0.369	33%	0.328	S	S	.	.			trans	-63.7	124.5	170.4	-176.2	171.1	-80.7	0	0	110	R630	R630-E638 HydrophobicContact CB-CG 3.97Å; R630-E638 VanDerWaalsContact CD-CD 3.44Å; R630-E638 WeakPolarHBondContact CD-OE2 3.39Å; R630-E638 IonicContact CZ-OE2 3.52Å; R630-E638 IonicContact NE-OE2 3.04Å; R630-E638 IonicContact NH1-OE2 3.05Å; R630-E638 PolarHBondContact NH1-OE2 2.88Å
639	N	89.5	Confident	88.3	Confident	68 Å²	68	64.8 Å²	64.8	36%	0.364	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	150.8	-179.3	-74.7	-3.5	0	0	0	110.5	R630 L631 K637	R630-N639 WeakPolarHBondContact CA-O 3.03Å; L631-N639 PolarHBondContact N-O 3.28Å; L631-N639 PolarHBondContact O-N 3.38Å; L631-N639 VanDerWaalsContact O-N 3.11Å; K637-N639 PolarHBondContact O-N 3.38Å
640	F	93.5	Very high	87.6	Confident	93 Å²	93	68.6 Å²	68.6	41%	0.408	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	138.8	169.5	-67	-65	0	0	0	111.1	R628 G629 R630 F692	R628-F640 VanDerWaalsContact NH2-CD1 3.34Å; G629-F640 WeakPolarHBondContact O-CA 3.49Å; R630-F640 HydrophobicContact CG-CD1 3.98Å; R630-F640 HydrophobicContact CG-CE1 3.83Å; F640-F692 HydrophobicContact CB-CB 3.86Å; F640-F692 HydrophobicContact CB-CD1 4.2Å; F640-F692 HydrophobicContact CB-CG 4.28Å; F640-F692 PolarHBondContact O-N 3.38Å
641	V	95.8	Very high	87	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.006	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	149.2	-179.1	-70.7	0	0	0	0	110.6	G629 L631 I643 E677 L689 T690	G629-V641 PolarHBondContact N-O 3.41Å; G629-V641 PolarHBondContact O-N 3.47Å; L631-V641 HydrophobicContact CB-CG1 3.73Å; L631-V641 HydrophobicContact CB-CG2 4.08Å; L631-V641 HydrophobicContact CD2-CG1 4.08Å; V641-I643 HydrophobicContact CG2-CD1 4.09Å; V641-I643 HydrophobicContact CG2-CG1 3.85Å; V641-E677 HydrophobicContact CG1-CG 4.2Å; V641-L689 HydrophobicContact CG2-CD2 4.14Å; V641-T690 CarbonylContact C-O 3.52Å; V641-T690 VanDerWaalsContact CA-O 3.28Å; V641-T690 WeakPolarHBondContact CA-O 3.31Å; V641-T690 WeakPolarHBondContact CB-O 3.22Å
642	A	94.9	Very high	86.4	Confident	12 Å²	12	73 Å²	73	10%	0.099	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	132.3	161.5	0	0	0	0	0	108.5	I618 V626 L689 T690 F692	I618-A642 HydrophobicContact CD1-CB 4.49Å; V626-A642 HydrophobicContact CG1-CB 4.45Å; A642-L689 WeakPolarHBondContact O-CA 3.29Å; A642-T690 PolarHBondContact N-O 2.87Å; A642-T690 PolarHBondContact O-N 2.88Å; A642-F692 HydrophobicContact CB-CD2 4.47Å
643	I	93.9	Very high	85.8	Confident	0 Å²	0	69 Å²	69	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	101.6	-173.3	-52.7	174.5	0	0	0	107.2	V612 I614 V626 C627 V641 T645 M687 I688 L689	V612-I643 HydrophobicContact CG1-CD1 3.52Å; I614-I643 HydrophobicContact CG1-CD1 3.83Å; V626-I643 WeakPolarHBondContact CA-O 3.44Å; C627-I643 HydrophobicContact CB-CB 4.47Å; C627-I643 PolarHBondContact N-O 3.4Å; C627-I643 PolarHBondContact O-N 2.87Å; V641-I643 HydrophobicContact CG2-CD1 4.09Å; V641-I643 HydrophobicContact CG2-CG1 3.85Å; I643-T645 HydrophobicContact CG2-CG2 4.27Å; I643-M687 HydrophobicContact CG2-CB 4.1Å; I643-M687 HydrophobicContact CG2-CG 4.11Å; I643-M687 HydrophobicContact CG2-SD 3.88Å; I643-I688 WeakPolarHBondContact CA-O 3.47Å; I643-L689 HydrophobicContact CG1-CG 4.31Å
644	K	91.8	Very high	85.4	Confident	39 Å²	39	71.2 Å²	71.2	17%	0.17	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	127.4	171.4	-152.2	-178.8	-167.4	175.4	0	107.6	V626 F658 E661 M687 I688	V626-K644 HydrophobicContact CG2-CG 4.32Å; K644-F658 HydrophobicContact CB-CE2 4.22Å; K644-F658 HydrophobicContact CB-CZ 4.46Å; K644-F658 HydrophobicContact CD-CD2 4.49Å; K644-F658 HydrophobicContact CD-CE2 3.95Å; K644-F658 HydrophobicContact CG-CE2 3.91Å; K644-E661 IonicContact NZ-OE1 2.71Å; K644-E661 PolarHBondContact NZ-OE1 3.33Å; K644-E661 IonicContact NZ-OE2 3.82Å; K644-E661 PolarHBondContact NZ-OE2 2.87Å; K644-M687 VanDerWaalsContact O-CA 3.32Å; K644-M687 WeakPolarHBondContact O-CA 3.23Å; K644-I688 HydrophobicContact CB-CB 4.24Å; K644-I688 PolarHBondContact N-O 2.03Å; K644-I688 PolarHBondContact O-N 3Å
645	T	89.1	Confident	85.5	Confident	17 Å²	17	68.2 Å²	68.2	10%	0.104	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	141.8	179.9	61.2	0	0	0	0	110.9	G624 E625 I643 M687	G624-T645 VanDerWaalsContact CA-O 3.31Å; G624-T645 WeakPolarHBondContact CA-O 3.43Å; E625-T645 PolarHBondContact N-OG1 3.15Å; E625-T645 PolarHBondContact O-N 2.75Å; E625-T645 PolarHBondContact O-OG1 2.86Å; I643-T645 HydrophobicContact CG2-CG2 4.27Å; T645-M687 HydrophobicContact CG2-CG 4.24Å
646	L	85.2	Confident	85.6	Confident	4 Å²	4	68.6 Å²	68.6	2%	0.021	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-92.7	116.8	172.5	-173.9	63.2	0	0	0	109.9	F623 Y650 R655 F658 P685 V686	F623-L646 HydrophobicContact CB-CD1 3.9Å; F623-L646 HydrophobicContact CD1-CD1 4.23Å; F623-L646 HydrophobicContact CG-CD1 4.49Å; L646-Y650 HydrophobicContact CD1-CD1 4.35Å; L646-Y650 HydrophobicContact CD1-CG 4.42Å; L646-Y650 HydrophobicContact CD2-CD1 3.46Å; L646-Y650 VanDerWaalsContact CD2-CD1 3.46Å; L646-Y650 HydrophobicContact CD2-CD2 4.38Å; L646-Y650 HydrophobicContact CD2-CE1 3.64Å; L646-Y650 HydrophobicContact CD2-CG 3.86Å; L646-Y650 HydrophobicContact CG-CD1 3.54Å; L646-Y650 HydrophobicContact CG-CE1 4.11Å; L646-Y650 HydrophobicContact CG-CG 4.05Å; L646-R655 HydrophobicContact CD2-CB 4.49Å; L646-R655 HydrophobicContact CD2-CG 4.36Å; L646-F658 HydrophobicContact CB-CD1 3.98Å; L646-F658 HydrophobicContact CB-CD2 4.43Å; L646-F658 HydrophobicContact CB-CE1 3.78Å; L646-F658 HydrophobicContact CB-CE2 4.22Å; L646-F658 HydrophobicContact CB-CG 4.3Å; L646-F658 HydrophobicContact CB-CZ 3.89Å; L646-F658 HydrophobicContact CD1-CB 4.13Å; L646-F658 HydrophobicContact CD1-CD1 4.45Å; L646-F658 HydrophobicContact CD1-CD2 4.19Å; L646-F658 HydrophobicContact CD1-CG 4.03Å; L646-F658 HydrophobicContact CD2-CD1 4.07Å; L646-F658 HydrophobicContact CD2-CG 4.37Å; L646-F658 HydrophobicContact CG-CD1 4.39Å; L646-F658 HydrophobicContact CG-CG 4.46Å; L646-P685 WeakPolarHBondContact O-CB 3.47Å; L646-V686 HydrophobicContact CB-CB 4.23Å; L646-V686 HydrophobicContact CD2-CB 4.43Å; L646-V686 PolarHBondContact N-O 2.95Å
647	K	78.4	Confident	85.6	Confident	102 Å²	102	63.8 Å²	63.8	44%	0.443	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-65.8	142.1	-178	-81.3	173.9	179.4	165.2	0	112.3	F623 E625 Y650	F623-K647 PolarHBondContact O-N 2.71Å; E625-K647 IonicContact OE1-NZ 2.63Å; K647-Y650 WeakPolarHBondContact O-CD1 3.37Å
648	G	77.1	Confident	85.7	Confident	73 Å²	73	55.3 Å²	55.3	75%	0.753	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	143.4	175.3	0	0	0	0	0	112.5
649	G	76.4	Confident	85.7	Confident	82 Å²	82	51.6 Å²	51.6	85%	0.845	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.5	13	-174.6	0	0	0	0	0	114.7
650	Y	79.6	Confident	85.5	Confident	80 Å²	80	49 Å²	49	31%	0.314	27%	0.27	S	S	.	.			trans	-58.5	153.7	173.3	61.3	-108.7	0	0	0	112.7	L646 K647 R655	L646-Y650 HydrophobicContact CD1-CD1 4.35Å; L646-Y650 HydrophobicContact CD1-CG 4.42Å; L646-Y650 HydrophobicContact CD2-CD1 3.46Å; L646-Y650 VanDerWaalsContact CD2-CD1 3.46Å; L646-Y650 HydrophobicContact CD2-CD2 4.38Å; L646-Y650 HydrophobicContact CD2-CE1 3.64Å; L646-Y650 HydrophobicContact CD2-CG 3.86Å; L646-Y650 HydrophobicContact CG-CD1 3.54Å; L646-Y650 HydrophobicContact CG-CE1 4.11Å; L646-Y650 HydrophobicContact CG-CG 4.05Å; K647-Y650 WeakPolarHBondContact O-CD1 3.37Å; Y650-R655 HydrophobicContact CD2-CB 3.79Å; Y650-R655 HydrophobicContact CD2-CG 4.37Å; Y650-R655 HydrophobicContact CE2-CB 3.78Å; Y650-R655 HydrophobicContact CE2-CG 3.9Å
651	T	82.4	Confident	85.2	Confident	75 Å²	75	45.2 Å²	45.2	46%	0.46	25%	0.254	S	S	.	.			trans	-81.4	155.8	166.3	61.7	0	0	0	0	111.4	Q653 Q654 R655	T651-Q653 PolarHBondContact O-N 2.68Å; T651-Q653 VanDerWaalsContact O-N 3.11Å; T651-Q654 PolarHBondContact O-N 3.08Å; T651-Q654 VanDerWaalsContact O-N 3.1Å; T651-Q654 WeakPolarHBondContact OG1-CG 3.5Å; T651-Q654 PolarHBondContact OG1-N 2.92Å; T651-Q654 PolarHBondContact OG1-OE1 2.89Å; T651-R655 PolarHBondContact O-N 3.08Å
652	E	81.4	Confident	85	Confident	104 Å²	104	45.1 Å²	45.1	49%	0.486	25%	0.253	S	S	.	.	H	α-helix	trans	-58.9	-23.4	173.3	-77.5	-58	120	0	0	113.3	R656	E652-R656 WeakPolarHBondContact O-CG 3.38Å; E652-R656 PolarHBondContact O-N 2.88Å; E652-R656 VanDerWaalsContact O-N 3.09Å; E652-R656 PolarHBondContact O-NH1 2.91Å
653	Q	79.6	Confident	84.8	Confident	87 Å²	87	44.6 Å²	44.6	41%	0.407	25%	0.249	S	C	.	.	H	α-helix	trans	-72.2	-50.2	172.6	-172.5	54.3	36.8	0	0	111.5	T651 R655 R656 D657	T651-Q653 PolarHBondContact O-N 2.68Å; T651-Q653 VanDerWaalsContact O-N 3.11Å; Q653-R655 PolarHBondContact O-N 2.86Å; Q653-R656 WeakPolarHBondContact O-CA 3.31Å; Q653-R656 VanDerWaalsContact O-CB 3.31Å; Q653-R656 WeakPolarHBondContact O-CB 3.46Å; Q653-R656 PolarHBondContact O-N 2.93Å; Q653-D657 WeakPolarHBondContact CG-OD2 3.43Å; Q653-D657 PolarHBondContact NE2-OD1 3.42Å; Q653-D657 PolarHBondContact NE2-OD2 3.15Å; Q653-D657 PolarHBondContact O-N 3.14Å; Q653-D657 VanDerWaalsContact O-OD2 3.11Å
654	Q	80.3	Confident	84.6	Confident	67 Å²	67	44.7 Å²	44.7	31%	0.313	25%	0.249	S	C	.	.	H	α-helix	trans	-59.5	-33.5	174.5	-71.2	162.1	-51.5	0	0	112.3	F623 T651 F658	F623-Q654 HydrophobicContact CD1-CB 4.23Å; F623-Q654 HydrophobicContact CE1-CB 4.26Å; F623-Q654 WeakPolarHBondContact CE1-O 3.46Å; T651-Q654 PolarHBondContact O-N 3.08Å; T651-Q654 VanDerWaalsContact O-N 3.1Å; T651-Q654 WeakPolarHBondContact OG1-CG 3.5Å; T651-Q654 PolarHBondContact OG1-N 2.92Å; T651-Q654 PolarHBondContact OG1-OE1 2.89Å; Q654-F658 VanDerWaalsContact O-CB 3.23Å; Q654-F658 WeakPolarHBondContact O-CB 3.34Å; Q654-F658 PolarHBondContact O-N 2.7Å
655	R	85.6	Confident	84.5	Confident	35 Å²	35	43.1 Å²	43.1	13%	0.132	24%	0.242	C	C	.	.	H	α-helix	trans	-63.1	-43.6	171.7	-169.9	-172.6	-178.2	-83.5	-14.6	112.1	N597 L646 Y650 T651 Q653 L659	N597-R655 PolarHBondContact ND2-NH1 2.97Å; N597-R655 PolarHBondContact ND2-NH2 2.81Å; N597-R655 PolarHBondContact OD1-NH2 3.11Å; L646-R655 HydrophobicContact CD2-CB 4.49Å; L646-R655 HydrophobicContact CD2-CG 4.36Å; Y650-R655 HydrophobicContact CD2-CB 3.79Å; Y650-R655 HydrophobicContact CD2-CG 4.37Å; Y650-R655 HydrophobicContact CE2-CB 3.78Å; Y650-R655 HydrophobicContact CE2-CG 3.9Å; T651-R655 PolarHBondContact O-N 3.08Å; Q653-R655 PolarHBondContact O-N 2.86Å; R655-L659 HydrophobicContact CG-CD1 4.27Å; R655-L659 WeakPolarHBondContact O-CB 3.16Å; R655-L659 VanDerWaalsContact O-CG 3.3Å; R655-L659 WeakPolarHBondContact O-CG 3.3Å; R655-L659 PolarHBondContact O-N 2.88Å
656	R	85.3	Confident	84.6	Confident	97 Å²	97	43.7 Å²	43.7	37%	0.366	25%	0.252	S	S	.	.	H	α-helix	trans	-60.8	-50.8	175.2	-82.3	-173.5	-72.8	-84.3	2.1	111.3	P596 E652 Q653 F658 L659 S660	P596-R656 HydrophobicContact CG-CB 4.41Å; P596-R656 HydrophobicContact CG-CG 3.55Å; E652-R656 WeakPolarHBondContact O-CG 3.38Å; E652-R656 PolarHBondContact O-N 2.88Å; E652-R656 VanDerWaalsContact O-N 3.09Å; E652-R656 PolarHBondContact O-NH1 2.91Å; Q653-R656 WeakPolarHBondContact O-CA 3.31Å; Q653-R656 VanDerWaalsContact O-CB 3.31Å; Q653-R656 WeakPolarHBondContact O-CB 3.46Å; Q653-R656 PolarHBondContact O-N 2.93Å; R656-F658 VanDerWaalsContact C-N 3.35Å; R656-F658 PolarHBondContact O-N 3.46Å; R656-L659 PolarHBondContact O-N 3Å; R656-S660 WeakPolarHBondContact O-CB 3.37Å; R656-S660 PolarHBondContact O-N 3.37Å; R656-S660 PolarHBondContact O-OG 2.89Å
657	D	83.8	Confident	85	Confident	46 Å²	46	44.6 Å²	44.6	25%	0.246	26%	0.256	C	S	.	.	H	α-helix	trans	-68.8	-35	-173.4	-59	-33.5	0	0	0	111.7	F623 Q653 S660 E661	F623-D657 HydrophobicContact CE1-CB 3.96Å; F623-D657 HydrophobicContact CZ-CB 3.84Å; Q653-D657 WeakPolarHBondContact CG-OD2 3.43Å; Q653-D657 PolarHBondContact NE2-OD1 3.42Å; Q653-D657 PolarHBondContact NE2-OD2 3.15Å; Q653-D657 PolarHBondContact O-N 3.14Å; Q653-D657 VanDerWaalsContact O-OD2 3.11Å; D657-S660 WeakPolarHBondContact CA-OG 3.31Å; D657-S660 PolarHBondContact O-OG 2.69Å; D657-E661 PolarHBondContact O-N 2.82Å
658	F	86.8	Confident	85.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63	-45.7	170.3	-172.7	-104	0	0	0	112.6	F623 K644 L646 Q654 R656 V686 I688	F623-F658 HydrophobicContact CB-CD2 3.51Å; F623-F658 HydrophobicContact CB-CE2 3.98Å; F623-F658 HydrophobicContact CB-CG 4.45Å; F623-F658 HydrophobicContact CD1-CB 4.03Å; F623-F658 HydrophobicContact CD1-CD2 4.31Å; F623-F658 AromaticContact CD2-CD2 3.97Å; F623-F658 HydrophobicContact CD2-CD2 3.97Å; F623-F658 HydrophobicContact CE1-CB 4.37Å; F623-F658 HydrophobicContact CG-CB 4.2Å; F623-F658 AromaticContact CG-CD2 3.66Å; F623-F658 HydrophobicContact CG-CD2 3.66Å; F623-F658 HydrophobicContact CG-CG 4.4Å; K644-F658 HydrophobicContact CB-CE2 4.22Å; K644-F658 HydrophobicContact CB-CZ 4.46Å; K644-F658 HydrophobicContact CD-CD2 4.49Å; K644-F658 HydrophobicContact CD-CE2 3.95Å; K644-F658 HydrophobicContact CG-CE2 3.91Å; L646-F658 HydrophobicContact CB-CD1 3.98Å; L646-F658 HydrophobicContact CB-CD2 4.43Å; L646-F658 HydrophobicContact CB-CE1 3.78Å; L646-F658 HydrophobicContact CB-CE2 4.22Å; L646-F658 HydrophobicContact CB-CG 4.3Å; L646-F658 HydrophobicContact CB-CZ 3.89Å; L646-F658 HydrophobicContact CD1-CB 4.13Å; L646-F658 HydrophobicContact CD1-CD1 4.45Å; L646-F658 HydrophobicContact CD1-CD2 4.19Å; L646-F658 HydrophobicContact CD1-CG 4.03Å; L646-F658 HydrophobicContact CD2-CD1 4.07Å; L646-F658 HydrophobicContact CD2-CG 4.37Å; L646-F658 HydrophobicContact CG-CD1 4.39Å; L646-F658 HydrophobicContact CG-CG 4.46Å; Q654-F658 VanDerWaalsContact O-CB 3.23Å; Q654-F658 WeakPolarHBondContact O-CB 3.34Å; Q654-F658 PolarHBondContact O-N 2.7Å; R656-F658 VanDerWaalsContact C-N 3.35Å; R656-F658 PolarHBondContact O-N 3.46Å; F658-V686 HydrophobicContact CD1-CG1 4.27Å; F658-V686 HydrophobicContact CE1-CB 4.26Å; F658-V686 HydrophobicContact CE1-CG1 3.86Å; F658-I688 HydrophobicContact CD1-CD1 3.82Å; F658-I688 HydrophobicContact CD1-CG1 4.26Å; F658-I688 HydrophobicContact CD2-CD1 3.89Å; F658-I688 HydrophobicContact CE1-CD1 3.59Å; F658-I688 HydrophobicContact CE1-CG1 3.62Å; F658-I688 HydrophobicContact CE2-CD1 3.71Å; F658-I688 HydrophobicContact CE2-CG1 4.31Å; F658-I688 HydrophobicContact CG-CD1 3.97Å; F658-I688 HydrophobicContact CZ-CB 4.44Å; F658-I688 HydrophobicContact CZ-CD1 3.56Å; F658-I688 HydrophobicContact CZ-CG1 3.67Å; F658-I688 WeakPolarHBondContact O-CD1 3.36Å
659	L	88.8	Confident	86.3	Confident	2 Å²	2	44 Å²	44	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-75	-28.9	-178.5	-69.6	179.3	0	0	0	113.1	P596 V600 R655 R656 S663 T681 V686	P596-L659 HydrophobicContact CB-CB 4.08Å; P596-L659 HydrophobicContact CB-CD1 4.02Å; V600-L659 HydrophobicContact CG2-CB 3.8Å; V600-L659 HydrophobicContact CG2-CD2 4.11Å; V600-L659 HydrophobicContact CG2-CG 4.4Å; V600-L659 VanDerWaalsContact CG2-O 3.31Å; V600-L659 WeakPolarHBondContact CG2-O 3.46Å; R655-L659 HydrophobicContact CG-CD1 4.27Å; R655-L659 WeakPolarHBondContact O-CB 3.16Å; R655-L659 VanDerWaalsContact O-CG 3.3Å; R655-L659 WeakPolarHBondContact O-CG 3.3Å; R655-L659 PolarHBondContact O-N 2.88Å; R656-L659 PolarHBondContact O-N 3Å; L659-S663 PolarHBondContact O-N 3.14Å; L659-S663 VanDerWaalsContact O-N 3.12Å; L659-S663 PolarHBondContact O-OG 3.11Å; L659-T681 HydrophobicContact CD2-CG2 4.08Å; L659-V686 HydrophobicContact CD2-CG1 4.03Å
660	S	86.6	Confident	87.2	Confident	12 Å²	12	42.4 Å²	42.4	8%	0.084	21%	0.206	C	C	.	.	H	α-helix	trans	-69.4	-38.3	174.4	67.2	0	0	0	0	111.5	R656 D657 A662 S663 I664	R656-S660 WeakPolarHBondContact O-CB 3.37Å; R656-S660 PolarHBondContact O-N 3.37Å; R656-S660 PolarHBondContact O-OG 2.89Å; D657-S660 WeakPolarHBondContact CA-OG 3.31Å; D657-S660 PolarHBondContact O-OG 2.69Å; S660-A662 VanDerWaalsContact C-N 3.32Å; S660-A662 PolarHBondContact O-N 3.44Å; S660-S663 CarbonylContact O-C 3.52Å; S660-S663 WeakPolarHBondContact O-CA 3.24Å; S660-S663 WeakPolarHBondContact O-CB 3.25Å; S660-S663 PolarHBondContact O-N 3.01Å; S660-I664 VanDerWaalsContact O-CG1 3.3Å; S660-I664 WeakPolarHBondContact O-CG1 3.33Å; S660-I664 PolarHBondContact O-N 3.44Å
661	E	87.4	Confident	87.9	Confident	14 Å²	14	42.7 Å²	42.7	7%	0.065	22%	0.218	C	C	.	.	H	α-helix	trans	-53.5	-47.2	173.9	-167.4	-169.3	158.7	0	0	111.9	K644 D657 I664 M665	K644-E661 IonicContact NZ-OE1 2.71Å; K644-E661 PolarHBondContact NZ-OE1 3.33Å; K644-E661 IonicContact NZ-OE2 3.82Å; K644-E661 PolarHBondContact NZ-OE2 2.87Å; D657-E661 PolarHBondContact O-N 2.82Å; E661-I664 PolarHBondContact O-N 2.82Å; E661-M665 HydrophobicContact CG-CE 4.08Å; E661-M665 WeakPolarHBondContact O-CG 3.16Å; E661-M665 PolarHBondContact O-N 2.91Å
662	A	90.5	Very high	88.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.6	-40	174.2	0	0	0	0	0	112.8	S660 I664 M665 G666 L676 V679 I688	S660-A662 VanDerWaalsContact C-N 3.32Å; S660-A662 PolarHBondContact O-N 3.44Å; A662-I664 VanDerWaalsContact C-N 3.31Å; A662-I664 PolarHBondContact O-N 2.85Å; A662-M665 PolarHBondContact O-N 2.74Å; A662-G666 PolarHBondContact O-N 2.84Å; A662-L676 HydrophobicContact CB-CD1 4.5Å; A662-L676 WeakPolarHBondContact O-CD2 3.3Å; A662-V679 HydrophobicContact CB-CG1 3.66Å; A662-I688 HydrophobicContact CB-CD1 4Å; A662-I688 HydrophobicContact CB-CG1 4.04Å; A662-I688 HydrophobicContact CB-CG2 4.11Å
663	S	90.5	Very high	89.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-67.3	-30.5	179.2	-56.8	0	0	0	0	113	P590 V600 F603 L659 S660 Q667	P590-S663 VanDerWaalsContact CG-CB 3.49Å; V600-S663 WeakPolarHBondContact CG2-OG 3.17Å; V600-S663 PolarHBondContact N-OG 2.94Å; F603-S663 WeakPolarHBondContact CB-O 3.4Å; L659-S663 PolarHBondContact O-N 3.14Å; L659-S663 VanDerWaalsContact O-N 3.12Å; L659-S663 PolarHBondContact O-OG 3.11Å; S660-S663 CarbonylContact O-C 3.52Å; S660-S663 WeakPolarHBondContact O-CA 3.24Å; S660-S663 WeakPolarHBondContact O-CB 3.25Å; S660-S663 PolarHBondContact O-N 3.01Å; S663-Q667 PolarHBondContact O-NE2 3.03Å; S663-Q667 VanDerWaalsContact O-NE2 3.14Å
664	I	89.5	Confident	90.1	Very high	3 Å²	3	31.5 Å²	31.5	2%	0.015	16%	0.161	C	C	.	.	H	α-helix	trans	-71.4	-52.8	172.2	-66.8	169.9	0	0	0	109.6	Y587 P590 S660 E661 A662 G666 Q667 F668 F733 F756	Y587-I664 HydrophobicContact CE2-CG2 4.4Å; P590-I664 HydrophobicContact CG-CG1 3.97Å; S660-I664 VanDerWaalsContact O-CG1 3.3Å; S660-I664 WeakPolarHBondContact O-CG1 3.33Å; S660-I664 PolarHBondContact O-N 3.44Å; E661-I664 PolarHBondContact O-N 2.82Å; A662-I664 VanDerWaalsContact C-N 3.31Å; A662-I664 PolarHBondContact O-N 2.85Å; I664-G666 VanDerWaalsContact C-N 3.28Å; I664-G666 PolarHBondContact O-N 3.46Å; I664-Q667 PolarHBondContact O-N 2.03Å; I664-F668 HydrophobicContact CG2-CD2 4.46Å; I664-F668 HydrophobicContact CG2-CE2 3.71Å; I664-F668 WeakPolarHBondContact O-CD2 3.47Å; I664-F733 HydrophobicContact CG2-CE2 3.9Å; I664-F733 HydrophobicContact CG2-CZ 3.61Å; I664-F756 HydrophobicContact CB-CB 4.38Å; I664-F756 HydrophobicContact CD1-CB 4.42Å; I664-F756 HydrophobicContact CG2-CB 3.81Å; I664-F756 HydrophobicContact CG2-CD1 3.88Å; I664-F756 HydrophobicContact CG2-CD2 4.47Å; I664-F756 HydrophobicContact CG2-CG 3.8Å
665	M	91.2	Very high	90.8	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.025	16%	0.162	C	C	.	.	H	α-helix	trans	-58.9	-37.6	-179.3	-72	-172.7	-68.7	0	0	112.9	E661 A662 Q667 F668 I674 L676 I688 T690 F756	E661-M665 HydrophobicContact CG-CE 4.08Å; E661-M665 WeakPolarHBondContact O-CG 3.16Å; E661-M665 PolarHBondContact O-N 2.91Å; A662-M665 PolarHBondContact O-N 2.74Å; M665-Q667 PolarHBondContact O-N 2.82Å; M665-F668 PolarHBondContact O-N 2.88Å; M665-I674 HydrophobicContact CG-CG2 4.47Å; M665-I674 HydrophobicContact SD-CG2 3.84Å; M665-L676 HydrophobicContact CB-CB 4.1Å; M665-L676 HydrophobicContact CE-CD1 4.29Å; M665-I688 HydrophobicContact CE-CG2 3.85Å; M665-T690 HydrophobicContact CE-CG2 4.05Å; M665-T690 HydrophobicContact SD-CG2 3.92Å; M665-F756 HydrophobicContact CG-CD2 3.48Å; M665-F756 VanDerWaalsContact CG-CD2 3.48Å; M665-F756 HydrophobicContact CG-CE2 3.75Å; M665-F756 HydrophobicContact SD-CD2 4.29Å
666	G	91	Very high	91.2	Very high	30 Å²	30	30.9 Å²	30.9	31%	0.309	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-20.3	180	0	0	0	0	0	115.1	F603 A662 I664	F603-G666 CarbonylContact O-C 3.57Å; F603-G666 VanDerWaalsContact O-CA 3.28Å; F603-G666 WeakPolarHBondContact O-CA 3.37Å; A662-G666 PolarHBondContact O-N 2.84Å; I664-G666 VanDerWaalsContact C-N 3.28Å; I664-G666 PolarHBondContact O-N 3.46Å
667	Q	91.9	Very high	91.6	Very high	22 Å²	22	27.6 Å²	27.6	10%	0.103	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-20.5	179.4	-68	-179.9	66.2	0	0	113.7	I588 F603 S663 I664 M665	I588-Q667 PolarHBondContact O-NE2 3.5Å; I588-Q667 PolarHBondContact O-OE1 2.91Å; F603-Q667 HydrophobicContact CB-CG 4.05Å; F603-Q667 HydrophobicContact CD1-CG 3.53Å; F603-Q667 HydrophobicContact CD2-CG 4.43Å; F603-Q667 HydrophobicContact CE1-CG 4.12Å; F603-Q667 HydrophobicContact CG-CG 3.73Å; S663-Q667 PolarHBondContact O-NE2 3.03Å; S663-Q667 VanDerWaalsContact O-NE2 3.14Å; I664-Q667 PolarHBondContact O-N 2.03Å; M665-Q667 PolarHBondContact O-N 2.82Å
668	F	91.9	Very high	92.1	Very high	9 Å²	9	25.4 Å²	25.4	4%	0.039	14%	0.137	C	C	.	.			trans	-99.6	139	-175.2	-57.5	-55.9	0	0	0	112.7	Y587 I664 M665 I673 L728 M731 F733 F756	Y587-F668 HydrophobicContact CD2-CE1 4.22Å; Y587-F668 AromaticContact CD2-CZ 3.71Å; Y587-F668 HydrophobicContact CD2-CZ 3.71Å; Y587-F668 HydrophobicContact CE2-CZ 4.1Å; I664-F668 HydrophobicContact CG2-CD2 4.46Å; I664-F668 HydrophobicContact CG2-CE2 3.71Å; I664-F668 WeakPolarHBondContact O-CD2 3.47Å; M665-F668 PolarHBondContact O-N 2.88Å; F668-I673 HydrophobicContact CB-CD1 4.15Å; F668-I673 HydrophobicContact CB-CG2 4.1Å; F668-I673 HydrophobicContact CG-CD1 4.45Å; F668-L728 HydrophobicContact CD1-CD2 3.78Å; F668-L728 HydrophobicContact CD2-CD2 3.84Å; F668-L728 HydrophobicContact CE1-CD2 3.65Å; F668-L728 HydrophobicContact CE2-CD2 3.69Å; F668-L728 HydrophobicContact CG-CD2 3.9Å; F668-L728 HydrophobicContact CZ-CD2 3.62Å; F668-M731 HydrophobicContact CD1-CG 4.34Å; F668-M731 HydrophobicContact CE1-CB 4.05Å; F668-M731 HydrophobicContact CE1-CE 4.4Å; F668-M731 HydrophobicContact CE1-CG 4.24Å; F668-F733 HydrophobicContact CE1-CB 4.25Å; F668-F733 HydrophobicContact CE1-CG 4.35Å; F668-F733 HydrophobicContact CE2-CD1 4.18Å; F668-F733 HydrophobicContact CE2-CD2 4.41Å; F668-F733 HydrophobicContact CE2-CE1 4.09Å; F668-F733 HydrophobicContact CE2-CE2 4.32Å; F668-F733 HydrophobicContact CE2-CG 4.31Å; F668-F733 HydrophobicContact CE2-CZ 4.12Å; F668-F733 HydrophobicContact CZ-CB 3.9Å; F668-F733 AromaticContact CZ-CD1 3.78Å; F668-F733 HydrophobicContact CZ-CD1 3.78Å; F668-F733 AromaticContact CZ-CD2 3.74Å; F668-F733 HydrophobicContact CZ-CD2 3.74Å; F668-F733 HydrophobicContact CZ-CE1 4.13Å; F668-F733 HydrophobicContact CZ-CE2 4.09Å; F668-F733 AromaticContact CZ-CG 3.53Å; F668-F733 HydrophobicContact CZ-CG 3.53Å; F668-F733 HydrophobicContact CZ-CZ 4.23Å; F668-F756 HydrophobicContact CD2-CE1 4.39Å; F668-F756 HydrophobicContact CD2-CZ 4.28Å; F668-F756 HydrophobicContact CE2-CE1 4.18Å
669	Q	91	Very high	92.5	Very high	155 Å²	155	25.5 Å²	25.5	72%	0.724	14%	0.137	S	C	*	.			trans	-141.5	90.3	176.5	-168.7	173.5	36.6	0	0	110.3
670	H	95.3	Very high	92.7	Very high	47 Å²	47	25.4 Å²	25.4	22%	0.218	14%	0.137	C	C	.	.			trans	-146.5	141	-177.5	-172.5	-97.4	0	0	0	110.7	N672 I673 A723 H727	H670-N672 PolarHBondContact ND1-N 2.95Å; H670-N672 VanDerWaalsContact ND1-N 3.17Å; H670-N672 PolarHBondContact O-N 2.87Å; H670-I673 HydrophobicContact CB-CB 4.32Å; H670-I673 HydrophobicContact CB-CD1 3.91Å; H670-I673 HydrophobicContact CB-CG1 4.11Å; H670-I673 PolarHBondContact O-N 3.33Å; H670-I673 VanDerWaalsContact O-N 3.09Å; H670-A723 VanDerWaalsContact CE1-C 3.42Å; H670-A723 PolarHBondContact CE1-O 2.82Å; H670-H727 HydrophobicContact CB-CB 4.13Å; H670-H727 AromaticContact CD2-CG 3.92Å; H670-H727 AromaticContact CD2-ND1 3.96Å; H670-H727 AromaticContact CG-CG 3.87Å
671	P	95.6	Very high	92.9	Very high	87 Å²	87	26.6 Å²	26.6	57%	0.565	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-13.3	-178.8	24	-36.8	0	0	0	115.5	K752	P671-K752 WeakPolarHBondContact O-CE 3.07Å
672	N	97.6	Very high	92.9	Very high	20 Å²	20	31.4 Å²	31.4	11%	0.107	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	22.7	177.4	-58.6	103.4	0	0	0	114	H670 G720 C751 K752 V753	H670-N672 PolarHBondContact ND1-N 2.95Å; H670-N672 VanDerWaalsContact ND1-N 3.17Å; H670-N672 PolarHBondContact O-N 2.87Å; N672-G720 WeakPolarHBondContact CB-O 3.33Å; N672-G720 VanDerWaalsContact ND2-CA 3.25Å; N672-G720 WeakPolarHBondContact ND2-CA 3.05Å; N672-C751 PolarHBondContact ND2-O 2.86Å; N672-K752 WeakPolarHBondContact O-CA 3.41Å; N672-V753 PolarHBondContact O-N 3.02Å
673	I	96	Very high	92.5	Very high	4 Å²	4	33 Å²	33	2%	0.021	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-123	143.4	166.8	-63.6	172.2	0	0	0	106.9	F668 H670 H675 H727 L728 F756	F668-I673 HydrophobicContact CB-CD1 4.15Å; F668-I673 HydrophobicContact CB-CG2 4.1Å; F668-I673 HydrophobicContact CG-CD1 4.45Å; H670-I673 HydrophobicContact CB-CB 4.32Å; H670-I673 HydrophobicContact CB-CD1 3.91Å; H670-I673 HydrophobicContact CB-CG1 4.11Å; H670-I673 PolarHBondContact O-N 3.33Å; H670-I673 VanDerWaalsContact O-N 3.09Å; I673-H675 PolarHBondContact O-N 2.8Å; I673-H727 HydrophobicContact CD1-CB 4.2Å; I673-H727 VanDerWaalsContact CD1-CD2 3.46Å; I673-H727 WeakPolarHBondContact CD1-CD2 3.24Å; I673-L728 HydrophobicContact CD1-CD2 3.64Å; I673-L728 HydrophobicContact CD1-CG 3.87Å; I673-F756 HydrophobicContact CG2-CE2 4.34Å; I673-F756 HydrophobicContact CG2-CZ 3.92Å
674	I	95.4	Very high	92	Very high	6 Å²	6	38.7 Å²	38.7	3%	0.031	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-61	129.2	179.9	-166.4	68.8	0	0	0	110.9	M665 T690 E691 M693 L744 V753 F756	M665-I674 HydrophobicContact CG-CG2 4.47Å; M665-I674 HydrophobicContact SD-CG2 3.84Å; I674-T690 HydrophobicContact CG1-CG2 4.35Å; I674-E691 HydrophobicContact CD1-CG 3.51Å; I674-E691 HydrophobicContact CG1-CG 4.34Å; I674-M693 HydrophobicContact CD1-CG 3.59Å; I674-M693 HydrophobicContact CD1-SD 4Å; I674-L744 HydrophobicContact CD1-CD1 3.98Å; I674-L744 HydrophobicContact CG1-CD1 4.48Å; I674-V753 PolarHBondContact N-O 3.43Å; I674-F756 HydrophobicContact CG2-CE2 4.13Å
675	H	94.5	Very high	91.9	Very high	75 Å²	75	41.1 Å²	41.1	35%	0.347	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-87.2	127.9	-177.9	-171.4	45.1	0	0	0	111.9	I673 T690 E691	I673-H675 PolarHBondContact O-N 2.8Å; H675-T690 CarbonylContact O-C 3.58Å; H675-T690 VanDerWaalsContact O-CA 3.23Å; H675-T690 WeakPolarHBondContact O-CA 3.33Å; H675-T690 WeakPolarHBondContact O-CB 3.44Å; H675-E691 HydrophobicContact CB-CB 4.5Å; H675-E691 HydrophobicContact CB-CG 4.21Å; H675-E691 VanDerWaalsContact CB-OE1 3.25Å; H675-E691 WeakPolarHBondContact CB-OE1 3.1Å; H675-E691 PolarHBondContact N-OE1 3.22Å; H675-E691 PolarHBondContact O-N 2.77Å
676	L	95.2	Very high	91.8	Very high	15 Å²	15	41.4 Å²	41.4	8%	0.079	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	116	166.1	-177.2	74.4	0	0	0	110.2	A604 A662 M665 G678 I688 T690	A604-L676 HydrophobicContact CB-CD2 3.68Å; A662-L676 HydrophobicContact CB-CD1 4.5Å; A662-L676 WeakPolarHBondContact O-CD2 3.3Å; M665-L676 HydrophobicContact CB-CB 4.1Å; M665-L676 HydrophobicContact CE-CD1 4.29Å; L676-G678 WeakPolarHBondContact CD1-O 3.26Å; L676-I688 HydrophobicContact CD1-CG2 3.59Å; L676-T690 HydrophobicContact CD1-CG2 4.38Å
677	E	94.2	Very high	91.9	Very high	28 Å²	28	40.7 Å²	40.7	13%	0.131	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-32.9	171.5	-76.7	-77.7	-179.1	0	0	111.5	L631 R636 V641 L689	L631-E677 HydrophobicContact CD2-CB 3.91Å; L631-E677 HydrophobicContact CD2-CG 4.21Å; R636-E677 IonicContact NH1-OE2 3.79Å; V641-E677 HydrophobicContact CG1-CG 4.2Å; E677-L689 HydrophobicContact CB-CB 4.37Å; E677-L689 PolarHBondContact N-O 2.81Å
678	G	93.6	Very high	92	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.8	-167.4	173.1	0	0	0	0	0	114.2	K605 L676 L689	K605-G678 CarbonylContact O-C 3.57Å; K605-G678 WeakPolarHBondContact O-CA 3.49Å; L676-G678 WeakPolarHBondContact CD1-O 3.26Å; G678-L689 PolarHBondContact N-O 2.86Å; G678-L689 PolarHBondContact O-N 2.86Å
679	V	95.2	Very high	92.1	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	161.1	-179.9	-67.3	0	0	0	0	110.4	V600 A604 K605 E606 I607 A662 T681 M687 I688	V600-V679 HydrophobicContact CG1-CB 4.42Å; V600-V679 HydrophobicContact CG1-CG1 4.36Å; V600-V679 HydrophobicContact CG1-CG2 3.66Å; A604-V679 HydrophobicContact CB-CG1 3.96Å; A604-V679 HydrophobicContact CB-CG2 4Å; K605-V679 PolarHBondContact O-N 2.9Å; E606-V679 CarbonylContact C-O 3.55Å; E606-V679 WeakPolarHBondContact CA-O 3.06Å; I607-V679 PolarHBondContact N-O 3.21Å; A662-V679 HydrophobicContact CB-CG1 3.66Å; V679-T681 HydrophobicContact CB-CG2 4.38Å; V679-T681 HydrophobicContact CG2-CG2 4.2Å; V679-M687 CarbonylContact C-O 3.52Å; V679-M687 WeakPolarHBondContact CA-O 3.2Å; V679-I688 HydrophobicContact CG1-CG1 4.43Å
680	I	93.7	Very high	92.3	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	102.6	168.1	-48.4	175.4	0	0	0	106.9	I607 A609 V612 S683 V686 M687 L689	I607-I680 HydrophobicContact CB-CG1 4.16Å; I607-I680 HydrophobicContact CG2-CG1 4.5Å; I607-I680 WeakPolarHBondContact O-CG1 3.48Å; A609-I680 HydrophobicContact CB-CD1 4.41Å; A609-I680 HydrophobicContact CB-CG2 4.2Å; V612-I680 HydrophobicContact CB-CD1 4.31Å; V612-I680 HydrophobicContact CG2-CD1 3.88Å; I680-S683 WeakPolarHBondContact CG2-OG 3.48Å; I680-V686 WeakPolarHBondContact O-CA 3.45Å; I680-V686 WeakPolarHBondContact O-CG1 3.32Å; I680-M687 HydrophobicContact CB-CB 4.17Å; I680-M687 HydrophobicContact CB-CE 4.14Å; I680-M687 HydrophobicContact CD1-CB 4.37Å; I680-M687 HydrophobicContact CD1-CE 3.57Å; I680-M687 HydrophobicContact CD1-SD 4.19Å; I680-M687 HydrophobicContact CG1-CB 4.39Å; I680-M687 HydrophobicContact CG1-CE 4.4Å; I680-M687 HydrophobicContact CG2-CE 4.21Å; I680-M687 PolarHBondContact N-O 3.29Å; I680-M687 PolarHBondContact O-N 2.89Å; I680-L689 HydrophobicContact CD1-CD1 3.91Å; I680-L689 HydrophobicContact CG1-CD1 3.89Å
681	T	90.8	Very high	92.2	Very high	37 Å²	37	32.5 Å²	32.5	23%	0.227	19%	0.194	C	C	.	.			trans	-103.2	-16.2	-179.2	61.7	0	0	0	0	112.6	V600 E606 L659 V679 V686	V600-T681 HydrophobicContact CG1-CG2 4.04Å; E606-T681 VanDerWaalsContact CD-OG1 3.29Å; E606-T681 PolarHBondContact OE1-N 2.66Å; E606-T681 PolarHBondContact OE1-OG1 2.64Å; E606-T681 PolarHBondContact OE2-N 2.79Å; E606-T681 VanDerWaalsContact OE2-N 3.11Å; E606-T681 PolarHBondContact OE2-OG1 3.31Å; L659-T681 HydrophobicContact CD2-CG2 4.08Å; V679-T681 HydrophobicContact CB-CG2 4.38Å; V679-T681 HydrophobicContact CG2-CG2 4.2Å; T681-V686 HydrophobicContact CG2-CG1 4.39Å
682	T	85.7	Confident	92.2	Very high	115 Å²	115	30.2 Å²	30.2	71%	0.706	18%	0.175	S	C	*	.	S	Bend	trans	-85.6	-7.1	-177.7	48.3	0	0	0	0	115	E606	E606-T682 WeakPolarHBondContact OE1-CB 3.23Å; E606-T682 WeakPolarHBondContact OE1-CG2 3.35Å; E606-T682 PolarHBondContact OE1-N 3.15Å; E606-T682 PolarHBondContact OE1-OG1 3.06Å
683	S	83.3	Confident	92.1	Very high	35 Å²	35	29.7 Å²	29.7	25%	0.245	17%	0.172	C	C	.	.	S	Bend	trans	-115.1	161.7	174.6	67.2	0	0	0	0	112.5	I680 P685 M687	I680-S683 WeakPolarHBondContact CG2-OG 3.48Å; S683-P685 CarbonylContact C-O 3.44Å; S683-P685 CarbonylContact O-C 3.57Å; S683-P685 VanDerWaalsContact O-C 3.31Å; S683-P685 VanDerWaalsContact O-O 3.11Å; S683-P685 PolarHBondContact OG-O 2.87Å; S683-M687 WeakPolarHBondContact OG-CE 3.47Å
684	C	79.8	Confident	92	Very high	118 Å²	118	34.3 Å²	34.3	80%	0.797	19%	0.194	S	C	*	.	S	Bend	trans	-110.8	126.1	165.4	-170.2	0	0	0	0	109.2
685	P	87	Confident	91.9	Very high	54 Å²	54	36.7 Å²	36.7	35%	0.351	21%	0.207	S	C	.	.	S	Bend	cis	-69.9	160	-0.8	31.5	-36.5	0	0	0	113.2	L646 S683	L646-P685 WeakPolarHBondContact O-CB 3.47Å; S683-P685 CarbonylContact C-O 3.44Å; S683-P685 CarbonylContact O-C 3.57Å; S683-P685 VanDerWaalsContact O-C 3.31Å; S683-P685 VanDerWaalsContact O-O 3.11Å; S683-P685 PolarHBondContact OG-O 2.87Å
686	V	89.8	Confident	91.8	Very high	11 Å²	11	34.5 Å²	34.5	7%	0.067	20%	0.204	C	C	.	.			trans	-73.9	139.7	169.3	-177.1	0	0	0	0	108.4	L646 F658 L659 I680 T681	L646-V686 HydrophobicContact CB-CB 4.23Å; L646-V686 HydrophobicContact CD2-CB 4.43Å; L646-V686 PolarHBondContact N-O 2.95Å; F658-V686 HydrophobicContact CD1-CG1 4.27Å; F658-V686 HydrophobicContact CE1-CB 4.26Å; F658-V686 HydrophobicContact CE1-CG1 3.86Å; L659-V686 HydrophobicContact CD2-CG1 4.03Å; I680-V686 WeakPolarHBondContact O-CA 3.45Å; I680-V686 WeakPolarHBondContact O-CG1 3.32Å; T681-V686 HydrophobicContact CG2-CG1 4.39Å
687	M	92.5	Very high	91.7	Very high	15 Å²	15	35 Å²	35	7%	0.074	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	145.4	-173.5	-61.1	178.7	-93.6	0	0	113.1	I614 I643 K644 T645 V679 I680 S683 L689	I614-M687 HydrophobicContact CD1-SD 4.29Å; I643-M687 HydrophobicContact CG2-CB 4.1Å; I643-M687 HydrophobicContact CG2-CG 4.11Å; I643-M687 HydrophobicContact CG2-SD 3.88Å; K644-M687 VanDerWaalsContact O-CA 3.32Å; K644-M687 WeakPolarHBondContact O-CA 3.23Å; T645-M687 HydrophobicContact CG2-CG 4.24Å; V679-M687 CarbonylContact C-O 3.52Å; V679-M687 WeakPolarHBondContact CA-O 3.2Å; I680-M687 HydrophobicContact CB-CB 4.17Å; I680-M687 HydrophobicContact CB-CE 4.14Å; I680-M687 HydrophobicContact CD1-CB 4.37Å; I680-M687 HydrophobicContact CD1-CE 3.57Å; I680-M687 HydrophobicContact CD1-SD 4.19Å; I680-M687 HydrophobicContact CG1-CB 4.39Å; I680-M687 HydrophobicContact CG1-CE 4.4Å; I680-M687 HydrophobicContact CG2-CE 4.21Å; I680-M687 PolarHBondContact N-O 3.29Å; I680-M687 PolarHBondContact O-N 2.89Å; S683-M687 WeakPolarHBondContact OG-CE 3.47Å; M687-L689 HydrophobicContact CB-CD1 4.08Å
688	I	93.2	Very high	91.8	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128.4	170.6	-58.2	167.3	0	0	0	107.6	I643 K644 F658 A662 M665 L676 V679	I643-I688 WeakPolarHBondContact CA-O 3.47Å; K644-I688 HydrophobicContact CB-CB 4.24Å; K644-I688 PolarHBondContact N-O 2.03Å; K644-I688 PolarHBondContact O-N 3Å; F658-I688 HydrophobicContact CD1-CD1 3.82Å; F658-I688 HydrophobicContact CD1-CG1 4.26Å; F658-I688 HydrophobicContact CD2-CD1 3.89Å; F658-I688 HydrophobicContact CE1-CD1 3.59Å; F658-I688 HydrophobicContact CE1-CG1 3.62Å; F658-I688 HydrophobicContact CE2-CD1 3.71Å; F658-I688 HydrophobicContact CE2-CG1 4.31Å; F658-I688 HydrophobicContact CG-CD1 3.97Å; F658-I688 HydrophobicContact CZ-CB 4.44Å; F658-I688 HydrophobicContact CZ-CD1 3.56Å; F658-I688 HydrophobicContact CZ-CG1 3.67Å; F658-I688 WeakPolarHBondContact O-CD1 3.36Å; A662-I688 HydrophobicContact CB-CD1 4Å; A662-I688 HydrophobicContact CB-CG1 4.04Å; A662-I688 HydrophobicContact CB-CG2 4.11Å; M665-I688 HydrophobicContact CE-CG2 3.85Å; L676-I688 HydrophobicContact CD1-CG2 3.59Å; V679-I688 HydrophobicContact CG1-CG1 4.43Å
689	L	94.8	Very high	91.9	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	114.9	-177.3	-74.9	81.8	0	0	0	110.4	I607 V612 L631 V641 A642 I643 E677 G678 I680 M687	I607-L689 HydrophobicContact CD1-CD2 4.23Å; V612-L689 HydrophobicContact CB-CD2 4.49Å; V612-L689 HydrophobicContact CG1-CD2 4.06Å; V612-L689 HydrophobicContact CG2-CD2 3.54Å; L631-L689 HydrophobicContact CD1-CD2 4.26Å; V641-L689 HydrophobicContact CG2-CD2 4.14Å; A642-L689 WeakPolarHBondContact O-CA 3.29Å; I643-L689 HydrophobicContact CG1-CG 4.31Å; E677-L689 HydrophobicContact CB-CB 4.37Å; E677-L689 PolarHBondContact N-O 2.81Å; G678-L689 PolarHBondContact N-O 2.86Å; G678-L689 PolarHBondContact O-N 2.86Å; I680-L689 HydrophobicContact CD1-CD1 3.91Å; I680-L689 HydrophobicContact CG1-CD1 3.89Å; M687-L689 HydrophobicContact CB-CD1 4.08Å
690	T	95.1	Very high	91.7	Very high	22 Å²	22	38.7 Å²	38.7	14%	0.135	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	164.9	171.6	53.9	0	0	0	0	111	V641 A642 M665 I674 H675 L676	V641-T690 CarbonylContact C-O 3.52Å; V641-T690 VanDerWaalsContact CA-O 3.28Å; V641-T690 WeakPolarHBondContact CA-O 3.31Å; V641-T690 WeakPolarHBondContact CB-O 3.22Å; A642-T690 PolarHBondContact N-O 2.87Å; A642-T690 PolarHBondContact O-N 2.88Å; M665-T690 HydrophobicContact CE-CG2 4.05Å; M665-T690 HydrophobicContact SD-CG2 3.92Å; I674-T690 HydrophobicContact CG1-CG2 4.35Å; H675-T690 CarbonylContact O-C 3.58Å; H675-T690 VanDerWaalsContact O-CA 3.23Å; H675-T690 WeakPolarHBondContact O-CA 3.33Å; H675-T690 WeakPolarHBondContact O-CB 3.44Å; L676-T690 HydrophobicContact CD1-CG2 4.38Å
691	E	94.3	Very high	91.8	Very high	37 Å²	37	39.6 Å²	39.6	17%	0.173	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	141	169.5	66.6	-176.5	132.6	0	0	111.4	I674 H675 M693 K752	I674-E691 HydrophobicContact CD1-CG 3.51Å; I674-E691 HydrophobicContact CG1-CG 4.34Å; H675-E691 HydrophobicContact CB-CB 4.5Å; H675-E691 HydrophobicContact CB-CG 4.21Å; H675-E691 VanDerWaalsContact CB-OE1 3.25Å; H675-E691 WeakPolarHBondContact CB-OE1 3.1Å; H675-E691 PolarHBondContact N-OE1 3.22Å; H675-E691 PolarHBondContact O-N 2.77Å; E691-M693 HydrophobicContact CG-SD 4.13Å; E691-K752 VanDerWaalsContact OE1-CD 3.23Å; E691-K752 WeakPolarHBondContact OE1-CD 3.37Å; E691-K752 WeakPolarHBondContact OE1-CE 3.44Å; E691-K752 IonicContact OE1-NZ 3.98Å; E691-K752 PolarHBondContact OE1-NZ 2.57Å; E691-K752 IonicContact OE2-NZ 3.18Å; E691-K752 PolarHBondContact OE2-NZ 3.28Å
692	F	94.9	Very high	92	Very high	39 Å²	39	40.7 Å²	40.7	17%	0.171	24%	0.243	C	C	.	.			trans	-78	136.4	176.2	-176.8	-111.5	0	0	0	111.1	I618 R628 F640 A642 E694	I618-F692 HydrophobicContact CD1-CD2 4.26Å; I618-F692 HydrophobicContact CD1-CE2 3.78Å; R628-F692 HydrophobicContact CB-CD2 4.47Å; R628-F692 HydrophobicContact CB-CE2 4.18Å; R628-F692 HydrophobicContact CG-CD2 4.2Å; R628-F692 HydrophobicContact CG-CE2 4.06Å; R628-F692 HydrophobicContact CG-CZ 4.32Å; F640-F692 HydrophobicContact CB-CB 3.86Å; F640-F692 HydrophobicContact CB-CD1 4.2Å; F640-F692 HydrophobicContact CB-CG 4.28Å; F640-F692 PolarHBondContact O-N 3.38Å; A642-F692 HydrophobicContact CB-CD2 4.47Å; F692-E694 HydrophobicContact CD1-CG 3.97Å; F692-E694 HydrophobicContact CE1-CB 4.18Å; F692-E694 HydrophobicContact CE1-CG 3.84Å
693	M	95.2	Very high	92.4	Very high	10 Å²	10	42.8 Å²	42.8	5%	0.049	24%	0.238	C	C	.	.			trans	-117.8	99.7	-176.4	-63.1	-66.7	-72.4	0	0	108.8	I674 E691 N695 G696 L744 V745 N746 K752	I674-M693 HydrophobicContact CD1-CG 3.59Å; I674-M693 HydrophobicContact CD1-SD 4Å; E691-M693 HydrophobicContact CG-SD 4.13Å; M693-N695 PolarHBondContact O-N 3.36Å; M693-N695 VanDerWaalsContact O-N 3.14Å; M693-G696 PolarHBondContact O-N 2.97Å; M693-G696 VanDerWaalsContact O-N 3.11Å; M693-L744 HydrophobicContact CB-CB 3.84Å; M693-L744 HydrophobicContact CB-CD1 4.39Å; M693-L744 VanDerWaalsContact CE-C 3.44Å; M693-L744 HydrophobicContact CE-CB 3.82Å; M693-L744 VanDerWaalsContact CE-O 3.27Å; M693-L744 WeakPolarHBondContact CE-O 3.41Å; M693-L744 HydrophobicContact CG-CB 3.73Å; M693-L744 HydrophobicContact CG-CD1 4.04Å; M693-L744 HydrophobicContact CG-CG 4.49Å; M693-V745 CarbonylContact C-O 3.5Å; M693-N746 HydrophobicContact CE-CB 3.91Å; M693-N746 HydrophobicContact SD-CB 3.95Å; M693-K752 HydrophobicContact CE-CB 3.92Å; M693-K752 HydrophobicContact CE-CD 3.8Å; M693-K752 HydrophobicContact CE-CG 3.65Å; M693-K752 HydrophobicContact SD-CD 3.95Å; M693-K752 HydrophobicContact SD-CG 4.47Å
694	E	93.8	Very high	92.9	Very high	101 Å²	101	46.4 Å²	46.4	47%	0.472	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-25.9	-161.8	-58.7	88.7	161.1	0	0	114.7	F692 N746 A747	F692-E694 HydrophobicContact CD1-CG 3.97Å; F692-E694 HydrophobicContact CE1-CB 4.18Å; F692-E694 HydrophobicContact CE1-CG 3.84Å; E694-N746 VanDerWaalsContact OE2-CA 3.25Å; E694-N746 WeakPolarHBondContact OE2-CA 3.45Å; E694-N746 VanDerWaalsContact OE2-CB 3.31Å; E694-N746 WeakPolarHBondContact OE2-CB 3.47Å; E694-A747 HydrophobicContact CB-CB 4.23Å; E694-A747 HydrophobicContact CG-CB 4.12Å; E694-A747 PolarHBondContact OE2-N 2.6Å
695	N	94.3	Very high	93.4	Very high	56 Å²	56	42.5 Å²	42.5	30%	0.299	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	3	-177.4	-74.2	-43.8	0	0	0	113.1	M693 F701 V745 N746	M693-N695 PolarHBondContact O-N 3.36Å; M693-N695 VanDerWaalsContact O-N 3.14Å; N695-F701 HydrophobicContact CB-CD2 3.57Å; N695-F701 HydrophobicContact CB-CE2 3.61Å; N695-F701 HydrophobicContact CB-CG 4.13Å; N695-F701 HydrophobicContact CB-CZ 4.2Å; N695-F701 WeakPolarHBondContact OD1-CE2 3.15Å; N695-V745 WeakPolarHBondContact CA-O 3.47Å; N695-V745 HydrophobicContact CB-CB 3.85Å; N695-V745 HydrophobicContact CB-CG1 4Å; N695-V745 WeakPolarHBondContact CB-O 3.32Å; N695-V745 PolarHBondContact N-O 2.81Å; N695-N746 PolarHBondContact ND2-O 2.94Å
696	G	92.3	Very high	93.6	Very high	28 Å²	28	46.6 Å²	46.6	29%	0.289	25%	0.249	S	C	.	.			trans	64.9	-149.1	176.6	0	0	0	0	0	114	M693 L744 V745	M693-G696 PolarHBondContact O-N 2.97Å; M693-G696 VanDerWaalsContact O-N 3.11Å; G696-L744 CarbonylContact O-C 3.44Å; G696-L744 WeakPolarHBondContact O-CA 3.17Å; G696-V745 PolarHBondContact O-N 2.98Å
697	A	93.3	Very high	93.5	Very high	26 Å²	26	49.8 Å²	49.8	22%	0.215	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-73.4	136.6	-179.4	0	0	0	0	0	112.4	D699 S700 F701 R741 I743	A697-D699 VanDerWaalsContact C-N 3.3Å; A697-D699 PolarHBondContact O-N 2.79Å; A697-S700 PolarHBondContact O-N 2.64Å; A697-F701 WeakPolarHBondContact O-CB 3.37Å; A697-F701 PolarHBondContact O-N 2.88Å; A697-R741 WeakPolarHBondContact CB-O 3.41Å; A697-I743 CarbonylContact C-O 3.49Å; A697-I743 WeakPolarHBondContact CA-O 3.34Å
698	L	95.9	Very high	93.4	Very high	12 Å²	12	55.4 Å²	55.4	6%	0.063	31%	0.31	C	S	.	.	H	α-helix	trans	-59.8	-37.8	-174.4	177.6	66.8	0	0	0	112.5	S700 F701 L702 M717 I721 A740 I743 V745	L698-S700 VanDerWaalsContact C-N 3.32Å; L698-S700 PolarHBondContact O-N 2.79Å; L698-F701 PolarHBondContact O-N 3.08Å; L698-L702 HydrophobicContact CD1-CD1 3.8Å; L698-L702 HydrophobicContact CD1-CD2 4.22Å; L698-L702 HydrophobicContact CD1-CG 3.73Å; L698-L702 HydrophobicContact CD2-CD1 4.42Å; L698-L702 HydrophobicContact CG-CD1 3.79Å; L698-L702 HydrophobicContact CG-CG 4.13Å; L698-L702 WeakPolarHBondContact O-CB 3.48Å; L698-L702 VanDerWaalsContact O-CG 3.24Å; L698-L702 WeakPolarHBondContact O-CG 3.44Å; L698-L702 PolarHBondContact O-N 3.15Å; L698-M717 HydrophobicContact CD1-SD 4.16Å; L698-I721 HydrophobicContact CD2-CD1 3.81Å; L698-A740 WeakPolarHBondContact CB-O 3.48Å; L698-A740 PolarHBondContact N-O 3.03Å; L698-I743 HydrophobicContact CB-CB 3.91Å; L698-I743 HydrophobicContact CB-CG2 4Å; L698-I743 WeakPolarHBondContact CB-O 3.44Å; L698-I743 HydrophobicContact CD2-CB 4.05Å; L698-I743 HydrophobicContact CD2-CG2 3.84Å; L698-I743 PolarHBondContact N-O 3.38Å; L698-V745 HydrophobicContact CB-CG2 3.78Å; L698-V745 HydrophobicContact CD1-CG2 3.61Å; L698-V745 HydrophobicContact CG-CG2 4.3Å
699	D	94.4	Very high	93.4	Very high	38 Å²	38	57.1 Å²	57.1	20%	0.203	32%	0.317	C	S	.	.	H	α-helix	trans	-62	-40.7	-178.9	81.9	-40.9	0	0	0	112.4	A697 R703 A740	A697-D699 VanDerWaalsContact C-N 3.3Å; A697-D699 PolarHBondContact O-N 2.79Å; D699-R703 WeakPolarHBondContact O-CG 3.45Å; D699-R703 VanDerWaalsContact O-CZ 3.31Å; D699-R703 PolarHBondContact O-N 3.06Å; D699-R703 PolarHBondContact O-NE 3.36Å; D699-R703 IonicContact OD1-NH2 2.8Å; D699-R703 IonicContact OD2-CZ 3.64Å; D699-R703 VanDerWaalsContact OD2-CZ 3.3Å; D699-R703 IonicContact OD2-NH1 2.65Å; D699-R703 PolarHBondContact OD2-NH1 2.98Å; D699-R703 IonicContact OD2-NH2 2.7Å; D699-R703 PolarHBondContact OD2-NH2 3.09Å; D699-A740 HydrophobicContact CB-CB 3.74Å; D699-A740 PolarHBondContact N-O 3.5Å
700	S	92.6	Very high	93.4	Very high	56 Å²	56	60.3 Å²	60.3	39%	0.392	34%	0.337	S	S	.	.	H	α-helix	trans	-80.6	-38.9	-179.7	-59.5	0	0	0	0	110.8	A697 L698 R703 V704	A697-S700 PolarHBondContact O-N 2.64Å; L698-S700 VanDerWaalsContact C-N 3.32Å; L698-S700 PolarHBondContact O-N 2.79Å; S700-R703 PolarHBondContact O-N 3.1Å; S700-R703 PolarHBondContact OG-NH2 2.97Å; S700-V704 WeakPolarHBondContact O-CG2 3.34Å; S700-V704 PolarHBondContact O-N 3.04Å; S700-V704 VanDerWaalsContact O-N 3.11Å
701	F	95.2	Very high	93.3	Very high	19 Å²	19	64.2 Å²	64.2	8%	0.083	36%	0.362	C	S	.	.	H	α-helix	trans	-59.3	-45.5	172.9	-179	-112.5	0	0	0	112.5	N695 A697 L698 V704 N705 F709 M717 V745 L749	N695-F701 HydrophobicContact CB-CD2 3.57Å; N695-F701 HydrophobicContact CB-CE2 3.61Å; N695-F701 HydrophobicContact CB-CG 4.13Å; N695-F701 HydrophobicContact CB-CZ 4.2Å; N695-F701 WeakPolarHBondContact OD1-CE2 3.15Å; A697-F701 WeakPolarHBondContact O-CB 3.37Å; A697-F701 PolarHBondContact O-N 2.88Å; L698-F701 PolarHBondContact O-N 3.08Å; F701-V704 PolarHBondContact O-N 3.49Å; F701-N705 WeakPolarHBondContact CE2-ND2 3.27Å; F701-N705 WeakPolarHBondContact O-CB 3.29Å; F701-N705 PolarHBondContact O-N 3.28Å; F701-N705 PolarHBondContact O-ND2 2.81Å; F701-F709 HydrophobicContact CD1-CE2 4.45Å; F701-F709 HydrophobicContact CD1-CZ 4.18Å; F701-F709 HydrophobicContact CE1-CE1 4.08Å; F701-F709 AromaticContact CE1-CE2 3.96Å; F701-F709 HydrophobicContact CE1-CE2 3.96Å; F701-F709 AromaticContact CE1-CZ 3.32Å; F701-F709 HydrophobicContact CE1-CZ 3.32Å; F701-F709 HydrophobicContact CE2-CZ 4.44Å; F701-F709 HydrophobicContact CZ-CE1 4.1Å; F701-F709 HydrophobicContact CZ-CE2 4.47Å; F701-F709 AromaticContact CZ-CZ 3.49Å; F701-F709 HydrophobicContact CZ-CZ 3.49Å; F701-F709 VanDerWaalsContact CZ-CZ 3.49Å; F701-M717 HydrophobicContact CE1-CE 3.97Å; F701-V745 HydrophobicContact CD1-CB 4.37Å; F701-V745 HydrophobicContact CD1-CG1 4.1Å; F701-V745 HydrophobicContact CD1-CG2 4.18Å; F701-V745 HydrophobicContact CE1-CG1 3.98Å; F701-L749 HydrophobicContact CE1-CD2 3.79Å; F701-L749 HydrophobicContact CZ-CD2 3.56Å
702	L	94.9	Very high	93.2	Very high	60 Å²	60	68.5 Å²	68.5	31%	0.314	39%	0.385	S	S	.	.	H	α-helix	trans	-66	-40.9	177.4	-72	175	0	0	0	112	L698 V704 N705 D706 F709 L714 M717	L698-L702 HydrophobicContact CD1-CD1 3.8Å; L698-L702 HydrophobicContact CD1-CD2 4.22Å; L698-L702 HydrophobicContact CD1-CG 3.73Å; L698-L702 HydrophobicContact CD2-CD1 4.42Å; L698-L702 HydrophobicContact CG-CD1 3.79Å; L698-L702 HydrophobicContact CG-CG 4.13Å; L698-L702 WeakPolarHBondContact O-CB 3.48Å; L698-L702 VanDerWaalsContact O-CG 3.24Å; L698-L702 WeakPolarHBondContact O-CG 3.44Å; L698-L702 PolarHBondContact O-N 3.15Å; L702-V704 VanDerWaalsContact C-N 3.33Å; L702-V704 PolarHBondContact O-N 3.33Å; L702-N705 CarbonylContact O-C 3.51Å; L702-N705 PolarHBondContact O-N 2.76Å; L702-D706 PolarHBondContact O-N 2.8Å; L702-D706 VanDerWaalsContact O-N 3.09Å; L702-F709 HydrophobicContact CD2-CD2 3.98Å; L702-F709 HydrophobicContact CD2-CE2 3.89Å; L702-L714 HydrophobicContact CD2-CD2 4.11Å; L702-M717 HydrophobicContact CD2-SD 4.38Å
703	R	93.2	Very high	93.1	Very high	159 Å²	159	70.2 Å²	70.2	60%	0.6	39%	0.394	S	S	*	.	H	α-helix	trans	-62.6	-36.2	177	-76.2	-175.7	-63.1	-103	2.7	113.3	D699 S700	D699-R703 WeakPolarHBondContact O-CG 3.45Å; D699-R703 VanDerWaalsContact O-CZ 3.31Å; D699-R703 PolarHBondContact O-N 3.06Å; D699-R703 PolarHBondContact O-NE 3.36Å; D699-R703 IonicContact OD1-NH2 2.8Å; D699-R703 IonicContact OD2-CZ 3.64Å; D699-R703 VanDerWaalsContact OD2-CZ 3.3Å; D699-R703 IonicContact OD2-NH1 2.65Å; D699-R703 PolarHBondContact OD2-NH1 2.98Å; D699-R703 IonicContact OD2-NH2 2.7Å; D699-R703 PolarHBondContact OD2-NH2 3.09Å; S700-R703 PolarHBondContact O-N 3.1Å; S700-R703 PolarHBondContact OG-NH2 2.97Å
704	V	94.1	Very high	93.1	Very high	112 Å²	112	72.9 Å²	72.9	68%	0.679	41%	0.408	S	S	*	.	H	α-helix	trans	-74.5	-26.9	177.5	172.3	0	0	0	0	112.3	S700 F701 L702	S700-V704 WeakPolarHBondContact O-CG2 3.34Å; S700-V704 PolarHBondContact O-N 3.04Å; S700-V704 VanDerWaalsContact O-N 3.11Å; F701-V704 PolarHBondContact O-N 3.49Å; L702-V704 VanDerWaalsContact C-N 3.33Å; L702-V704 PolarHBondContact O-N 3.33Å
705	N	91.4	Very high	93.1	Very high	35 Å²	35	72.1 Å²	72.1	19%	0.187	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	30.1	-174.5	-63.8	-86.4	0	0	0	112.4	F701 L702 G707 Q708 F709	F701-N705 WeakPolarHBondContact CE2-ND2 3.27Å; F701-N705 WeakPolarHBondContact O-CB 3.29Å; F701-N705 PolarHBondContact O-N 3.28Å; F701-N705 PolarHBondContact O-ND2 2.81Å; L702-N705 CarbonylContact O-C 3.51Å; L702-N705 PolarHBondContact O-N 2.76Å; N705-G707 PolarHBondContact O-N 3.26Å; N705-Q708 HydrophobicContact CB-CB 4.4Å; N705-Q708 WeakPolarHBondContact O-CB 3.36Å; N705-Q708 PolarHBondContact O-N 2.9Å; N705-F709 HydrophobicContact CB-CD2 4.39Å; N705-F709 HydrophobicContact CB-CE2 3.4Å; N705-F709 VanDerWaalsContact CB-CE2 3.4Å; N705-F709 HydrophobicContact CB-CZ 3.48Å; N705-F709 VanDerWaalsContact CB-CZ 3.48Å
706	D	89.6	Confident	93	Very high	141 Å²	141	70.9 Å²	70.9	75%	0.754	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	138.3	-178.2	-170.6	25	0	0	0	111.4	L702 Q708	L702-D706 PolarHBondContact O-N 2.8Å; L702-D706 VanDerWaalsContact O-N 3.09Å; D706-Q708 PolarHBondContact O-N 2.74Å; D706-Q708 VanDerWaalsContact O-N 3.1Å
707	G	88.3	Confident	93.2	Very high	77 Å²	77	69.9 Å²	69.9	79%	0.794	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	-3.8	-172.8	0	0	0	0	0	116.8	N705	N705-G707 PolarHBondContact O-N 3.26Å
708	Q	91.4	Very high	93.4	Very high	134 Å²	134	74.2 Å²	74.2	63%	0.626	42%	0.418	S	S	*	.			trans	-88.6	-13.4	-174.2	-57.2	-166.8	37.5	0	0	114.8	N705 D706	N705-Q708 HydrophobicContact CB-CB 4.4Å; N705-Q708 WeakPolarHBondContact O-CB 3.36Å; N705-Q708 PolarHBondContact O-N 2.9Å; D706-Q708 PolarHBondContact O-N 2.74Å; D706-Q708 VanDerWaalsContact O-N 3.1Å
709	F	93.2	Very high	93.4	Very high	37 Å²	37	82.6 Å²	82.6	16%	0.162	45%	0.448	C	S	.	.	S	Bend	trans	-97.7	136.6	-179.2	-58.8	-62.4	0	0	0	112.9	F701 L702 N705 Q713 L714 M717 L749	F701-F709 HydrophobicContact CD1-CE2 4.45Å; F701-F709 HydrophobicContact CD1-CZ 4.18Å; F701-F709 HydrophobicContact CE1-CE1 4.08Å; F701-F709 AromaticContact CE1-CE2 3.96Å; F701-F709 HydrophobicContact CE1-CE2 3.96Å; F701-F709 AromaticContact CE1-CZ 3.32Å; F701-F709 HydrophobicContact CE1-CZ 3.32Å; F701-F709 HydrophobicContact CE2-CZ 4.44Å; F701-F709 HydrophobicContact CZ-CE1 4.1Å; F701-F709 HydrophobicContact CZ-CE2 4.47Å; F701-F709 AromaticContact CZ-CZ 3.49Å; F701-F709 HydrophobicContact CZ-CZ 3.49Å; F701-F709 VanDerWaalsContact CZ-CZ 3.49Å; L702-F709 HydrophobicContact CD2-CD2 3.98Å; L702-F709 HydrophobicContact CD2-CE2 3.89Å; N705-F709 HydrophobicContact CB-CD2 4.39Å; N705-F709 HydrophobicContact CB-CE2 3.4Å; N705-F709 VanDerWaalsContact CB-CE2 3.4Å; N705-F709 HydrophobicContact CB-CZ 3.48Å; N705-F709 VanDerWaalsContact CB-CZ 3.48Å; F709-Q713 HydrophobicContact CB-CB 4.41Å; F709-L714 HydrophobicContact CB-CD2 3.84Å; F709-L714 HydrophobicContact CB-CG 3.95Å; F709-L714 HydrophobicContact CD2-CD2 4.14Å; F709-L714 HydrophobicContact CG-CD2 4.27Å; F709-M717 HydrophobicContact CD1-CE 4.28Å; F709-M717 HydrophobicContact CE1-CE 4.2Å; F709-M717 HydrophobicContact CE2-CE 4.49Å; F709-M717 HydrophobicContact CG-CE 4.5Å; F709-M717 HydrophobicContact CZ-CE 4.33Å; F709-L749 HydrophobicContact CD1-CD1 4.37Å; F709-L749 HydrophobicContact CE1-CD1 4.22Å; F709-L749 HydrophobicContact CE1-CD2 4.11Å
710	T	93.8	Very high	93.4	Very high	67 Å²	67	81 Å²	81	41%	0.411	44%	0.441	S	S	.	.			trans	-68.5	151.8	168.3	62.3	0	0	0	0	111	I712 Q713 L714	T710-I712 PolarHBondContact O-N 3.13Å; T710-I712 VanDerWaalsContact O-N 3.1Å; T710-I712 VanDerWaalsContact OG1-CG2 3.25Å; T710-I712 WeakPolarHBondContact OG1-CG2 3.33Å; T710-Q713 WeakPolarHBondContact O-CB 3.18Å; T710-Q713 PolarHBondContact O-N 2.78Å; T710-Q713 WeakPolarHBondContact OG1-CG 3.37Å; T710-Q713 PolarHBondContact OG1-N 2.97Å; T710-Q713 PolarHBondContact OG1-OE1 2.89Å; T710-L714 PolarHBondContact O-N 2.99Å
711	P	93.8	Very high	93.6	Very high	104 Å²	104	79.5 Å²	79.5	68%	0.675	43%	0.428	S	S	*	.	H	α-helix	trans	-54	-32.8	176.1	-28.9	35.9	0	0	0	114	L714 V715	P711-L714 PolarHBondContact O-N 2.81Å; P711-V715 WeakPolarHBondContact O-CB 3.35Å; P711-V715 VanDerWaalsContact O-CG2 3.31Å; P711-V715 WeakPolarHBondContact O-CG2 3.2Å; P711-V715 PolarHBondContact O-N 3.26Å
712	I	91.6	Very high	93.7	Very high	128 Å²	128	81.5 Å²	81.5	66%	0.656	45%	0.448	S	S	*	.	H	α-helix	trans	-69.6	-33.2	178.1	-172.3	61.5	0	0	0	112.8	T710 G716	T710-I712 PolarHBondContact O-N 3.13Å; T710-I712 VanDerWaalsContact O-N 3.1Å; T710-I712 VanDerWaalsContact OG1-CG2 3.25Å; T710-I712 WeakPolarHBondContact OG1-CG2 3.33Å; I712-G716 PolarHBondContact O-N 3.01Å
713	Q	93	Very high	93.8	Very high	74 Å²	74	80.2 Å²	80.2	35%	0.346	45%	0.446	S	S	.	.	H	α-helix	trans	-68.1	-44	173.1	-72.8	162.5	-61.4	0	0	110.9	F709 T710 V715 G716 M717 L749	F709-Q713 HydrophobicContact CB-CB 4.41Å; T710-Q713 WeakPolarHBondContact O-CB 3.18Å; T710-Q713 PolarHBondContact O-N 2.78Å; T710-Q713 WeakPolarHBondContact OG1-CG 3.37Å; T710-Q713 PolarHBondContact OG1-N 2.97Å; T710-Q713 PolarHBondContact OG1-OE1 2.89Å; Q713-V715 PolarHBondContact O-N 3.11Å; Q713-G716 WeakPolarHBondContact O-CA 3.48Å; Q713-G716 PolarHBondContact O-N 3.19Å; Q713-G716 VanDerWaalsContact O-N 3.07Å; Q713-M717 WeakPolarHBondContact O-CG 3.38Å; Q713-M717 PolarHBondContact O-N 2.79Å; Q713-L749 HydrophobicContact CG-CD1 4.26Å
714	L	94.9	Very high	94	Very high	67 Å²	67	72.7 Å²	72.7	35%	0.351	42%	0.418	S	S	.	.	H	α-helix	trans	-62.4	-42.1	176.5	-62.6	175	0	0	0	112	L702 F709 T710 P711 G716 M717 L718	L702-L714 HydrophobicContact CD2-CD2 4.11Å; F709-L714 HydrophobicContact CB-CD2 3.84Å; F709-L714 HydrophobicContact CB-CG 3.95Å; F709-L714 HydrophobicContact CD2-CD2 4.14Å; F709-L714 HydrophobicContact CG-CD2 4.27Å; T710-L714 PolarHBondContact O-N 2.99Å; P711-L714 PolarHBondContact O-N 2.81Å; L714-G716 VanDerWaalsContact C-N 3.3Å; L714-G716 PolarHBondContact O-N 2.91Å; L714-M717 HydrophobicContact CD2-SD 4.23Å; L714-M717 WeakPolarHBondContact O-CB 3.48Å; L714-M717 PolarHBondContact O-N 3.03Å; L714-L718 WeakPolarHBondContact O-CG 3.39Å; L714-L718 PolarHBondContact O-N 2.79Å
715	V	95.1	Very high	94	Very high	85 Å²	85	69.7 Å²	69.7	52%	0.515	40%	0.397	S	S	.	.	H	α-helix	trans	-62.9	-37.3	171.7	169.5	0	0	0	0	111.4	P711 Q713 L718 R719	P711-V715 WeakPolarHBondContact O-CB 3.35Å; P711-V715 VanDerWaalsContact O-CG2 3.31Å; P711-V715 WeakPolarHBondContact O-CG2 3.2Å; P711-V715 PolarHBondContact O-N 3.26Å; Q713-V715 PolarHBondContact O-N 3.11Å; V715-L718 PolarHBondContact O-N 2.87Å; V715-R719 VanDerWaalsContact O-CB 3.23Å; V715-R719 WeakPolarHBondContact O-CB 3.5Å; V715-R719 PolarHBondContact O-N 2.88Å
716	G	91.6	Very high	94.2	Very high	30 Å²	30	74.3 Å²	74.3	31%	0.309	42%	0.415	S	S	.	.	H	α-helix	trans	-59.4	-45.8	173.5	0	0	0	0	0	113.1	I712 Q713 L714 G720	I712-G716 PolarHBondContact O-N 3.01Å; Q713-G716 WeakPolarHBondContact O-CA 3.48Å; Q713-G716 PolarHBondContact O-N 3.19Å; Q713-G716 VanDerWaalsContact O-N 3.07Å; L714-G716 VanDerWaalsContact C-N 3.3Å; L714-G716 PolarHBondContact O-N 2.91Å; G716-G720 PolarHBondContact O-N 2.69Å; G716-G720 VanDerWaalsContact O-N 3.1Å
717	M	96.8	Very high	94.4	Very high	7 Å²	7	69.5 Å²	69.5	3%	0.034	39%	0.388	C	S	.	.	H	α-helix	trans	-61	-53.1	175.1	-68.5	174.3	-177.5	0	0	111.5	L698 F701 L702 F709 Q713 L714 R719 G720 I721 L749 C751	L698-M717 HydrophobicContact CD1-SD 4.16Å; F701-M717 HydrophobicContact CE1-CE 3.97Å; L702-M717 HydrophobicContact CD2-SD 4.38Å; F709-M717 HydrophobicContact CD1-CE 4.28Å; F709-M717 HydrophobicContact CE1-CE 4.2Å; F709-M717 HydrophobicContact CE2-CE 4.49Å; F709-M717 HydrophobicContact CG-CE 4.5Å; F709-M717 HydrophobicContact CZ-CE 4.33Å; Q713-M717 WeakPolarHBondContact O-CG 3.38Å; Q713-M717 PolarHBondContact O-N 2.79Å; L714-M717 HydrophobicContact CD2-SD 4.23Å; L714-M717 WeakPolarHBondContact O-CB 3.48Å; L714-M717 PolarHBondContact O-N 3.03Å; M717-R719 PolarHBondContact O-N 2.92Å; M717-G720 WeakPolarHBondContact O-CA 3.19Å; M717-G720 PolarHBondContact O-N 2.89Å; M717-I721 WeakPolarHBondContact O-CG1 3.48Å; M717-I721 PolarHBondContact O-N 3.01Å; M717-I721 VanDerWaalsContact O-N 3.07Å; M717-L749 HydrophobicContact CE-CB 3.92Å; M717-L749 HydrophobicContact CE-CD1 4.21Å; M717-L749 HydrophobicContact CE-CD2 3.98Å; M717-L749 HydrophobicContact CE-CG 4.26Å; M717-C751 VanDerWaalsContact CB-SG 3.52Å
718	L	96.6	Very high	94.6	Very high	117 Å²	117	65.8 Å²	65.8	61%	0.613	35%	0.351	S	S	*	.	H	α-helix	trans	-58.2	-44.4	178.9	-72.9	171.4	0	0	0	112.4	L714 V715 G720 I721 A722	L714-L718 WeakPolarHBondContact O-CG 3.39Å; L714-L718 PolarHBondContact O-N 2.79Å; V715-L718 PolarHBondContact O-N 2.87Å; L718-G720 VanDerWaalsContact C-N 3.27Å; L718-G720 PolarHBondContact O-N 2.9Å; L718-I721 PolarHBondContact O-N 3.29Å; L718-A722 WeakPolarHBondContact O-CB 3.43Å; L718-A722 PolarHBondContact O-N 2.79Å
719	R	96.6	Very high	94.5	Very high	188 Å²	188	62.5 Å²	62.5	71%	0.709	35%	0.346	S	S	*	.	H	α-helix	trans	-60.3	-38.3	175.9	-175.6	-170.6	66.5	156.4	0.8	111.7	V715 M717 A723	V715-R719 VanDerWaalsContact O-CB 3.23Å; V715-R719 WeakPolarHBondContact O-CB 3.5Å; V715-R719 PolarHBondContact O-N 2.88Å; M717-R719 PolarHBondContact O-N 2.92Å; R719-A723 WeakPolarHBondContact O-CB 3.47Å; R719-A723 PolarHBondContact O-N 2.87Å
720	G	93.9	Very high	94.2	Very high	5 Å²	5	65.8 Å²	65.8	5%	0.052	37%	0.365	C	S	.	.	H	α-helix	trans	-61.1	-52.9	174.8	0	0	0	0	0	112	N672 G716 M717 L718 A722 A723 G724	N672-G720 WeakPolarHBondContact CB-O 3.33Å; N672-G720 VanDerWaalsContact ND2-CA 3.25Å; N672-G720 WeakPolarHBondContact ND2-CA 3.05Å; G716-G720 PolarHBondContact O-N 2.69Å; G716-G720 VanDerWaalsContact O-N 3.1Å; M717-G720 WeakPolarHBondContact O-CA 3.19Å; M717-G720 PolarHBondContact O-N 2.89Å; L718-G720 VanDerWaalsContact C-N 3.27Å; L718-G720 PolarHBondContact O-N 2.9Å; G720-A722 VanDerWaalsContact C-N 3.33Å; G720-A722 PolarHBondContact O-N 3.01Å; G720-A723 PolarHBondContact O-N 2.93Å; G720-A723 VanDerWaalsContact O-N 3.13Å; G720-G724 PolarHBondContact O-N 3.04Å
721	I	97.6	Very high	93.8	Very high	24 Å²	24	63.5 Å²	63.5	12%	0.123	35%	0.35	C	S	.	.	H	α-helix	trans	-57.2	-46.9	178.3	-59.4	163	0	0	0	110.6	L698 M717 L718 A723 G724 M725 L738 I743 C751 V753	L698-I721 HydrophobicContact CD2-CD1 3.81Å; M717-I721 WeakPolarHBondContact O-CG1 3.48Å; M717-I721 PolarHBondContact O-N 3.01Å; M717-I721 VanDerWaalsContact O-N 3.07Å; L718-I721 PolarHBondContact O-N 3.29Å; I721-A723 VanDerWaalsContact C-N 3.33Å; I721-A723 PolarHBondContact O-N 3.1Å; I721-G724 PolarHBondContact O-N 3Å; I721-M725 PolarHBondContact O-N 2.76Å; I721-L738 HydrophobicContact CG2-CD1 4.43Å; I721-I743 HydrophobicContact CD1-CG1 4.22Å; I721-I743 HydrophobicContact CD1-CG2 4.04Å; I721-I743 HydrophobicContact CG1-CD1 4.25Å; I721-I743 HydrophobicContact CG1-CG1 4.32Å; I721-I743 HydrophobicContact CG1-CG2 3.94Å; I721-I743 HydrophobicContact CG2-CD1 3.98Å; I721-C751 HydrophobicContact CD1-CB 4.23Å; I721-C751 HydrophobicContact CG1-CB 3.68Å; I721-V753 HydrophobicContact CG2-CG2 4.49Å
722	A	97.5	Very high	93.2	Very high	60 Å²	60	62.6 Å²	62.6	50%	0.496	35%	0.346	S	S	.	.	H	α-helix	trans	-61.3	-38.3	177.9	0	0	0	0	0	112.8	L718 G720 K726	L718-A722 WeakPolarHBondContact O-CB 3.43Å; L718-A722 PolarHBondContact O-N 2.79Å; G720-A722 VanDerWaalsContact C-N 3.33Å; G720-A722 PolarHBondContact O-N 3.01Å; A722-K726 WeakPolarHBondContact O-CB 3.4Å; A722-K726 PolarHBondContact O-N 3.43Å
723	A	96.8	Very high	92.9	Very high	34 Å²	34	56.7 Å²	56.7	28%	0.281	32%	0.316	S	S	.	.	H	α-helix	trans	-67.5	-38.9	175.4	0	0	0	0	0	112.3	H670 R719 G720 I721 K726 H727	H670-A723 VanDerWaalsContact CE1-C 3.42Å; H670-A723 PolarHBondContact CE1-O 2.82Å; R719-A723 WeakPolarHBondContact O-CB 3.47Å; R719-A723 PolarHBondContact O-N 2.87Å; G720-A723 PolarHBondContact O-N 2.93Å; G720-A723 VanDerWaalsContact O-N 3.13Å; I721-A723 VanDerWaalsContact C-N 3.33Å; I721-A723 PolarHBondContact O-N 3.1Å; A723-K726 PolarHBondContact O-N 2.77Å; A723-H727 PolarHBondContact O-N 2.83Å
724	G	95.8	Very high	92.5	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.6	-49.7	172.6	0	0	0	0	0	112.3	G720 I721 K726 H727 L728	G720-G724 PolarHBondContact O-N 3.04Å; I721-G724 PolarHBondContact O-N 3Å; G724-K726 VanDerWaalsContact C-N 3.33Å; G724-K726 PolarHBondContact O-N 3.38Å; G724-H727 WeakPolarHBondContact O-CB 3.34Å; G724-H727 PolarHBondContact O-N 2.82Å; G724-H727 VanDerWaalsContact O-N 3.14Å; G724-L728 PolarHBondContact O-N 2.87Å; G724-L728 VanDerWaalsContact O-N 3.12Å
725	M	95.9	Very high	92.1	Very high	49 Å²	49	53.2 Å²	53.2	24%	0.241	30%	0.302	C	S	.	.	H	α-helix	trans	-64.6	-35.4	177.7	-70.8	-55.5	-56.9	0	0	113.2	I721 L728 A729 H735 L738 V753	I721-M725 PolarHBondContact O-N 2.76Å; M725-L728 HydrophobicContact CE-CD1 4.47Å; M725-L728 PolarHBondContact O-N 2.83Å; M725-L728 HydrophobicContact SD-CD1 3.97Å; M725-A729 PolarHBondContact O-N 2.93Å; M725-H735 HydrophobicContact CE-CB 4.07Å; M725-H735 HydrophobicContact SD-CB 4.36Å; M725-L738 HydrophobicContact CE-CD2 4.1Å; M725-L738 HydrophobicContact CG-CD1 4.08Å; M725-L738 HydrophobicContact CG-CD2 3.68Å; M725-L738 HydrophobicContact SD-CD1 3.65Å; M725-L738 HydrophobicContact SD-CD2 3.83Å; M725-L738 HydrophobicContact SD-CG 4.23Å; M725-V753 HydrophobicContact CG-CG2 4.31Å; M725-V753 HydrophobicContact SD-CG1 4.18Å; M725-V753 HydrophobicContact SD-CG2 4.22Å
726	K	95.7	Very high	91.6	Very high	132 Å²	132	54.5 Å²	54.5	57%	0.574	30%	0.298	S	S	*	.	H	α-helix	trans	-60.7	-45.9	171.3	-172.6	-167.8	170.2	-166.6	0	111.1	A722 A723 G724 L728 A729 D730	A722-K726 WeakPolarHBondContact O-CB 3.4Å; A722-K726 PolarHBondContact O-N 3.43Å; A723-K726 PolarHBondContact O-N 2.77Å; G724-K726 VanDerWaalsContact C-N 3.33Å; G724-K726 PolarHBondContact O-N 3.38Å; K726-L728 VanDerWaalsContact C-N 3.3Å; K726-L728 PolarHBondContact O-N 2.95Å; K726-A729 PolarHBondContact O-N 2.84Å; K726-A729 VanDerWaalsContact O-N 3.14Å; K726-D730 VanDerWaalsContact CE-OD2 3.28Å; K726-D730 WeakPolarHBondContact CE-OD2 3.39Å; K726-D730 IonicContact NZ-OD2 3.02Å; K726-D730 WeakPolarHBondContact O-CB 3.42Å; K726-D730 VanDerWaalsContact O-CG 3.31Å; K726-D730 PolarHBondContact O-N 3.49Å
727	H	93.8	Very high	91.3	Very high	40 Å²	40	54.7 Å²	54.7	19%	0.185	29%	0.291	C	S	.	.	H	α-helix	trans	-60.8	-38.6	178.4	-178.7	82.4	0	0	0	112.5	H670 I673 A723 G724 M731	H670-H727 HydrophobicContact CB-CB 4.13Å; H670-H727 AromaticContact CD2-CG 3.92Å; H670-H727 AromaticContact CD2-ND1 3.96Å; H670-H727 AromaticContact CG-CG 3.87Å; I673-H727 HydrophobicContact CD1-CB 4.2Å; I673-H727 VanDerWaalsContact CD1-CD2 3.46Å; I673-H727 WeakPolarHBondContact CD1-CD2 3.24Å; A723-H727 PolarHBondContact O-N 2.83Å; G724-H727 WeakPolarHBondContact O-CB 3.34Å; G724-H727 PolarHBondContact O-N 2.82Å; G724-H727 VanDerWaalsContact O-N 3.14Å; H727-M731 WeakPolarHBondContact O-CB 3.05Å; H727-M731 VanDerWaalsContact O-CG 3.22Å; H727-M731 WeakPolarHBondContact O-CG 3.07Å; H727-M731 PolarHBondContact O-N 2.88Å; H727-M731 VanDerWaalsContact O-N 3.17Å
728	L	91.3	Very high	91.1	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.2	-44.3	173.3	-65.4	-179.6	0	0	0	111.6	F668 I673 G724 M725 K726 M731 S732 F733 H735 V753 F756	F668-L728 HydrophobicContact CD1-CD2 3.78Å; F668-L728 HydrophobicContact CD2-CD2 3.84Å; F668-L728 HydrophobicContact CE1-CD2 3.65Å; F668-L728 HydrophobicContact CE2-CD2 3.69Å; F668-L728 HydrophobicContact CG-CD2 3.9Å; F668-L728 HydrophobicContact CZ-CD2 3.62Å; I673-L728 HydrophobicContact CD1-CD2 3.64Å; I673-L728 HydrophobicContact CD1-CG 3.87Å; G724-L728 PolarHBondContact O-N 2.87Å; G724-L728 VanDerWaalsContact O-N 3.12Å; M725-L728 HydrophobicContact CE-CD1 4.47Å; M725-L728 PolarHBondContact O-N 2.83Å; M725-L728 HydrophobicContact SD-CD1 3.97Å; K726-L728 VanDerWaalsContact C-N 3.3Å; K726-L728 PolarHBondContact O-N 2.95Å; L728-M731 CarbonylContact O-C 3.47Å; L728-M731 WeakPolarHBondContact O-CA 3.43Å; L728-M731 WeakPolarHBondContact O-CB 3.28Å; L728-M731 PolarHBondContact O-N 3.01Å; L728-M731 VanDerWaalsContact O-N 3.15Å; L728-S732 PolarHBondContact O-N 3.36Å; L728-F733 CarbonylContact C-O 3.48Å; L728-F733 HydrophobicContact CB-CD1 4.22Å; L728-F733 HydrophobicContact CD1-CD1 4.22Å; L728-F733 HydrophobicContact CD1-CE1 4.48Å; L728-F733 HydrophobicContact CD2-CD1 3.8Å; L728-F733 HydrophobicContact CD2-CE1 4.31Å; L728-F733 HydrophobicContact CG-CD1 4.29Å; L728-F733 PolarHBondContact O-N 2.87Å; L728-H735 HydrophobicContact CD1-CB 4.27Å; L728-V753 HydrophobicContact CD1-CG1 4.26Å; L728-F756 HydrophobicContact CD1-CE1 4.13Å; L728-F756 HydrophobicContact CD2-CE1 4.27Å
729	A	89.1	Confident	90.9	Very high	64 Å²	64	53.9 Å²	53.9	53%	0.529	29%	0.291	S	S	.	.	H	α-helix	trans	-65.1	-40.7	176.7	0	0	0	0	0	113.1	M725 K726 M731 S732	M725-A729 PolarHBondContact O-N 2.93Å; K726-A729 PolarHBondContact O-N 2.84Å; K726-A729 VanDerWaalsContact O-N 3.14Å; A729-M731 PolarHBondContact O-N 2.8Å; A729-S732 PolarHBondContact O-N 2.88Å
730	D	87.8	Confident	90.7	Very high	107 Å²	107	47.1 Å²	47.1	57%	0.572	28%	0.275	S	S	*	.	H	α-helix	trans	-62.6	-21.6	174.1	-70.4	-18.2	0	0	0	111.9	K726	K726-D730 VanDerWaalsContact CE-OD2 3.28Å; K726-D730 WeakPolarHBondContact CE-OD2 3.39Å; K726-D730 IonicContact NZ-OD2 3.02Å; K726-D730 WeakPolarHBondContact O-CB 3.42Å; K726-D730 VanDerWaalsContact O-CG 3.31Å; K726-D730 PolarHBondContact O-N 3.49Å
731	M	84.8	Confident	90.5	Very high	19 Å²	19	53.2 Å²	53.2	9%	0.094	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	7.6	174.1	-69.4	-74	-55.6	0	0	113.4	K585 Y587 F668 H727 L728 A729 F733	K585-M731 HydrophobicContact CB-CE 3.98Å; K585-M731 HydrophobicContact CB-SD 3.99Å; K585-M731 VanDerWaalsContact O-CE 3.31Å; K585-M731 WeakPolarHBondContact O-CE 3.46Å; Y587-M731 WeakPolarHBondContact CB-O 3.41Å; F668-M731 HydrophobicContact CD1-CG 4.34Å; F668-M731 HydrophobicContact CE1-CB 4.05Å; F668-M731 HydrophobicContact CE1-CE 4.4Å; F668-M731 HydrophobicContact CE1-CG 4.24Å; H727-M731 WeakPolarHBondContact O-CB 3.05Å; H727-M731 VanDerWaalsContact O-CG 3.22Å; H727-M731 WeakPolarHBondContact O-CG 3.07Å; H727-M731 PolarHBondContact O-N 2.88Å; H727-M731 VanDerWaalsContact O-N 3.17Å; L728-M731 CarbonylContact O-C 3.47Å; L728-M731 WeakPolarHBondContact O-CA 3.43Å; L728-M731 WeakPolarHBondContact O-CB 3.28Å; L728-M731 PolarHBondContact O-N 3.01Å; L728-M731 VanDerWaalsContact O-N 3.15Å; A729-M731 PolarHBondContact O-N 2.8Å; M731-F733 VanDerWaalsContact C-N 3.26Å; M731-F733 PolarHBondContact O-N 2.94Å
732	S	82.1	Confident	90.3	Very high	84 Å²	84	52.5 Å²	52.5	59%	0.587	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	30	-174.2	-59.2	0	0	0	0	114.7	L728 A729	L728-S732 PolarHBondContact O-N 3.36Å; A729-S732 PolarHBondContact O-N 2.88Å
733	F	84.1	Confident	90.3	Very high	5 Å²	5	49.8 Å²	49.8	2%	0.022	27%	0.27	C	S	.	.			trans	-111.2	138	-177.2	-176.5	-90	0	0	0	112.6	Y587 I664 F668 L728 M731 F756 S759	Y587-F733 HydrophobicContact CD1-CD2 4.02Å; Y587-F733 AromaticContact CD2-CD2 3.61Å; Y587-F733 HydrophobicContact CD2-CD2 3.61Å; Y587-F733 HydrophobicContact CD2-CE2 4.11Å; Y587-F733 HydrophobicContact CD2-CG 4.45Å; Y587-F733 AromaticContact CE1-CD2 3.87Å; Y587-F733 HydrophobicContact CE1-CD2 3.87Å; Y587-F733 HydrophobicContact CE1-CE2 4.16Å; Y587-F733 AromaticContact CE2-CD2 3.44Å; Y587-F733 HydrophobicContact CE2-CD2 3.44Å; Y587-F733 VanDerWaalsContact CE2-CD2 3.44Å; Y587-F733 AromaticContact CE2-CE2 3.45Å; Y587-F733 HydrophobicContact CE2-CE2 3.45Å; Y587-F733 VanDerWaalsContact CE2-CE2 3.45Å; Y587-F733 AromaticContact CG-CD2 3.9Å; Y587-F733 HydrophobicContact CG-CD2 3.9Å; Y587-F733 AromaticContact CZ-CD2 3.58Å; Y587-F733 AromaticContact CZ-CE2 3.48Å; Y587-F733 VanDerWaalsContact CZ-CE2 3.48Å; I664-F733 HydrophobicContact CG2-CE2 3.9Å; I664-F733 HydrophobicContact CG2-CZ 3.61Å; F668-F733 HydrophobicContact CE1-CB 4.25Å; F668-F733 HydrophobicContact CE1-CG 4.35Å; F668-F733 HydrophobicContact CE2-CD1 4.18Å; F668-F733 HydrophobicContact CE2-CD2 4.41Å; F668-F733 HydrophobicContact CE2-CE1 4.09Å; F668-F733 HydrophobicContact CE2-CE2 4.32Å; F668-F733 HydrophobicContact CE2-CG 4.31Å; F668-F733 HydrophobicContact CE2-CZ 4.12Å; F668-F733 HydrophobicContact CZ-CB 3.9Å; F668-F733 AromaticContact CZ-CD1 3.78Å; F668-F733 HydrophobicContact CZ-CD1 3.78Å; F668-F733 AromaticContact CZ-CD2 3.74Å; F668-F733 HydrophobicContact CZ-CD2 3.74Å; F668-F733 HydrophobicContact CZ-CE1 4.13Å; F668-F733 HydrophobicContact CZ-CE2 4.09Å; F668-F733 AromaticContact CZ-CG 3.53Å; F668-F733 HydrophobicContact CZ-CG 3.53Å; F668-F733 HydrophobicContact CZ-CZ 4.23Å; L728-F733 CarbonylContact C-O 3.48Å; L728-F733 HydrophobicContact CB-CD1 4.22Å; L728-F733 HydrophobicContact CD1-CD1 4.22Å; L728-F733 HydrophobicContact CD1-CE1 4.48Å; L728-F733 HydrophobicContact CD2-CD1 3.8Å; L728-F733 HydrophobicContact CD2-CE1 4.31Å; L728-F733 HydrophobicContact CG-CD1 4.29Å; L728-F733 PolarHBondContact O-N 2.87Å; M731-F733 VanDerWaalsContact C-N 3.26Å; M731-F733 PolarHBondContact O-N 2.94Å; F733-F756 AromaticContact CE1-CD1 3.66Å; F733-F756 HydrophobicContact CE1-CD1 3.66Å; F733-F756 AromaticContact CE1-CE1 3.79Å; F733-F756 HydrophobicContact CE1-CE1 3.79Å; F733-F756 AromaticContact CZ-CD1 3.79Å; F733-F756 HydrophobicContact CZ-CD1 3.79Å; F733-F756 HydrophobicContact CZ-CE1 4.3Å; F733-S759 WeakPolarHBondContact CZ-OG 3.36Å
734	V	84.4	Confident	90.2	Very high	65 Å²	65	50.3 Å²	50.3	39%	0.394	27%	0.268	S	S	.	.			trans	-117.8	117.8	180	-176.2	0	0	0	0	110.1	R736 L762	V734-R736 VanDerWaalsContact C-N 3.32Å; V734-R736 HydrophobicContact CG1-CG 3.93Å; V734-R736 PolarHBondContact O-N 2.87Å; V734-L762 HydrophobicContact CG2-CD1 3.78Å
735	H	87.6	Confident	90.3	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.009	27%	0.268	C	S	.	.			trans	-64	-32	-177.6	-162.5	-76.6	0	0	0	114.3	M725 L728 D737 V753 S754 D755 F756 S759	M725-H735 HydrophobicContact CE-CB 4.07Å; M725-H735 HydrophobicContact SD-CB 4.36Å; L728-H735 HydrophobicContact CD1-CB 4.27Å; H735-D737 PolarHBondContact CE1-O 3.04Å; H735-D737 PolarHBondContact ND1-O 2.82Å; H735-D737 PolarHBondContact O-N 2.85Å; H735-V753 WeakPolarHBondContact CD2-CG1 3.11Å; H735-V753 WeakPolarHBondContact NE2-CG1 3.08Å; H735-S754 PolarHBondContact CE1-O 2.92Å; H735-S754 VanDerWaalsContact CE1-O 3.25Å; H735-S754 PolarHBondContact NE2-O 2.82Å; H735-S754 VanDerWaalsContact NE2-O 3.1Å; H735-D755 PolarHBondContact CE1-O 3.45Å; H735-D755 PolarHBondContact NE2-O 3.29Å; H735-F756 AromaticContact CD2-CD1 3.9Å; H735-F756 AromaticContact CD2-CE1 3.57Å; H735-F756 AromaticContact NE2-CE1 3.87Å; H735-S759 PolarHBondContact O-OG 3.23Å
736	R	83.9	Confident	90.2	Very high	112 Å²	112	49.1 Å²	49.1	42%	0.423	26%	0.263	S	S	.	.	S	Bend	trans	62.8	-33.7	-176.5	-57.6	-178.3	-174.7	-139.3	2.8	116.6	V734 R760 F761	V734-R736 VanDerWaalsContact C-N 3.32Å; V734-R736 HydrophobicContact CG1-CG 3.93Å; V734-R736 PolarHBondContact O-N 2.87Å; R736-R760 PolarHBondContact NE-O 3.31Å; R736-R760 PolarHBondContact NH2-O 2.99Å; R736-F761 PolarHBondContact NH2-O 2.95Å
737	D	85.1	Confident	90.1	Very high	34 Å²	34	45.6 Å²	45.6	18%	0.182	26%	0.258	C	S	.	.			trans	-117.8	64.8	176.4	-167.9	26.9	0	0	0	113.4	H735 A739 R741 N742 L758	H735-D737 PolarHBondContact CE1-O 3.04Å; H735-D737 PolarHBondContact ND1-O 2.82Å; H735-D737 PolarHBondContact O-N 2.85Å; D737-A739 PolarHBondContact O-N 2.87Å; D737-R741 IonicContact OD1-CZ 2.73Å; D737-R741 IonicContact OD1-NH2 3.9Å; D737-R741 PolarHBondContact OD1-NH2 2.83Å; D737-R741 IonicContact OD2-CZ 2.64Å; D737-R741 IonicContact OD2-NE 2.61Å; D737-R741 IonicContact OD2-NH2 3.88Å; D737-R741 PolarHBondContact OD2-NH2 2.85Å; D737-N742 VanDerWaalsContact CG-ND2 3.27Å; D737-N742 PolarHBondContact O-ND2 2.86Å; D737-N742 PolarHBondContact OD2-ND2 2.03Å; D737-L758 HydrophobicContact CB-CD1 4.15Å
738	L	92.6	Very high	90.1	Very high	84 Å²	84	50 Å²	50	44%	0.44	28%	0.283	S	S	.	.			trans	-85.2	93.8	175.8	-175.6	68.4	0	0	0	110.6	I721 M725 I743 V753	I721-L738 HydrophobicContact CG2-CD1 4.43Å; M725-L738 HydrophobicContact CE-CD2 4.1Å; M725-L738 HydrophobicContact CG-CD1 4.08Å; M725-L738 HydrophobicContact CG-CD2 3.68Å; M725-L738 HydrophobicContact SD-CD1 3.65Å; M725-L738 HydrophobicContact SD-CD2 3.83Å; M725-L738 HydrophobicContact SD-CG 4.23Å; L738-I743 HydrophobicContact CD1-CD1 3.81Å; L738-V753 HydrophobicContact CD1-CG1 4.36Å; L738-V753 HydrophobicContact CD1-CG2 4.49Å
739	A	91.8	Very high	90.3	Very high	24 Å²	24	52.1 Å²	52.1	20%	0.198	29%	0.294	C	S	.	.			trans	-129	158.2	176.4	0	0	0	0	0	111.5	D737 R741 N742 I743	D737-A739 PolarHBondContact O-N 2.87Å; A739-R741 HydrophobicContact CB-CG 3.84Å; A739-R741 PolarHBondContact O-N 2.84Å; A739-R741 VanDerWaalsContact O-N 3.15Å; A739-N742 WeakPolarHBondContact O-CA 3.45Å; A739-N742 PolarHBondContact O-N 2.83Å; A739-I743 PolarHBondContact O-N 3.42Å
740	A	92.4	Very high	90.6	Very high	46 Å²	46	51.5 Å²	51.5	38%	0.38	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-62.3	-22.8	-178.9	0	0	0	0	0	113.9	L698 D699 N742 I743	L698-A740 WeakPolarHBondContact CB-O 3.48Å; L698-A740 PolarHBondContact N-O 3.03Å; D699-A740 HydrophobicContact CB-CB 3.74Å; D699-A740 PolarHBondContact N-O 3.5Å; A740-N742 VanDerWaalsContact C-N 3.28Å; A740-I743 PolarHBondContact O-N 2.93Å
741	R	91.4	Very high	91.1	Very high	133 Å²	133	46.4 Å²	46.4	50%	0.502	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-66.4	-27.1	170.1	55	164.7	-162.6	-81.5	-3.7	113.5	A697 D737 A739	A697-R741 WeakPolarHBondContact CB-O 3.41Å; D737-R741 IonicContact OD1-CZ 2.73Å; D737-R741 IonicContact OD1-NH2 3.9Å; D737-R741 PolarHBondContact OD1-NH2 2.83Å; D737-R741 IonicContact OD2-CZ 2.64Å; D737-R741 IonicContact OD2-NE 2.61Å; D737-R741 IonicContact OD2-NH2 3.88Å; D737-R741 PolarHBondContact OD2-NH2 2.85Å; A739-R741 HydrophobicContact CB-CG 3.84Å; A739-R741 PolarHBondContact O-N 2.84Å; A739-R741 VanDerWaalsContact O-N 3.15Å
742	N	93	Very high	91.7	Very high	8 Å²	8	46.5 Å²	46.5	4%	0.043	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-98.5	7.5	-178.1	-61.8	-1.2	0	0	0	112	D737 A739 A740 S754 D755	D737-N742 VanDerWaalsContact CG-ND2 3.27Å; D737-N742 PolarHBondContact O-ND2 2.86Å; D737-N742 PolarHBondContact OD2-ND2 2.03Å; A739-N742 WeakPolarHBondContact O-CA 3.45Å; A739-N742 PolarHBondContact O-N 2.83Å; A740-N742 VanDerWaalsContact C-N 3.28Å; N742-S754 CarbonylContact O-C 3.52Å; N742-S754 PolarHBondContact O-N 3.31Å; N742-S754 VanDerWaalsContact O-O 3.09Å; N742-S754 PolarHBondContact O-OG 2.92Å; N742-D755 HydrophobicContact CB-CB 4.25Å
743	I	96.9	Very high	92.3	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.021	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	120.3	169.9	-57.2	-55.8	0	0	0	108.3	A697 L698 I721 L738 A739 A740 C751 K752 V753	A697-I743 CarbonylContact C-O 3.49Å; A697-I743 WeakPolarHBondContact CA-O 3.34Å; L698-I743 HydrophobicContact CB-CB 3.91Å; L698-I743 HydrophobicContact CB-CG2 4Å; L698-I743 WeakPolarHBondContact CB-O 3.44Å; L698-I743 HydrophobicContact CD2-CB 4.05Å; L698-I743 HydrophobicContact CD2-CG2 3.84Å; L698-I743 PolarHBondContact N-O 3.38Å; I721-I743 HydrophobicContact CD1-CG1 4.22Å; I721-I743 HydrophobicContact CD1-CG2 4.04Å; I721-I743 HydrophobicContact CG1-CD1 4.25Å; I721-I743 HydrophobicContact CG1-CG1 4.32Å; I721-I743 HydrophobicContact CG1-CG2 3.94Å; I721-I743 HydrophobicContact CG2-CD1 3.98Å; L738-I743 HydrophobicContact CD1-CD1 3.81Å; A739-I743 PolarHBondContact O-N 3.42Å; A740-I743 PolarHBondContact O-N 2.93Å; I743-C751 HydrophobicContact CG2-CB 3.66Å; I743-K752 WeakPolarHBondContact CA-O 3.21Å; I743-V753 HydrophobicContact CD1-CB 4.32Å; I743-V753 HydrophobicContact CD1-CG2 3.9Å
744	L	95.9	Very high	92.7	Very high	45 Å²	45	42.7 Å²	42.7	24%	0.236	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	148.2	175.4	-64.5	173	0	0	0	111.2	I674 M693 G696 C751 K752 S754	I674-L744 HydrophobicContact CD1-CD1 3.98Å; I674-L744 HydrophobicContact CG1-CD1 4.48Å; M693-L744 HydrophobicContact CB-CB 3.84Å; M693-L744 HydrophobicContact CB-CD1 4.39Å; M693-L744 VanDerWaalsContact CE-C 3.44Å; M693-L744 HydrophobicContact CE-CB 3.82Å; M693-L744 VanDerWaalsContact CE-O 3.27Å; M693-L744 WeakPolarHBondContact CE-O 3.41Å; M693-L744 HydrophobicContact CG-CB 3.73Å; M693-L744 HydrophobicContact CG-CD1 4.04Å; M693-L744 HydrophobicContact CG-CG 4.49Å; G696-L744 CarbonylContact O-C 3.44Å; G696-L744 WeakPolarHBondContact O-CA 3.17Å; L744-C751 CarbonylContact O-C 3.56Å; L744-C751 WeakPolarHBondContact O-CA 3.39Å; L744-K752 PolarHBondContact N-O 2.75Å; L744-K752 PolarHBondContact O-N 3.3Å; L744-S754 WeakPolarHBondContact CG-OG 3.41Å
745	V	96.6	Very high	92.6	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	132.1	-177.6	-169.7	0	0	0	0	109.9	M693 N695 G696 L698 F701	M693-V745 CarbonylContact C-O 3.5Å; N695-V745 WeakPolarHBondContact CA-O 3.47Å; N695-V745 HydrophobicContact CB-CB 3.85Å; N695-V745 HydrophobicContact CB-CG1 4Å; N695-V745 WeakPolarHBondContact CB-O 3.32Å; N695-V745 PolarHBondContact N-O 2.81Å; G696-V745 PolarHBondContact O-N 2.98Å; L698-V745 HydrophobicContact CB-CG2 3.78Å; L698-V745 HydrophobicContact CD1-CG2 3.61Å; L698-V745 HydrophobicContact CG-CG2 4.3Å; F701-V745 HydrophobicContact CD1-CB 4.37Å; F701-V745 HydrophobicContact CD1-CG1 4.1Å; F701-V745 HydrophobicContact CD1-CG2 4.18Å; F701-V745 HydrophobicContact CE1-CG1 3.98Å
746	N	94.6	Very high	92.2	Very high	23 Å²	23	43 Å²	43	12%	0.123	23%	0.23	C	C	.	.			trans	-95.9	174.4	174.4	77.7	4	0	0	0	112.3	M693 E694 N695 N748 L749 V750	M693-N746 HydrophobicContact CE-CB 3.91Å; M693-N746 HydrophobicContact SD-CB 3.95Å; E694-N746 VanDerWaalsContact OE2-CA 3.25Å; E694-N746 WeakPolarHBondContact OE2-CA 3.45Å; E694-N746 VanDerWaalsContact OE2-CB 3.31Å; E694-N746 WeakPolarHBondContact OE2-CB 3.47Å; N695-N746 PolarHBondContact ND2-O 2.94Å; N746-N748 PolarHBondContact O-N 2.9Å; N746-N748 WeakPolarHBondContact OD1-CA 3.41Å; N746-N748 PolarHBondContact OD1-N 2.96Å; N746-L749 PolarHBondContact O-N 3.39Å; N746-L749 PolarHBondContact OD1-N 2.82Å; N746-V750 PolarHBondContact N-O 3.42Å; N746-V750 WeakPolarHBondContact OD1-CB 3.48Å; N746-V750 PolarHBondContact OD1-N 2.89Å
747	A	93.3	Very high	91	Very high	58 Å²	58	40 Å²	40	48%	0.479	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-22.8	-180	0	0	0	0	0	114.3	E694	E694-A747 HydrophobicContact CB-CB 4.23Å; E694-A747 HydrophobicContact CG-CB 4.12Å; E694-A747 PolarHBondContact OE2-N 2.6Å
748	N	94.3	Very high	89.3	Confident	133 Å²	133	44.1 Å²	44.1	71%	0.711	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	15.2	178.7	-63.2	-59	0	0	0	113.3	N746 V750	N746-N748 PolarHBondContact O-N 2.9Å; N746-N748 WeakPolarHBondContact OD1-CA 3.41Å; N746-N748 PolarHBondContact OD1-N 2.96Å; N748-V750 HydrophobicContact CB-CG2 4.25Å; N748-V750 PolarHBondContact O-N 3.14Å
749	L	94.1	Very high	87.3	Confident	44 Å²	44	40.3 Å²	40.3	23%	0.23	24%	0.235	C	C	.	.			trans	60.1	22.8	-176.2	-50.3	179.1	0	0	0	114.2	F701 F709 Q713 M717 N746 C751	F701-L749 HydrophobicContact CE1-CD2 3.79Å; F701-L749 HydrophobicContact CZ-CD2 3.56Å; F709-L749 HydrophobicContact CD1-CD1 4.37Å; F709-L749 HydrophobicContact CE1-CD1 4.22Å; F709-L749 HydrophobicContact CE1-CD2 4.11Å; Q713-L749 HydrophobicContact CG-CD1 4.26Å; M717-L749 HydrophobicContact CE-CB 3.92Å; M717-L749 HydrophobicContact CE-CD1 4.21Å; M717-L749 HydrophobicContact CE-CD2 3.98Å; M717-L749 HydrophobicContact CE-CG 4.26Å; N746-L749 PolarHBondContact O-N 3.39Å; N746-L749 PolarHBondContact OD1-N 2.82Å; L749-C751 PolarHBondContact O-N 2.86Å
750	V	96.3	Very high	85.4	Confident	51 Å²	51	46.8 Å²	46.8	31%	0.309	26%	0.255	S	S	.	.			trans	-82.7	114.6	174.4	-176	0	0	0	0	108.9	N746 N748	N746-V750 PolarHBondContact N-O 3.42Å; N746-V750 WeakPolarHBondContact OD1-CB 3.48Å; N746-V750 PolarHBondContact OD1-N 2.89Å; N748-V750 HydrophobicContact CB-CG2 4.25Å; N748-V750 PolarHBondContact O-N 3.14Å
751	C	97.6	Very high	82.8	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.007	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	137.2	172.2	-66.7	0	0	0	0	111.6	N672 M717 I721 I743 L744 L749	N672-C751 PolarHBondContact ND2-O 2.86Å; M717-C751 VanDerWaalsContact CB-SG 3.52Å; I721-C751 HydrophobicContact CD1-CB 4.23Å; I721-C751 HydrophobicContact CG1-CB 3.68Å; I743-C751 HydrophobicContact CG2-CB 3.66Å; L744-C751 CarbonylContact O-C 3.56Å; L744-C751 WeakPolarHBondContact O-CA 3.39Å; L749-C751 PolarHBondContact O-N 2.86Å
752	K	97.2	Very high	80.3	Confident	21 Å²	21	46.6 Å²	46.6	9%	0.091	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	136.2	175	-57.3	-167	174.3	-160.8	0	111.2	P671 N672 E691 M693 I743 L744	P671-K752 WeakPolarHBondContact O-CE 3.07Å; N672-K752 WeakPolarHBondContact O-CA 3.41Å; E691-K752 VanDerWaalsContact OE1-CD 3.23Å; E691-K752 WeakPolarHBondContact OE1-CD 3.37Å; E691-K752 WeakPolarHBondContact OE1-CE 3.44Å; E691-K752 IonicContact OE1-NZ 3.98Å; E691-K752 PolarHBondContact OE1-NZ 2.57Å; E691-K752 IonicContact OE2-NZ 3.18Å; E691-K752 PolarHBondContact OE2-NZ 3.28Å; M693-K752 HydrophobicContact CE-CB 3.92Å; M693-K752 HydrophobicContact CE-CD 3.8Å; M693-K752 HydrophobicContact CE-CG 3.65Å; M693-K752 HydrophobicContact SD-CD 3.95Å; M693-K752 HydrophobicContact SD-CG 4.47Å; I743-K752 WeakPolarHBondContact CA-O 3.21Å; L744-K752 PolarHBondContact N-O 2.75Å; L744-K752 PolarHBondContact O-N 3.3Å
753	V	96.3	Very high	77.5	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	135.1	172.5	-177.6	0	0	0	0	109.3	N672 I674 I721 M725 L728 H735 L738 I743	N672-V753 PolarHBondContact O-N 3.02Å; I674-V753 PolarHBondContact N-O 3.43Å; I721-V753 HydrophobicContact CG2-CG2 4.49Å; M725-V753 HydrophobicContact CG-CG2 4.31Å; M725-V753 HydrophobicContact SD-CG1 4.18Å; M725-V753 HydrophobicContact SD-CG2 4.22Å; L728-V753 HydrophobicContact CD1-CG1 4.26Å; H735-V753 WeakPolarHBondContact CD2-CG1 3.11Å; H735-V753 WeakPolarHBondContact NE2-CG1 3.08Å; L738-V753 HydrophobicContact CD1-CG1 4.36Å; L738-V753 HydrophobicContact CD1-CG2 4.49Å; I743-V753 HydrophobicContact CD1-CB 4.32Å; I743-V753 HydrophobicContact CD1-CG2 3.9Å
754	S	91.6	Very high	74.7	Confident	9 Å²	9	59.9 Å²	59.9	6%	0.063	32%	0.322	C	S	.	.			trans	-150.9	175.5	-175.5	67.8	0	0	0	0	111.3	H735 N742 L744	H735-S754 PolarHBondContact CE1-O 2.92Å; H735-S754 VanDerWaalsContact CE1-O 3.25Å; H735-S754 PolarHBondContact NE2-O 2.82Å; H735-S754 VanDerWaalsContact NE2-O 3.1Å; N742-S754 CarbonylContact O-C 3.52Å; N742-S754 PolarHBondContact O-N 3.31Å; N742-S754 VanDerWaalsContact O-O 3.09Å; N742-S754 PolarHBondContact O-OG 2.92Å; L744-S754 WeakPolarHBondContact CG-OG 3.41Å
755	D	82.6	Confident	71.8	Confident	71 Å²	71	65.5 Å²	65.5	38%	0.38	35%	0.352	S	S	.	.			trans	62.5	89.9	-176.9	-160.8	-7.9	0	0	0	114.6	H735 N742 G757	H735-D755 PolarHBondContact CE1-O 3.45Å; H735-D755 PolarHBondContact NE2-O 3.29Å; N742-D755 HydrophobicContact CB-CB 4.25Å; D755-G757 PolarHBondContact OD1-N 2.82Å
756	F	77.9	Confident	68.7	Low	1 Å²	1	69 Å²	69	0%	0.004	38%	0.376	C	S	.	.			trans	-98.5	10.1	-177.6	-64.3	-82.6	0	0	0	113.6	I664 M665 F668 I673 I674 L728 F733 H735 L758 S759	I664-F756 HydrophobicContact CB-CB 4.38Å; I664-F756 HydrophobicContact CD1-CB 4.42Å; I664-F756 HydrophobicContact CG2-CB 3.81Å; I664-F756 HydrophobicContact CG2-CD1 3.88Å; I664-F756 HydrophobicContact CG2-CD2 4.47Å; I664-F756 HydrophobicContact CG2-CG 3.8Å; M665-F756 HydrophobicContact CG-CD2 3.48Å; M665-F756 VanDerWaalsContact CG-CD2 3.48Å; M665-F756 HydrophobicContact CG-CE2 3.75Å; M665-F756 HydrophobicContact SD-CD2 4.29Å; F668-F756 HydrophobicContact CD2-CE1 4.39Å; F668-F756 HydrophobicContact CD2-CZ 4.28Å; F668-F756 HydrophobicContact CE2-CE1 4.18Å; I673-F756 HydrophobicContact CG2-CE2 4.34Å; I673-F756 HydrophobicContact CG2-CZ 3.92Å; I674-F756 HydrophobicContact CG2-CE2 4.13Å; L728-F756 HydrophobicContact CD1-CE1 4.13Å; L728-F756 HydrophobicContact CD2-CE1 4.27Å; F733-F756 AromaticContact CE1-CD1 3.66Å; F733-F756 HydrophobicContact CE1-CD1 3.66Å; F733-F756 AromaticContact CE1-CE1 3.79Å; F733-F756 HydrophobicContact CE1-CE1 3.79Å; F733-F756 AromaticContact CZ-CD1 3.79Å; F733-F756 HydrophobicContact CZ-CD1 3.79Å; F733-F756 HydrophobicContact CZ-CE1 4.3Å; H735-F756 AromaticContact CD2-CD1 3.9Å; H735-F756 AromaticContact CD2-CE1 3.57Å; H735-F756 AromaticContact NE2-CE1 3.87Å; F756-L758 PolarHBondContact O-N 3.33Å; F756-S759 WeakPolarHBondContact O-CB 3.3Å; F756-S759 PolarHBondContact O-N 2.98Å; F756-S759 PolarHBondContact O-OG 3.16Å
757	G	59	Low	65.8	Low	49 Å²	49	74 Å²	74	51%	0.505	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.2	-171.6	0	0	0	0	0	115.6	D755	D755-G757 PolarHBondContact OD1-N 2.82Å
758	L	49.7	Very low	62.8	Low	121 Å²	121	76.7 Å²	76.7	63%	0.634	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	7.2	179.1	-62.5	176.2	0	0	0	114.1	D737 F756	D737-L758 HydrophobicContact CB-CD1 4.15Å; F756-L758 PolarHBondContact O-N 3.33Å
759	S	51.9	Low	60	Low	4 Å²	4	75.1 Å²	75.1	3%	0.028	42%	0.417	C	S	.	.			trans	-79.1	140.1	-176.4	-65.7	0	0	0	0	112.8	F733 H735 F756	F733-S759 WeakPolarHBondContact CZ-OG 3.36Å; H735-S759 PolarHBondContact O-OG 3.23Å; F756-S759 WeakPolarHBondContact O-CB 3.3Å; F756-S759 PolarHBondContact O-N 2.98Å; F756-S759 PolarHBondContact O-OG 3.16Å
760	R	49.9	Very low	57.2	Low	160 Å²	160	77.6 Å²	77.6	60%	0.604	43%	0.434	S	S	*	.			trans	-144.5	142.7	175.2	-80.4	-174.3	175.2	177.2	-0.5	111.8	R736	R736-R760 PolarHBondContact NE-O 3.31Å; R736-R760 PolarHBondContact NH2-O 2.99Å
761	F	39.4	Very low	54.1	Low	70 Å²	70	85.2 Å²	85.2	31%	0.307	46%	0.459	S	S	.	.			trans	-57.9	155.5	173.5	-169.9	-115.7	0	0	0	112.4	Y587 D589 R736 T763	Y587-F761 AromaticContact CD1-CD2 3.65Å; Y587-F761 HydrophobicContact CD1-CD2 3.65Å; Y587-F761 HydrophobicContact CD1-CE2 4.16Å; Y587-F761 HydrophobicContact CE1-CB 4.26Å; Y587-F761 AromaticContact CE1-CD2 3.94Å; Y587-F761 HydrophobicContact CE1-CD2 3.94Å; Y587-F761 HydrophobicContact CE1-CG 4.49Å; D589-F761 HydrophobicContact CB-CB 4Å; D589-F761 HydrophobicContact CB-CG 4.42Å; D589-F761 WeakPolarHBondContact OD2-CB 3.49Å; R736-F761 PolarHBondContact NH2-O 2.95Å; F761-T763 HydrophobicContact CD1-CG2 4.09Å; F761-T763 HydrophobicContact CE1-CG2 4.04Å
762	L	38	Very low	51	Low	105 Å²	105	90.9 Å²	90.9	55%	0.55	49%	0.493	S	S	.	.			trans	-112.2	111.1	171.2	-73.6	173.5	0	0	0	108.7	V734	V734-L762 HydrophobicContact CG2-CD1 3.78Å
763	T	35.4	Very low	47.7	Very low	92 Å²	92	95.4 Å²	95.4	56%	0.564	53%	0.528	S	S	*	.			trans	-79.3	125.7	165.9	34.3	0	0	0	0	109.5	F761 N765	F761-T763 HydrophobicContact CD1-CG2 4.09Å; F761-T763 HydrophobicContact CE1-CG2 4.04Å; T763-N765 PolarHBondContact O-N 2.83Å
764	E	37.2	Very low	44.6	Very low	199 Å²	199	100.9 Å²	100.9	93%	0.93	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	12.8	-174.9	-69.4	-169.4	139.3	0	0	116
765	N	34.6	Very low	41.6	Very low	163 Å²	163	111.5 Å²	111.5	87%	0.872	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.4	13.2	-172.5	-92.9	-38.4	0	0	0	116.1	T763	T763-N765 PolarHBondContact O-N 2.83Å
766	S	31.7	Very low	39.5	Very low	73 Å²	73	113.5 Å²	113.5	51%	0.51	63%	0.632	S	S	.	*			trans	-93.6	107.3	166.5	57.9	0	0	0	0	110.8	D768	S766-D768 PolarHBondContact O-N 2.04Å
767	S	34.6	Very low	37.5	Very low	128 Å²	128	119.4 Å²	119.4	90%	0.895	67%	0.666	S	S	*	*			trans	-74.5	45.1	172.2	62.2	0	0	0	0	112.4
768	D	30	Very low	36.3	Very low	115 Å²	115	123.3 Å²	123.3	62%	0.615	67%	0.674	S	S	*	*			trans	-129.1	100.6	-169	-157.6	6.4	0	0	0	109.4	S766 T770	S766-D768 PolarHBondContact O-N 2.04Å; D768-T770 VanDerWaalsContact C-N 3.33Å; D768-T770 PolarHBondContact O-N 3.41Å; D768-T770 PolarHBondContact O-OG1 3.2Å
769	P	35	Very low	35.5	Very low	100 Å²	100	123.5 Å²	123.5	65%	0.649	68%	0.677	S	S	*	*			trans	-74.8	86.4	-177.1	30.8	-33.5	0	0	0	109.6	Y771	P769-Y771 HydrophobicContact CB-CD2 4.35Å; P769-Y771 HydrophobicContact CB-CE2 4.49Å; P769-Y771 PolarHBondContact O-N 3.14Å
770	T	35.8	Very low	34.5	Very low	97 Å²	97	130.9 Å²	130.9	60%	0.595	72%	0.717	S	S	*	*			trans	-72.9	71.6	179.8	-20	0	0	0	0	111.6	D768 T772	D768-T770 VanDerWaalsContact C-N 3.33Å; D768-T770 PolarHBondContact O-N 3.41Å; D768-T770 PolarHBondContact O-OG1 3.2Å; T770-T772 PolarHBondContact O-N 3.42Å; T770-T772 VanDerWaalsContact O-N 3.17Å
771	Y	30.7	Very low	33.5	Very low	211 Å²	211	129 Å²	129	83%	0.827	73%	0.725	S	S	*	*			trans	-62.6	109.4	160.9	-82.4	-89.6	0	0	0	108.6	P769 S773	P769-Y771 HydrophobicContact CB-CD2 4.35Å; P769-Y771 HydrophobicContact CB-CE2 4.49Å; P769-Y771 PolarHBondContact O-N 3.14Å; Y771-S773 PolarHBondContact O-N 3.04Å
772	T	31.7	Very low	33.1	Very low	120 Å²	120	133.2 Å²	133.2	74%	0.736	76%	0.755	S	S	*	*			trans	-85.3	96.4	162.1	40.1	0	0	0	0	108.7	T770 S774	T770-T772 PolarHBondContact O-N 3.42Å; T770-T772 VanDerWaalsContact O-N 3.17Å; T772-S774 PolarHBondContact O-N 2.82Å
773	S	29.8	Very low	32.7	Very low	116 Å²	116	135.4 Å²	135.4	81%	0.811	77%	0.771	S	S	*	*			trans	-72.1	99.6	167.3	53.8	0	0	0	0	109.6	Y771	Y771-S773 PolarHBondContact O-N 3.04Å
774	S	29.7	Very low	32.4	Very low	114 Å²	114	139 Å²	139	80%	0.797	79%	0.788	S	S	*	*			trans	-151.2	105.2	168.9	-54.8	0	0	0	0	108.8	T772	T772-S774 PolarHBondContact O-N 2.82Å
775	L	28.6	Very low	32	Very low	232 Å²	232	133.5 Å²	133.5	100%	1.215	78%	0.775	S	S	*	*			trans	-116	0	164.9	-106.7	169.7	0	0	0	107.2

Retrieved 775 of 775 residues in 695.8 ms (Link to these results)

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