A0A077YZD3_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YZD3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 461 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.9	Very low	30.4	Very low	246 Å²	246	140.6 Å²	140.6	100%	1.212	81%	0.809	S	S	*	*				0	130.3	0	-92.1	175.2	174.1	0	0	108.2
2	V	34.8	Very low	29.9	Very low	121 Å²	121	141.8 Å²	141.8	73%	0.733	81%	0.81	S	S	*	*			trans	-66.9	148.6	172.8	179.2	0	0	0	0	109.6	L4	V2-L4 HydrophobicContact CG1-CB 4.38Å; V2-L4 HydrophobicContact CG1-CG 4Å; V2-L4 VanDerWaalsContact CG1-N 3.3Å
3	P	43.6	Very low	29.7	Very low	120 Å²	120	138.2 Å²	138.2	78%	0.779	81%	0.809	S	S	*	*				-130	125.7	106.4	29	-14.6	0	0	0	109.7
4	L	28.4	Very low	29.5	Very low	138 Å²	138	135.1 Å²	135.1	72%	0.723	80%	0.798	S	S	*	*				97.6	128.2	59.5	-93	163.3	0	0	0	111.8	V2	V2-L4 HydrophobicContact CG1-CB 4.38Å; V2-L4 HydrophobicContact CG1-CG 4Å; V2-L4 VanDerWaalsContact CG1-N 3.3Å
5	N	29.7	Very low	29.2	Very low	131 Å²	131	136.3 Å²	136.3	70%	0.701	79%	0.793	S	S	*	*			trans	88.9	85.1	155.5	-68.1	-4.4	0	0	0	120.1
6	S	25.7	Very low	29.1	Very low	94 Å²	94	138.2 Å²	138.2	66%	0.657	80%	0.799	S	S	*	*				10.9	115.8	112.4	59.8	0	0	0	0	117.4
7	N	29.4	Very low	29	Very low	169 Å²	169	137.9 Å²	137.9	90%	0.904	79%	0.794	S	S	*	*				-134	108.9	129.2	-100.9	-17.4	0	0	0	108.7
8	S	24.3	Very low	29	Very low	111 Å²	111	135.7 Å²	135.7	78%	0.776	80%	0.795	S	S	*	*			trans	-73.4	126.4	162.6	50.3	0	0	0	0	109.5
9	S	27.3	Very low	28.8	Very low	114 Å²	114	131.8 Å²	131.8	80%	0.797	79%	0.787	S	S	*	*			trans	-162.3	111.3	137.4	56.5	0	0	0	0	108.8	N11	S9-N11 PolarHBondContact O-N 2.92Å
10	N	23.5	Very low	28.7	Very low	143 Å²	143	132.7 Å²	132.7	77%	0.765	79%	0.787	S	S	*	*			trans	-29	129.8	159	-64.6	-17.4	0	0	0	112.4
11	N	27.7	Very low	28.5	Very low	160 Å²	160	133.1 Å²	133.1	86%	0.856	79%	0.785	S	S	*	*				-148.7	98.9	129.1	-93.5	-24.6	0	0	0	106.6	S9 A13	S9-N11 PolarHBondContact O-N 2.92Å; N11-A13 PolarHBondContact O-N 2.72Å
12	D	24.9	Very low	27.8	Very low	154 Å²	154	127.5 Å²	127.5	82%	0.824	76%	0.764	S	S	*	*			trans	-52.5	92.9	154.2	-68.3	-47.3	0	0	0	107.9
13	A	27.4	Very low	27.4	Very low	95 Å²	95	127.4 Å²	127.4	79%	0.785	76%	0.759	S	S	*	*			trans	-105.5	71.5	156.8	0	0	0	0	0	106.7	N11	N11-A13 PolarHBondContact O-N 2.72Å
14	S	26.3	Very low	26.5	Very low	95 Å²	95	124.9 Å²	124.9	66%	0.664	74%	0.744	S	S	*	*			trans	-52.4	133.5	152.3	51.1	0	0	0	0	109.2
15	E	25.8	Very low	26.5	Very low	153 Å²	153	126.5 Å²	126.5	72%	0.715	75%	0.754	S	S	*	*			trans	54.6	83.7	153.2	-60.5	-176.7	162.1	0	0	116.7
16	N	27.7	Very low	26.4	Very low	167 Å²	167	125.4 Å²	125.4	89%	0.893	75%	0.747	S	S	*	*				-102.9	84.8	125.4	-92.1	-21	0	0	0	106.7	A18	N16-A18 VanDerWaalsContact C-N 3.29Å; N16-A18 PolarHBondContact O-N 2.85Å
17	N	26.3	Very low	26.8	Very low	133 Å²	133	126 Å²	126	71%	0.711	74%	0.739	S	S	*	*			trans	-45.8	106.8	149.8	-90.6	-35.7	0	0	0	105.7	G19	N17-G19 PolarHBondContact O-N 3.15Å
18	A	30.1	Very low	27.4	Very low	98 Å²	98	119.1 Å²	119.1	81%	0.81	71%	0.708	S	S	*	*			trans	-60.2	85	169.1	0	0	0	0	0	106.5	N16 D20	N16-A18 VanDerWaalsContact C-N 3.29Å; N16-A18 PolarHBondContact O-N 2.85Å; A18-D20 PolarHBondContact O-N 3.45Å
19	G	25.2	Very low	28.2	Very low	62 Å²	62	120.1 Å²	120.1	64%	0.639	70%	0.696	S	S	*	*			trans	-61.8	103.8	179.8	0	0	0	0	0	108.3	N17 L21	N17-G19 PolarHBondContact O-N 3.15Å; G19-L21 VanDerWaalsContact C-N 3.27Å; G19-L21 PolarHBondContact O-N 3.16Å
20	D	26.6	Very low	29.1	Very low	149 Å²	149	119.4 Å²	119.4	80%	0.797	68%	0.676	S	S	*	*			trans	37.4	45.9	150.4	-70.6	-21.1	0	0	0	117.3	A18 V22	A18-D20 PolarHBondContact O-N 3.45Å; D20-V22 PolarHBondContact O-N 2.92Å
21	L	24.6	Very low	30	Very low	143 Å²	143	116.1 Å²	116.1	75%	0.749	66%	0.656	S	S	*	*			trans	-72.4	85	148.8	-91.2	165	0	0	0	107	G19 L23	G19-L21 VanDerWaalsContact C-N 3.27Å; G19-L21 PolarHBondContact O-N 3.16Å; L21-L23 HydrophobicContact CB-CD1 4.46Å; L21-L23 HydrophobicContact CB-CG 4.22Å; L21-L23 HydrophobicContact CD2-CD2 4.38Å; L21-L23 PolarHBondContact O-N 3.18Å
22	V	24.5	Very low	30.6	Very low	128 Å²	128	110 Å²	110	78%	0.776	62%	0.623	S	S	*	*			trans	-68.9	76.5	164.2	-175.6	0	0	0	0	107.2	D20 S24	D20-V22 PolarHBondContact O-N 2.92Å; V22-S24 PolarHBondContact O-N 3.37Å; V22-S24 VanDerWaalsContact O-N 3.13Å
23	L	25.4	Very low	31.2	Very low	118 Å²	118	108.2 Å²	108.2	62%	0.618	61%	0.613	S	S	*	*			trans	-72.3	99.5	169.4	-69.6	165.5	0	0	0	106.1	L21 D25	L21-L23 HydrophobicContact CB-CD1 4.46Å; L21-L23 HydrophobicContact CB-CG 4.22Å; L21-L23 HydrophobicContact CD2-CD2 4.38Å; L21-L23 PolarHBondContact O-N 3.18Å; L23-D25 PolarHBondContact O-N 2.96Å
24	S	26.2	Very low	31.9	Very low	67 Å²	67	113.8 Å²	113.8	47%	0.469	61%	0.614	S	S	.	*			trans	-61.9	131.8	177.3	63.7	0	0	0	0	109.7	V22 I26	V22-S24 PolarHBondContact O-N 3.37Å; V22-S24 VanDerWaalsContact O-N 3.13Å; S24-I26 PolarHBondContact O-N 3.36Å
25	D	27	Very low	33.2	Very low	172 Å²	172	111.2 Å²	111.2	92%	0.92	59%	0.594	S	S	*	*	S	Bend	trans	-63.7	21	169.8	-54.1	-38.2	0	0	0	113.8	L23	L23-D25 PolarHBondContact O-N 2.96Å
26	I	29	Very low	34.1	Very low	108 Å²	108	109 Å²	109	55%	0.554	58%	0.584	S	S	*	*	S	Bend	trans	-92.9	126.4	175.4	-57.9	172.1	0	0	0	105.6	S24 G28	S24-I26 PolarHBondContact O-N 3.36Å; I26-G28 VanDerWaalsContact C-N 3.33Å; I26-G28 WeakPolarHBondContact O-CA 3.37Å; I26-G28 PolarHBondContact O-N 3.4Å
27	E	34.3	Very low	34.8	Very low	107 Å²	107	108.1 Å²	108.1	50%	0.5	57%	0.568	S	S	.	*			trans	-33.8	95.5	170.7	-66.9	-176.3	160.4	0	0	110.8	Y29 R40	E27-Y29 PolarHBondContact O-N 3.37Å; E27-R40 IonicContact OE1-NH2 3.83Å; E27-R40 IonicContact OE2-CZ 3.56Å; E27-R40 IonicContact OE2-NE 2.83Å; E27-R40 IonicContact OE2-NH2 2.64Å; E27-R40 PolarHBondContact OE2-NH2 2.96Å
28	G	41	Very low	35.5	Very low	25 Å²	25	109.7 Å²	109.7	26%	0.258	57%	0.565	S	S	.	*			trans	-80.8	127.4	-157	0	0	0	0	0	109.8	I26 L41	I26-G28 VanDerWaalsContact C-N 3.33Å; I26-G28 WeakPolarHBondContact O-CA 3.37Å; I26-G28 PolarHBondContact O-N 3.4Å; G28-L41 WeakPolarHBondContact O-CA 3.35Å; G28-L41 WeakPolarHBondContact O-CB 3.4Å; G28-L41 WeakPolarHBondContact O-CD1 3.49Å; G28-L41 WeakPolarHBondContact O-CG 3.43Å; G28-L41 PolarHBondContact O-N 2.8Å
29	Y	42	Very low	36.2	Very low	131 Å²	131	108.9 Å²	108.9	51%	0.514	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	136.9	163.8	-67.5	-100.3	0	0	0	107.9	E27 Y39 R40	E27-Y29 PolarHBondContact O-N 3.37Å; Y29-Y39 CarbonylContact C-O 3.5Å; Y29-Y39 WeakPolarHBondContact CA-O 3.28Å; Y29-R40 HydrophobicContact CD1-CB 3.86Å; Y29-R40 HydrophobicContact CD1-CG 4.36Å; Y29-R40 HydrophobicContact CE1-CB 3.55Å; Y29-R40 HydrophobicContact CE1-CG 3.86Å; Y29-R40 HydrophobicContact CE2-CG 4.35Å
30	Y	46.4	Very low	37.1	Very low	100 Å²	100	112.4 Å²	112.4	39%	0.392	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	145.6	166.6	85.1	-91.8	0	0	0	110.4	D32 Y38 Y39 L41	Y30-D32 HydrophobicContact CE2-CB 4.17Å; Y30-Y38 CarbonylContact O-C 3.57Å; Y30-Y38 WeakPolarHBondContact O-CA 3.21Å; Y30-Y39 HydrophobicContact CE1-CD2 4.41Å; Y30-Y39 HydrophobicContact CE1-CG 4.3Å; Y30-Y39 HydrophobicContact CE2-CD2 4.15Å; Y30-Y39 AromaticContact CZ-CD2 3.9Å; Y30-Y39 PolarHBondContact N-O 2.77Å; Y30-Y39 PolarHBondContact O-N 2.73Å; Y30-L41 HydrophobicContact CD1-CD2 3.7Å; Y30-L41 HydrophobicContact CD1-CG 4.1Å; Y30-L41 HydrophobicContact CE1-CD2 4.2Å
31	F	42.6	Very low	38	Very low	74 Å²	74	107 Å²	107	33%	0.325	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	120.6	179.2	-175.7	-108.5	0	0	0	109.9	N33 Y38	F31-N33 WeakPolarHBondContact CD1-OD1 3.2Å; F31-N33 WeakPolarHBondContact CE1-OD1 3.45Å; F31-Y38 HydrophobicContact CB-CD1 3.92Å; F31-Y38 HydrophobicContact CB-CE1 3.74Å; F31-Y38 AromaticContact CD2-CD1 3.84Å; F31-Y38 HydrophobicContact CD2-CD1 3.84Å; F31-Y38 AromaticContact CD2-CD2 3.73Å; F31-Y38 HydrophobicContact CD2-CD2 3.73Å; F31-Y38 AromaticContact CD2-CE1 3.61Å; F31-Y38 HydrophobicContact CD2-CE1 3.61Å; F31-Y38 AromaticContact CD2-CE2 3.47Å; F31-Y38 HydrophobicContact CD2-CE2 3.47Å; F31-Y38 VanDerWaalsContact CD2-CE2 3.47Å; F31-Y38 AromaticContact CD2-CG 3.9Å; F31-Y38 HydrophobicContact CD2-CG 3.9Å; F31-Y38 AromaticContact CD2-CZ 3.4Å; F31-Y38 VanDerWaalsContact CD2-CZ 3.4Å; F31-Y38 HydrophobicContact CE2-CD2 4.13Å; F31-Y38 AromaticContact CE2-CE2 3.7Å; F31-Y38 HydrophobicContact CE2-CE2 3.7Å; F31-Y38 AromaticContact CE2-CZ 3.94Å; F31-Y38 HydrophobicContact CG-CD1 4.36Å; F31-Y38 HydrophobicContact CG-CE1 4Å
32	D	40.3	Very low	38.9	Very low	32 Å²	32	101.4 Å²	101.4	17%	0.171	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	110	174.2	175.7	0.4	0	0	0	109.7	Y30 R34 T35 Q36 R37 Y39	Y30-D32 HydrophobicContact CE2-CB 4.17Å; D32-R34 VanDerWaalsContact C-N 3.26Å; D32-R34 PolarHBondContact O-N 3.5Å; D32-R34 WeakPolarHBondContact OD1-CA 3.3Å; D32-R34 WeakPolarHBondContact OD1-CB 3.46Å; D32-R34 PolarHBondContact OD1-N 2.6Å; D32-T35 WeakPolarHBondContact CB-OG1 3.21Å; D32-T35 PolarHBondContact O-N 3.04Å; D32-T35 PolarHBondContact OD1-N 3.29Å; D32-T35 WeakPolarHBondContact OD2-CB 3.47Å; D32-T35 WeakPolarHBondContact OD2-CG2 3.11Å; D32-T35 PolarHBondContact OD2-OG1 3.33Å; D32-Q36 VanDerWaalsContact O-CA 3.28Å; D32-Q36 WeakPolarHBondContact O-CA 3.34Å; D32-Q36 PolarHBondContact O-N 3.19Å; D32-R37 PolarHBondContact N-O 2.74Å; D32-R37 PolarHBondContact O-N 3.05Å; D32-Y39 HydrophobicContact CB-CD2 4.01Å; D32-Y39 HydrophobicContact CB-CE2 3.64Å
33	N	37.3	Very low	40	Very low	115 Å²	115	98.7 Å²	98.7	62%	0.615	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-28.4	178.5	-80.1	-13.7	0	0	0	113.3	F31 Q36	F31-N33 WeakPolarHBondContact CD1-OD1 3.2Å; F31-N33 WeakPolarHBondContact CE1-OD1 3.45Å; N33-Q36 PolarHBondContact O-NE2 3.05Å
34	R	40.6	Very low	41.1	Very low	213 Å²	213	96.1 Å²	96.1	80%	0.804	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-40.8	-179.4	-172	-175.5	66.1	94	-1.2	111.1	D32	D32-R34 VanDerWaalsContact C-N 3.26Å; D32-R34 PolarHBondContact O-N 3.5Å; D32-R34 WeakPolarHBondContact OD1-CA 3.3Å; D32-R34 WeakPolarHBondContact OD1-CB 3.46Å; D32-R34 PolarHBondContact OD1-N 2.6Å
35	T	54.8	Low	41.9	Very low	40 Å²	40	101.1 Å²	101.1	25%	0.245	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-8.7	179.8	65.1	0	0	0	0	114.1	D32 R37 Y39	D32-T35 WeakPolarHBondContact CB-OG1 3.21Å; D32-T35 PolarHBondContact O-N 3.04Å; D32-T35 PolarHBondContact OD1-N 3.29Å; D32-T35 WeakPolarHBondContact OD2-CB 3.47Å; D32-T35 WeakPolarHBondContact OD2-CG2 3.11Å; D32-T35 PolarHBondContact OD2-OG1 3.33Å; T35-R37 VanDerWaalsContact C-N 3.27Å; T35-R37 WeakPolarHBondContact O-CG 3.4Å; T35-R37 PolarHBondContact O-N 2.63Å; T35-Y39 PolarHBondContact OG1-OH 2.79Å; T35-Y39 VanDerWaalsContact OG1-OH 3.1Å
36	Q	43.4	Very low	42.6	Very low	108 Å²	108	94.8 Å²	94.8	51%	0.505	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	44	-175.3	-63.5	-72.6	-53.1	0	0	111.8	D32 N33	D32-Q36 VanDerWaalsContact O-CA 3.28Å; D32-Q36 WeakPolarHBondContact O-CA 3.34Å; D32-Q36 PolarHBondContact O-N 3.19Å; N33-Q36 PolarHBondContact O-NE2 3.05Å
37	R	42.4	Very low	43.3	Very low	148 Å²	148	101.1 Å²	101.1	56%	0.558	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.4	146.1	-176.1	-71.4	173.6	-176.2	-168.4	1.6	111.2	D32 T35 Y39	D32-R37 PolarHBondContact N-O 2.74Å; D32-R37 PolarHBondContact O-N 3.05Å; T35-R37 VanDerWaalsContact C-N 3.27Å; T35-R37 WeakPolarHBondContact O-CG 3.4Å; T35-R37 PolarHBondContact O-N 2.63Å; R37-Y39 HydrophobicContact CB-CD2 4.48Å; R37-Y39 HydrophobicContact CB-CE2 3.76Å; R37-Y39 WeakPolarHBondContact CD-OH 3.3Å
38	Y	41.8	Very low	43.6	Very low	165 Å²	165	100 Å²	100	65%	0.647	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	131.6	168.7	-68.1	-89.1	0	0	0	109.6	Y30 F31	Y30-Y38 CarbonylContact O-C 3.57Å; Y30-Y38 WeakPolarHBondContact O-CA 3.21Å; F31-Y38 HydrophobicContact CB-CD1 3.92Å; F31-Y38 HydrophobicContact CB-CE1 3.74Å; F31-Y38 AromaticContact CD2-CD1 3.84Å; F31-Y38 HydrophobicContact CD2-CD1 3.84Å; F31-Y38 AromaticContact CD2-CD2 3.73Å; F31-Y38 HydrophobicContact CD2-CD2 3.73Å; F31-Y38 AromaticContact CD2-CE1 3.61Å; F31-Y38 HydrophobicContact CD2-CE1 3.61Å; F31-Y38 AromaticContact CD2-CE2 3.47Å; F31-Y38 HydrophobicContact CD2-CE2 3.47Å; F31-Y38 VanDerWaalsContact CD2-CE2 3.47Å; F31-Y38 AromaticContact CD2-CG 3.9Å; F31-Y38 HydrophobicContact CD2-CG 3.9Å; F31-Y38 AromaticContact CD2-CZ 3.4Å; F31-Y38 VanDerWaalsContact CD2-CZ 3.4Å; F31-Y38 HydrophobicContact CE2-CD2 4.13Å; F31-Y38 AromaticContact CE2-CE2 3.7Å; F31-Y38 HydrophobicContact CE2-CE2 3.7Å; F31-Y38 AromaticContact CE2-CZ 3.94Å; F31-Y38 HydrophobicContact CG-CD1 4.36Å; F31-Y38 HydrophobicContact CG-CE1 4Å
39	Y	45	Very low	43.6	Very low	81 Å²	81	108 Å²	108	32%	0.318	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	135.7	174.6	-63.2	-85.3	0	0	0	109.6	Y29 Y30 D32 T35 R37	Y29-Y39 CarbonylContact C-O 3.5Å; Y29-Y39 WeakPolarHBondContact CA-O 3.28Å; Y30-Y39 HydrophobicContact CE1-CD2 4.41Å; Y30-Y39 HydrophobicContact CE1-CG 4.3Å; Y30-Y39 HydrophobicContact CE2-CD2 4.15Å; Y30-Y39 AromaticContact CZ-CD2 3.9Å; Y30-Y39 PolarHBondContact N-O 2.77Å; Y30-Y39 PolarHBondContact O-N 2.73Å; D32-Y39 HydrophobicContact CB-CD2 4.01Å; D32-Y39 HydrophobicContact CB-CE2 3.64Å; T35-Y39 PolarHBondContact OG1-OH 2.79Å; T35-Y39 VanDerWaalsContact OG1-OH 3.1Å; R37-Y39 HydrophobicContact CB-CD2 4.48Å; R37-Y39 HydrophobicContact CB-CE2 3.76Å; R37-Y39 WeakPolarHBondContact CD-OH 3.3Å
40	R	44.2	Very low	43.8	Very low	136 Å²	136	105.5 Å²	105.5	51%	0.513	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	121.2	178.6	-170.6	177.9	179.9	-173.2	-0.4	109	E27 Y29 S42	E27-R40 IonicContact OE1-NH2 3.83Å; E27-R40 IonicContact OE2-CZ 3.56Å; E27-R40 IonicContact OE2-NE 2.83Å; E27-R40 IonicContact OE2-NH2 2.64Å; E27-R40 PolarHBondContact OE2-NH2 2.96Å; Y29-R40 HydrophobicContact CD1-CB 3.86Å; Y29-R40 HydrophobicContact CD1-CG 4.36Å; Y29-R40 HydrophobicContact CE1-CB 3.55Å; Y29-R40 HydrophobicContact CE1-CG 3.86Å; Y29-R40 HydrophobicContact CE2-CG 4.35Å; R40-S42 PolarHBondContact O-N 3.07Å
41	L	45.3	Very low	43.8	Very low	36 Å²	36	103.5 Å²	103.5	19%	0.188	50%	0.504	C	S	.	.			trans	-72.6	109	164.8	-60	167.5	0	0	0	106.8	G28 Y30 L57	G28-L41 WeakPolarHBondContact O-CA 3.35Å; G28-L41 WeakPolarHBondContact O-CB 3.4Å; G28-L41 WeakPolarHBondContact O-CD1 3.49Å; G28-L41 WeakPolarHBondContact O-CG 3.43Å; G28-L41 PolarHBondContact O-N 2.8Å; Y30-L41 HydrophobicContact CD1-CD2 3.7Å; Y30-L41 HydrophobicContact CD1-CG 4.1Å; Y30-L41 HydrophobicContact CE1-CD2 4.2Å; L41-L57 HydrophobicContact CD2-CD1 4.06Å
42	S	42.9	Very low	43.8	Very low	26 Å²	26	102.1 Å²	102.1	18%	0.182	50%	0.503	C	S	.	.			trans	-74.3	148.7	174.2	54.8	0	0	0	0	110.5	R40 N46	R40-S42 PolarHBondContact O-N 3.07Å; S42-N46 VanDerWaalsContact CB-ND2 3.27Å; S42-N46 WeakPolarHBondContact CB-ND2 3.31Å; S42-N46 WeakPolarHBondContact OG-CB 3.45Å; S42-N46 VanDerWaalsContact OG-CG 3.29Å; S42-N46 PolarHBondContact OG-ND2 2.73Å
43	S	47.3	Very low	44.4	Very low	71 Å²	71	102 Å²	102	50%	0.497	50%	0.502	S	S	.	.			trans	-40.2	155.1	178.2	60.1	0	0	0	0	114.9	E45 N46	S43-E45 PolarHBondContact O-N 3.31Å; S43-N46 PolarHBondContact O-N 2.79Å
44	A	48.5	Very low	45	Very low	63 Å²	63	102.7 Å²	102.7	52%	0.521	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-26.5	180	0	0	0	0	0	115.4	W54	A44-W54 HydrophobicContact CB-CB 4.03Å
45	E	43	Very low	45.6	Very low	172 Å²	172	95.4 Å²	95.4	80%	0.804	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	11.4	-178.6	-60.3	-175.3	178.1	0	0	114.9	S43 R47	S43-E45 PolarHBondContact O-N 3.31Å; E45-R47 PolarHBondContact O-N 2.78Å
46	N	42.3	Very low	45.5	Very low	39 Å²	39	97.8 Å²	97.8	21%	0.209	49%	0.492	C	S	.	.			trans	-62.4	123.7	-175.7	-167	14.9	0	0	0	112.1	S42 S43 V48	S42-N46 VanDerWaalsContact CB-ND2 3.27Å; S42-N46 WeakPolarHBondContact CB-ND2 3.31Å; S42-N46 WeakPolarHBondContact OG-CB 3.45Å; S42-N46 VanDerWaalsContact OG-CG 3.29Å; S42-N46 PolarHBondContact OG-ND2 2.73Å; S43-N46 PolarHBondContact O-N 2.79Å; N46-V48 WeakPolarHBondContact OD1-CG2 3.3Å; N46-V48 PolarHBondContact OD1-N 2.83Å
47	R	43.8	Very low	45.8	Very low	242 Å²	242	96 Å²	96	91%	0.913	49%	0.486	S	S	*	.			trans	-101.1	10.1	176.9	-62.7	-173.8	-179.2	-175.6	-0.1	113.1	E45 Q49	E45-R47 PolarHBondContact O-N 2.78Å; R47-Q49 PolarHBondContact O-N 3.33Å
48	V	41	Very low	46.1	Very low	84 Å²	84	94.9 Å²	94.9	51%	0.509	49%	0.49	S	S	.	.			trans	-72.9	108.8	173.7	179.8	0	0	0	0	108.8	N46 G50 V51	N46-V48 WeakPolarHBondContact OD1-CG2 3.3Å; N46-V48 PolarHBondContact OD1-N 2.83Å; V48-G50 PolarHBondContact O-N 2.78Å; V48-V51 HydrophobicContact CB-CB 4.44Å; V48-V51 HydrophobicContact CB-CG2 4.25Å; V48-V51 HydrophobicContact CG1-CB 4.4Å; V48-V51 HydrophobicContact CG1-CG2 3.72Å; V48-V51 PolarHBondContact O-N 2.81Å
49	Q	41.1	Very low	46.2	Very low	191 Å²	191	90 Å²	90	89%	0.893	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	125.6	-178.4	-162.1	176.5	14.2	0	0	111.2	R47	R47-Q49 PolarHBondContact O-N 3.33Å
50	G	46.3	Very low	46.3	Very low	80 Å²	80	88.2 Å²	88.2	83%	0.825	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	-2.2	178.4	0	0	0	0	0	116	V48	V48-G50 PolarHBondContact O-N 2.78Å
51	V	45.1	Very low	45.8	Very low	58 Å²	58	87.2 Å²	87.2	35%	0.352	50%	0.503	S	S	.	.	S	Bend	trans	-98.3	117.9	171.6	178.6	0	0	0	0	108.5	V48 N53	V48-V51 HydrophobicContact CB-CB 4.44Å; V48-V51 HydrophobicContact CB-CG2 4.25Å; V48-V51 HydrophobicContact CG1-CB 4.4Å; V48-V51 HydrophobicContact CG1-CG2 3.72Å; V48-V51 PolarHBondContact O-N 2.81Å; V51-N53 PolarHBondContact O-N 3.06Å
52	P	43.7	Very low	45.4	Very low	44 Å²	44	94.4 Å²	94.4	29%	0.286	54%	0.535	S	S	.	.			trans	-59.1	129.4	179.5	-22	31.7	0	0	0	111.1	D56	P52-D56 WeakPolarHBondContact CA-OD2 3.29Å; P52-D56 HydrophobicContact CB-CB 4.4Å
53	N	52.4	Low	45	Very low	30 Å²	30	97.1 Å²	97.1	16%	0.16	55%	0.553	C	S	.	*			trans	-96.1	176.9	170.9	67.5	44.6	0	0	0	110.5	V51 A55 D56	V51-N53 PolarHBondContact O-N 3.06Å; N53-A55 VanDerWaalsContact C-N 3.26Å; N53-A55 PolarHBondContact O-N 3.42Å; N53-A55 WeakPolarHBondContact OD1-CA 3.33Å; N53-A55 VanDerWaalsContact OD1-CB 3.28Å; N53-A55 WeakPolarHBondContact OD1-CB 3.09Å; N53-A55 PolarHBondContact OD1-N 2.7Å; N53-D56 VanDerWaalsContact CG-OD2 3.26Å; N53-D56 PolarHBondContact N-OD2 2.52Å; N53-D56 PolarHBondContact ND2-OD2 2.9Å; N53-D56 PolarHBondContact O-N 3.12Å; N53-D56 PolarHBondContact OD1-N 2.71Å; N53-D56 PolarHBondContact OD1-OD2 2.84Å
54	W	50	Low	44.5	Very low	130 Å²	130	98.7 Å²	98.7	49%	0.492	56%	0.564	S	S	.	*	H	α-helix	trans	-60.7	-32.5	179.8	-166.5	-98.7	0	0	0	113.5	A44 L57 I58	A44-W54 HydrophobicContact CB-CB 4.03Å; W54-L57 PolarHBondContact O-N 3.37Å; W54-I58 VanDerWaalsContact CD1-CD1 3.46Å; W54-I58 WeakPolarHBondContact O-CG1 3.21Å; W54-I58 PolarHBondContact O-N 3.42Å
55	A	52.3	Low	44	Very low	59 Å²	59	104.5 Å²	104.5	49%	0.488	59%	0.585	S	S	.	*	H	α-helix	trans	-71.5	-34.7	178.5	0	0	0	0	0	112.2	N53 L57 I58 G59	N53-A55 VanDerWaalsContact C-N 3.26Å; N53-A55 PolarHBondContact O-N 3.42Å; N53-A55 WeakPolarHBondContact OD1-CA 3.33Å; N53-A55 VanDerWaalsContact OD1-CB 3.28Å; N53-A55 WeakPolarHBondContact OD1-CB 3.09Å; N53-A55 PolarHBondContact OD1-N 2.7Å; A55-L57 PolarHBondContact O-N 3.41Å; A55-I58 PolarHBondContact O-N 3.18Å; A55-G59 PolarHBondContact O-N 3.31Å
56	D	53.7	Low	43.5	Very low	90 Å²	90	106.9 Å²	106.9	48%	0.481	59%	0.586	S	S	.	*	H	α-helix	trans	-62.1	-30.9	176.2	-58	-36.4	0	0	0	111.8	P52 N53	P52-D56 WeakPolarHBondContact CA-OD2 3.29Å; P52-D56 HydrophobicContact CB-CB 4.4Å; N53-D56 VanDerWaalsContact CG-OD2 3.26Å; N53-D56 PolarHBondContact N-OD2 2.52Å; N53-D56 PolarHBondContact ND2-OD2 2.9Å; N53-D56 PolarHBondContact O-N 3.12Å; N53-D56 PolarHBondContact OD1-N 2.71Å; N53-D56 PolarHBondContact OD1-OD2 2.84Å
57	L	50.1	Low	43.2	Very low	70 Å²	70	109.4 Å²	109.4	37%	0.366	61%	0.607	S	S	.	*	H	α-helix	trans	-80.1	-34.1	176.8	-74.6	161.8	0	0	0	113.2	L41 W54 A55 W71	L41-L57 HydrophobicContact CD2-CD1 4.06Å; W54-L57 PolarHBondContact O-N 3.37Å; A55-L57 PolarHBondContact O-N 3.41Å; L57-W71 HydrophobicContact CD2-CH2 4.2Å; L57-W71 HydrophobicContact CD2-CZ3 4.5Å
58	I	48.8	Very low	43	Very low	126 Å²	126	102.1 Å²	102.1	65%	0.646	61%	0.608	S	S	*	*	H	α-helix	trans	-71.3	-34.7	177.3	-67.7	170.2	0	0	0	111.1	W54 A55 A60	W54-I58 VanDerWaalsContact CD1-CD1 3.46Å; W54-I58 WeakPolarHBondContact O-CG1 3.21Å; W54-I58 PolarHBondContact O-N 3.42Å; A55-I58 PolarHBondContact O-N 3.18Å; I58-A60 VanDerWaalsContact C-N 3.34Å
59	G	43	Very low	42.6	Very low	63 Å²	63	106.6 Å²	106.6	65%	0.649	62%	0.617	S	S	*	*	S	Bend	trans	-80.5	-10.3	179.4	0	0	0	0	0	114.9	A55	A55-G59 PolarHBondContact O-N 3.31Å
60	A	46.8	Very low	42.7	Very low	42 Å²	42	100.3 Å²	100.3	35%	0.347	59%	0.589	S	S	.	*	S	Bend	trans	-66.2	124	179.1	0	0	0	0	0	109.8	I58 Q62	I58-A60 VanDerWaalsContact C-N 3.34Å; A60-Q62 PolarHBondContact O-N 3.26Å
61	P	34.2	Very low	42.4	Very low	115 Å²	115	101.6 Å²	101.6	75%	0.747	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-57.8	130	177.4	20.7	-29.3	0	0	0	109.6
62	Q	37.5	Very low	42.2	Very low	187 Å²	187	105.3 Å²	105.3	87%	0.874	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-57.9	125.8	175.8	-75.5	-163.2	-4.1	0	0	108.9	A60 S64	A60-Q62 PolarHBondContact O-N 3.26Å; Q62-S64 PolarHBondContact O-N 2.87Å; Q62-S64 VanDerWaalsContact O-N 3.14Å
63	P	35	Very low	41.9	Very low	84 Å²	84	108.9 Å²	108.9	55%	0.545	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-64.9	121.9	-177.1	23.1	-29.6	0	0	0	108.9	L65	P63-L65 PolarHBondContact O-N 3.09Å
64	S	35.1	Very low	41.2	Very low	104 Å²	104	116.5 Å²	116.5	73%	0.727	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-59.6	123.7	164.8	54.4	0	0	0	0	106.8	Q62 R66	Q62-S64 PolarHBondContact O-N 2.87Å; Q62-S64 VanDerWaalsContact O-N 3.14Å; S64-R66 PolarHBondContact O-N 2.81Å
65	L	38.7	Very low	40.3	Very low	185 Å²	185	115.4 Å²	115.4	97%	0.969	63%	0.625	S	S	*	*	S	Bend	trans	-61.5	16.9	-172.7	-86.5	146.4	0	0	0	115	P63	P63-L65 PolarHBondContact O-N 3.09Å
66	R	33	Very low	39.1	Very low	221 Å²	221	120.9 Å²	120.9	83%	0.834	65%	0.646	S	S	*	*	S	Bend	trans	-106.7	113	-178	-70.6	-170.4	177.7	-163.1	0.6	110.3	S64	S64-R66 PolarHBondContact O-N 2.81Å
67	S	36.5	Very low	38	Very low	92 Å²	92	120 Å²	120	64%	0.643	66%	0.657	S	S	*	*	S	Bend	trans	62.2	100.3	169.8	68.8	0	0	0	0	116.2	Y69	S67-Y69 WeakPolarHBondContact O-CD2 3.02Å; S67-Y69 PolarHBondContact O-N 2.82Å
68	G	39.1	Very low	37	Very low	90 Å²	90	122.3 Å²	122.3	93%	0.928	68%	0.677	S	S	*	*	S	Bend		64.8	-7.4	129.4	0	0	0	0	0	120.4
69	Y	31.4	Very low	35.9	Very low	178 Å²	178	123 Å²	123	70%	0.698	69%	0.687	S	S	*	*			trans	-97.8	114.1	-178.6	-69.4	-74.8	0	0	0	109.8	S67	S67-Y69 WeakPolarHBondContact O-CD2 3.02Å; S67-Y69 PolarHBondContact O-N 2.82Å
70	D	43	Very low	35.1	Very low	59 Å²	59	127.9 Å²	127.9	32%	0.316	70%	0.697	S	S	.	*			trans	-75.6	128.9	176.4	-164.4	-15.6	0	0	0	108	R72 D73	D70-R72 HydrophobicContact CB-CB 4.49Å; D70-R72 PolarHBondContact O-N 3.35Å; D70-R72 WeakPolarHBondContact OD1-CD 3.38Å; D70-R72 WeakPolarHBondContact OD1-CG 3.19Å; D70-R72 IonicContact OD1-CZ 2.89Å; D70-R72 PolarHBondContact OD1-N 3.48Å; D70-R72 IonicContact OD1-NE 2.83Å; D70-R72 IonicContact OD1-NH1 3.3Å; D70-R72 PolarHBondContact OD1-NH1 2.89Å; D70-R72 WeakPolarHBondContact OD2-CD 3.29Å; D70-R72 IonicContact OD2-CZ 2.64Å; D70-R72 IonicContact OD2-NE 3.26Å; D70-R72 IonicContact OD2-NH1 2.86Å; D70-R72 PolarHBondContact OD2-NH1 3.41Å; D70-D73 PolarHBondContact O-N 2.87Å
71	W	41.4	Very low	34	Very low	106 Å²	106	136.6 Å²	136.6	40%	0.402	72%	0.721	S	S	.	*	G	3₁₀ helix	trans	-57	-16.3	178.6	63.8	-90	0	0	0	112.6	L57 D73 Y74 L75	L57-W71 HydrophobicContact CD2-CH2 4.2Å; L57-W71 HydrophobicContact CD2-CZ3 4.5Å; W71-D73 VanDerWaalsContact C-N 3.28Å; W71-D73 PolarHBondContact O-N 2.92Å; W71-Y74 PolarHBondContact O-N 2.65Å; W71-L75 HydrophobicContact CZ3-CD1 4.06Å
72	R	40.1	Very low	33.5	Very low	136 Å²	136	143 Å²	143	51%	0.513	73%	0.73	S	S	.	*	G	3₁₀ helix	trans	-70.7	-16.4	177.9	-60.8	174.1	-166.8	133.4	-3	114.1	D70 Y74	D70-R72 HydrophobicContact CB-CB 4.49Å; D70-R72 PolarHBondContact O-N 3.35Å; D70-R72 WeakPolarHBondContact OD1-CD 3.38Å; D70-R72 WeakPolarHBondContact OD1-CG 3.19Å; D70-R72 IonicContact OD1-CZ 2.89Å; D70-R72 PolarHBondContact OD1-N 3.48Å; D70-R72 IonicContact OD1-NE 2.83Å; D70-R72 IonicContact OD1-NH1 3.3Å; D70-R72 PolarHBondContact OD1-NH1 2.89Å; D70-R72 WeakPolarHBondContact OD2-CD 3.29Å; D70-R72 IonicContact OD2-CZ 2.64Å; D70-R72 IonicContact OD2-NE 3.26Å; D70-R72 IonicContact OD2-NH1 2.86Å; D70-R72 PolarHBondContact OD2-NH1 3.41Å; R72-Y74 PolarHBondContact O-N 2.49Å
73	D	38	Very low	32.8	Very low	120 Å²	120	145.7 Å²	145.7	64%	0.642	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-73.2	-10.5	176.5	-68.2	-25.1	0	0	0	112.7	D70 W71	D70-D73 PolarHBondContact O-N 2.87Å; W71-D73 VanDerWaalsContact C-N 3.28Å; W71-D73 PolarHBondContact O-N 2.92Å
74	Y	36.7	Very low	32.4	Very low	189 Å²	189	149.4 Å²	149.4	74%	0.741	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-93.1	6.6	-179.4	-64.4	-82.4	0	0	0	114.3	W71 R72	W71-Y74 PolarHBondContact O-N 2.65Å; R72-Y74 PolarHBondContact O-N 2.49Å
75	L	31.8	Very low	31.8	Very low	108 Å²	108	150.5 Å²	150.5	57%	0.565	75%	0.747	S	S	*	*			trans	-103.9	91.4	-179	-65.8	176.3	0	0	0	111.5	W71 G77	W71-L75 HydrophobicContact CZ3-CD1 4.06Å; L75-G77 PolarHBondContact O-N 2.79Å
76	D	26.3	Very low	31.1	Very low	174 Å²	174	149.1 Å²	149.1	93%	0.93	74%	0.735	S	S	*	*			trans	-70.5	110.9	168	-84.1	-32.7	0	0	0	110.2
77	G	32	Very low	30.7	Very low	70 Å²	70	149.7 Å²	149.7	72%	0.722	74%	0.737	S	S	*	*			trans	-148.1	117.8	-178.1	0	0	0	0	0	113.8	L75	L75-G77 PolarHBondContact O-N 2.79Å
78	P	27.8	Very low	30.1	Very low	120 Å²	120	150.7 Å²	150.7	78%	0.779	73%	0.734	S	S	*	*			trans	-87.9	160.7	-167.7	30.1	-28.5	0	0	0	115.9	L80	P78-L80 PolarHBondContact O-N 2.64Å
79	V	25.8	Very low	29.6	Very low	141 Å²	141	149.9 Å²	149.9	86%	0.855	71%	0.706	S	S	*	*			trans	-61.7	95.6	-177.5	-177.5	0	0	0	0	112	R81	V79-R81 PolarHBondContact O-N 3.16Å
80	L	26.2	Very low	29.3	Very low	164 Å²	164	141.5 Å²	141.5	86%	0.859	67%	0.674	S	S	*	*			trans	-79.1	104.5	174.6	-85.4	160.7	0	0	0	111.9	P78	P78-L80 PolarHBondContact O-N 2.64Å
81	R	25.5	Very low	28.6	Very low	225 Å²	225	139.5 Å²	139.5	85%	0.849	66%	0.663	S	S	*	*			trans	-83.6	115.8	156	-73.1	179.9	174.2	179.1	-1	108.6	V79	V79-R81 PolarHBondContact O-N 3.16Å
82	R	23.5	Very low	28.3	Very low	250 Å²	250	135.8 Å²	135.8	94%	0.943	65%	0.652	S	S	*	*			trans	-179.2	151.4	147	-101.9	163	-169.2	-158.3	4.4	112.4
83	R	22.7	Very low	27.6	Very low	243 Å²	243	130.5 Å²	130.5	92%	0.917	63%	0.633	S	S	*	*			trans	-62.2	128.7	-174	-63	172.9	174.6	178.8	-3.6	112.6
84	H	25.3	Very low	27	Very low	163 Å²	163	126.5 Å²	126.5	76%	0.755	61%	0.61	S	S	*	*			trans	-145.7	121.9	153.3	-105.4	-84	0	0	0	108.3
85	P	23.7	Very low	26.4	Very low	126 Å²	126	123.9 Å²	123.9	82%	0.818	60%	0.599	S	S	*	*			trans	-95.3	90.4	172.2	33.6	-24.7	0	0	0	109.6
86	E	23.9	Very low	26.1	Very low	156 Å²	156	120.1 Å²	120.1	73%	0.729	58%	0.579	S	S	*	*			trans	-142.7	106.3	171	-70.3	-176.1	-165.3	0	0	109.7
87	R	24.5	Very low	26	Very low	234 Å²	234	112.6 Å²	112.6	88%	0.883	54%	0.54	S	S	*	.			trans	-147.7	90.3	166.6	-75.7	-163.6	171.8	179.9	-4	112
88	I	24.3	Very low	25.6	Very low	112 Å²	112	114.7 Å²	114.7	57%	0.574	53%	0.531	S	S	*	.				25.5	104.7	127.2	-55.7	178.4	0	0	0	115.2	N368	I88-N368 HydrophobicContact CG2-CB 4.34Å
89	E	26.9	Very low	25.4	Very low	73 Å²	73	112.6 Å²	112.6	34%	0.341	51%	0.513	S	S	.	.				72.2	124	99.4	-72.6	171.1	-167.6	0	0	114.8	Q94	E89-Q94 VanDerWaalsContact CA-OE1 3.25Å; E89-Q94 VanDerWaalsContact CG-NE2 3.25Å
90	N	25.8	Very low	25.4	Very low	3 Å²	3	107.4 Å²	107.4	2%	0.016	48%	0.48	C	S	.	.			trans	172.9	143.2	141.6	-90.4	-58.9	0	0	0	110.3	Q284 F342 N368 W369 T370	N90-Q284 HydrophobicContact CB-CG 4.11Å; N90-Q284 PolarHBondContact O-NE2 2.84Å; N90-F342 HydrophobicContact CB-CE1 3.74Å; N90-F342 HydrophobicContact CB-CE2 4.25Å; N90-F342 HydrophobicContact CB-CZ 3.27Å; N90-F342 WeakPolarHBondContact ND2-CE1 3Å; N90-F342 WeakPolarHBondContact ND2-CE2 3.43Å; N90-F342 WeakPolarHBondContact ND2-CZ 3.32Å; N90-F342 WeakPolarHBondContact OD1-CE1 3.34Å; N90-F342 WeakPolarHBondContact OD1-CZ 2.74Å; N90-N368 VanDerWaalsContact ND2-C 3.33Å; N90-N368 PolarHBondContact ND2-O 2.84Å; N90-N368 VanDerWaalsContact OD1-C 3.24Å; N90-N368 PolarHBondContact OD1-O 3.1Å; N90-W369 WeakPolarHBondContact OD1-CA 3.46Å; N90-W369 PolarHBondContact OD1-N 3.21Å; N90-W369 PolarHBondContact OD1-O 2.85Å; N90-T370 VanDerWaalsContact C-OG1 3.31Å; N90-T370 VanDerWaalsContact CA-OG1 3.23Å; N90-T370 WeakPolarHBondContact CA-OG1 3.28Å; N90-T370 WeakPolarHBondContact CB-OG1 3.4Å; N90-T370 WeakPolarHBondContact OD1-CA 3.32Å; N90-T370 PolarHBondContact OD1-N 2.82Å; N90-T370 PolarHBondContact OD1-OG1 2.86Å
91	L	28.9	Very low	25.3	Very low	17 Å²	17	103.7 Å²	103.7	9%	0.089	47%	0.466	C	S	.	.	S	Bend	trans	-67.4	156.5	173.5	-54.2	159.5	0	0	0	109.3	Q94 Q284 T370	L91-Q94 HydrophobicContact CD2-CB 4.49Å; L91-Q284 PolarHBondContact O-NE2 2.93Å; L91-Q284 VanDerWaalsContact O-O 3.05Å; L91-T370 VanDerWaalsContact CB-CB 3.41Å; L91-T370 HydrophobicContact CB-CG2 3.52Å; L91-T370 HydrophobicContact CD1-CG2 4.23Å; L91-T370 VanDerWaalsContact CD1-O 3.23Å; L91-T370 WeakPolarHBondContact CD1-O 2.89Å; L91-T370 HydrophobicContact CG-CG2 4.29Å; L91-T370 PolarHBondContact N-OG1 3.01Å; L91-T370 WeakPolarHBondContact O-CG2 3.4Å; L91-T370 PolarHBondContact O-OG1 2.8Å
92	P	33.7	Very low	25.3	Very low	27 Å²	27	99.4 Å²	99.4	18%	0.175	45%	0.45	C	S	.	.	S	Bend	cis	-76.2	143	19	3.4	6	0	0	0	112.7	K244 S245 Q284 A285	P92-K244 CarbonylContact C-O 3.59Å; P92-K244 WeakPolarHBondContact CD-O 3.47Å; P92-K244 CarbonylContact O-C 3.35Å; P92-S245 WeakPolarHBondContact CD-OG 3.36Å; P92-S245 WeakPolarHBondContact CG-OG 3.4Å; P92-S245 PolarHBondContact O-N 3.29Å; P92-Q284 WeakPolarHBondContact CD-O 3.19Å; P92-A285 HydrophobicContact CG-CB 4.25Å
93	F	27	Very low	25.4	Very low	25 Å²	25	91 Å²	91	11%	0.11	44%	0.441	C	S	.	.	S	Bend	trans	59.2	71	174.5	-72.1	-65.6	0	0	0	116.3	A208 F209 T210 V243 V246	F93-A208 WeakPolarHBondContact CE1-O 3.38Å; F93-A208 VanDerWaalsContact CE2-O 3.31Å; F93-A208 WeakPolarHBondContact CE2-O 3.31Å; F93-A208 WeakPolarHBondContact CZ-O 3.47Å; F93-F209 HydrophobicContact CE1-CB 4.34Å; F93-F209 HydrophobicContact CE1-CD1 4.16Å; F93-T210 HydrophobicContact CB-CG2 3.92Å; F93-T210 VanDerWaalsContact CB-OG1 3.23Å; F93-T210 WeakPolarHBondContact CB-OG1 3.47Å; F93-T210 HydrophobicContact CD1-CG2 3.83Å; F93-T210 VanDerWaalsContact CD1-N 3.3Å; F93-T210 WeakPolarHBondContact CD1-OG1 3.47Å; F93-T210 HydrophobicContact CD2-CG2 4.25Å; F93-T210 VanDerWaalsContact CE1-N 3.31Å; F93-T210 HydrophobicContact CG-CG2 3.67Å; F93-T210 WeakPolarHBondContact CG-OG1 3.39Å; F93-V243 HydrophobicContact CB-CG1 4.34Å; F93-V246 HydrophobicContact CD2-CB 3.74Å; F93-V246 HydrophobicContact CD2-CG2 3.52Å; F93-V246 HydrophobicContact CE2-CB 3.59Å; F93-V246 HydrophobicContact CE2-CG2 3.79Å; F93-V246 HydrophobicContact CG-CG2 4.27Å
94	Q	24.9	Very low	25.7	Very low	36 Å²	36	88.1 Å²	88.1	17%	0.168	43%	0.43	C	S	.	.			trans	-119.3	121.4	157.6	-169.4	148.2	-19.4	0	0	111.7	E89 L91 L96	E89-Q94 VanDerWaalsContact CA-OE1 3.25Å; E89-Q94 VanDerWaalsContact CG-NE2 3.25Å; L91-Q94 HydrophobicContact CD2-CB 4.49Å; Q94-L96 PolarHBondContact O-N 2.85Å
95	R	24.8	Very low	25.8	Very low	135 Å²	135	81 Å²	81	51%	0.509	40%	0.399	S	S	.	.			trans	36.7	68.9	144.8	-71.8	-179.4	166.3	-176.6	-6.1	117.8
96	L	24.2	Very low	26	Very low	28 Å²	28	78.3 Å²	78.3	15%	0.147	39%	0.394	C	S	.	.			trans	-105.1	28.1	142.5	-128.9	96	0	0	0	114.1	Q94 Y143 S145 K163 N170	Q94-L96 PolarHBondContact O-N 2.85Å; L96-Y143 HydrophobicContact CD1-CE2 3.41Å; L96-Y143 VanDerWaalsContact CD1-CE2 3.41Å; L96-Y143 WeakPolarHBondContact CD1-OH 3.4Å; L96-Y143 HydrophobicContact CD2-CE2 3.52Å; L96-Y143 WeakPolarHBondContact CD2-OH 3.27Å; L96-Y143 HydrophobicContact CG-CE2 3.89Å; L96-Y143 WeakPolarHBondContact CG-OH 3.32Å; L96-S145 VanDerWaalsContact CD2-CB 3.48Å; L96-K163 HydrophobicContact CD2-CB 3.52Å; L96-K163 HydrophobicContact CD2-CD 3.96Å; L96-K163 HydrophobicContact CD2-CG 3.87Å; L96-N170 WeakPolarHBondContact CD2-OD1 3.32Å; L96-N170 VanDerWaalsContact O-CG 3.29Å; L96-N170 PolarHBondContact O-ND2 3.32Å; L96-N170 PolarHBondContact O-OD1 3.14Å
97	V	24.8	Very low	26.3	Very low	16 Å²	16	80.6 Å²	80.6	10%	0.097	40%	0.396	C	S	.	.			trans	-123	92.3	170.1	-176.9	0	0	0	0	106.7	L100 N170 V211	V97-L100 HydrophobicContact CG1-CD1 4.24Å; V97-L100 HydrophobicContact CG1-CG 3.94Å; V97-N170 WeakPolarHBondContact CG2-ND2 3.31Å; V97-V211 HydrophobicContact CB-CG1 4.41Å; V97-V211 HydrophobicContact CG1-CG1 3.77Å; V97-V211 HydrophobicContact CG2-CB 4.41Å; V97-V211 HydrophobicContact CG2-CG1 4.22Å; V97-V211 HydrophobicContact CG2-CG2 4.37Å
98	E	22.8	Very low	26.8	Very low	115 Å²	115	71.5 Å²	71.5	54%	0.537	36%	0.364	S	S	.	.			trans	-62.9	125.4	150.6	-71.3	155.8	155.4	0	0	106.5	L100 K163 E168	E98-L100 PolarHBondContact O-N 2.67Å; E98-K163 IonicContact OE2-NZ 3.15Å; E98-K163 PolarHBondContact OE2-NZ 3.02Å; E98-E168 HydrophobicContact CB-CB 4.39Å; E98-E168 HydrophobicContact CB-CG 4.44Å
99	L	23.2	Very low	27.3	Very low	75 Å²	75	69.7 Å²	69.7	39%	0.393	36%	0.358	S	S	.	.			trans	25.9	81.1	156.7	-64.7	164.2	0	0	0	115.3	P101 I214	L99-P101 VanDerWaalsContact O-CD 3.31Å; L99-P101 WeakPolarHBondContact O-CD 3.47Å; L99-I214 HydrophobicContact CD2-CB 4.06Å; L99-I214 HydrophobicContact CD2-CD1 3.97Å; L99-I214 HydrophobicContact CD2-CG1 4.06Å; L99-I214 HydrophobicContact CG-CD1 4.26Å
100	L	26.1	Very low	27.9	Very low	33 Å²	33	68.6 Å²	68.6	17%	0.173	35%	0.354	C	S	.	.			trans	-73.9	123	152.9	-74.8	176.4	0	0	0	107.2	V97 E98 Y102 V105 V211	V97-L100 HydrophobicContact CG1-CD1 4.24Å; V97-L100 HydrophobicContact CG1-CG 3.94Å; E98-L100 PolarHBondContact O-N 2.67Å; L100-Y102 PolarHBondContact O-N 3.15Å; L100-V105 HydrophobicContact CB-CG2 4.31Å; L100-V105 HydrophobicContact CD1-CB 4.22Å; L100-V105 HydrophobicContact CD1-CG1 4.17Å; L100-V105 HydrophobicContact CD1-CG2 3.65Å; L100-V211 HydrophobicContact CD1-CG1 3.51Å; L100-V211 HydrophobicContact CG-CG1 4.35Å
101	P	25.6	Very low	28.9	Very low	85 Å²	85	70 Å²	70	55%	0.552	36%	0.361	S	S	*	.			trans	-56.4	129.3	158.3	-16.5	29.3	0	0	0	107.1	L99 G103 R104	L99-P101 VanDerWaalsContact O-CD 3.31Å; L99-P101 WeakPolarHBondContact O-CD 3.47Å; P101-G103 PolarHBondContact O-N 3.46Å; P101-R104 PolarHBondContact O-N 3.16Å
102	Y	24.8	Very low	29.8	Very low	136 Å²	136	77.8 Å²	77.8	53%	0.533	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-35.9	-29.9	-174.6	-172	-103.2	0	0	0	115.9	L100 D216	L100-Y102 PolarHBondContact O-N 3.15Å; Y102-D216 HydrophobicContact CD2-CB 4.24Å; Y102-D216 WeakPolarHBondContact CD2-OD2 3.45Å; Y102-D216 HydrophobicContact CE2-CB 4.39Å
103	G	25.8	Very low	30.5	Very low	73 Å²	73	79.1 Å²	79.1	75%	0.753	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	0.1	-178.3	0	0	0	0	0	118.6	P101	P101-G103 PolarHBondContact O-N 3.46Å
104	R	28	Very low	31.5	Very low	182 Å²	182	78 Å²	78	69%	0.687	40%	0.395	S	S	*	.			trans	-114.6	-1	-174.7	-70.7	-168	-176.5	-174.9	3.8	117.5	P101 G106 R107	P101-R104 PolarHBondContact O-N 3.16Å; R104-G106 PolarHBondContact O-N 3.02Å; R104-G106 VanDerWaalsContact O-N 3.16Å; R104-R107 PolarHBondContact O-N 3.21Å
105	V	28.4	Very low	32.7	Very low	14 Å²	14	78.2 Å²	78.2	9%	0.085	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-19.6	172.7	-155.7	0	0	0	0	112.2	L100 R107 V211 F236	L100-V105 HydrophobicContact CB-CG2 4.31Å; L100-V105 HydrophobicContact CD1-CB 4.22Å; L100-V105 HydrophobicContact CD1-CG1 4.17Å; L100-V105 HydrophobicContact CD1-CG2 3.65Å; V105-R107 PolarHBondContact O-N 2.76Å; V105-R107 VanDerWaalsContact O-N 3.09Å; V105-V211 HydrophobicContact CG1-CG1 4.48Å; V105-V211 HydrophobicContact CG1-CG2 4.29Å; V105-V211 HydrophobicContact CG2-CG1 4.38Å; V105-F236 HydrophobicContact CB-CE1 4.28Å; V105-F236 HydrophobicContact CG1-CE1 3.62Å; V105-F236 HydrophobicContact CG1-CZ 4.24Å
106	G	27.8	Very low	34	Very low	70 Å²	70	74.4 Å²	74.4	72%	0.722	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-3.6	170.3	0	0	0	0	0	114.8	R104	R104-G106 PolarHBondContact O-N 3.02Å; R104-G106 VanDerWaalsContact O-N 3.16Å
107	R	30.4	Very low	35.7	Very low	203 Å²	203	73.8 Å²	73.8	77%	0.766	39%	0.393	S	S	*	.			trans	-119.9	70.6	171.8	-75	-173.2	178	-178	-0.3	110.5	R104 V105 T109	R104-R107 PolarHBondContact O-N 3.21Å; V105-R107 PolarHBondContact O-N 2.76Å; V105-R107 VanDerWaalsContact O-N 3.09Å; R107-T109 HydrophobicContact CB-CG2 4.44Å; R107-T109 PolarHBondContact O-N 3.15Å
108	I	34.3	Very low	37.6	Very low	43 Å²	43	84.1 Å²	84.1	22%	0.221	43%	0.43	C	S	.	.			trans	-69	95.4	150.1	-58.4	-170.1	0	0	0	105.7	M110 I172 I231 M234	I108-M110 PolarHBondContact O-N 3.37Å; I108-I172 HydrophobicContact CD1-CD1 4.16Å; I108-I172 HydrophobicContact CG2-CB 4.22Å; I108-I172 HydrophobicContact CG2-CD1 3.59Å; I108-I172 HydrophobicContact CG2-CG1 3.68Å; I108-I231 HydrophobicContact CB-CD1 4.11Å; I108-I231 HydrophobicContact CG2-CD1 3.82Å; I108-M234 HydrophobicContact CB-CE 3.94Å; I108-M234 HydrophobicContact CD1-CE 3.45Å; I108-M234 VanDerWaalsContact CD1-CE 3.45Å; I108-M234 HydrophobicContact CD1-SD 3.84Å; I108-M234 HydrophobicContact CG1-CE 3.73Å; I108-M234 HydrophobicContact CG1-SD 4.16Å
109	T	35.4	Very low	40	Very low	74 Å²	74	81.3 Å²	81.3	45%	0.454	42%	0.415	S	S	.	.			trans	-77.5	119.2	172.3	44.6	0	0	0	0	108.3	R107 D111	R107-T109 HydrophobicContact CB-CG2 4.44Å; R107-T109 PolarHBondContact O-N 3.15Å; T109-D111 PolarHBondContact O-N 2.64Å
110	M	38.7	Very low	42.5	Very low	51 Å²	51	81.1 Å²	81.1	25%	0.251	42%	0.419	S	S	.	.	B	Isolated β-bridge	trans	-63.6	122.3	163.1	-70.5	-164.5	163	0	0	108.9	I108 R112 I174 F225 G229 I231	I108-M110 PolarHBondContact O-N 3.37Å; M110-R112 PolarHBondContact O-N 3.16Å; M110-I174 HydrophobicContact CE-CD1 4Å; M110-I174 HydrophobicContact SD-CD1 4.47Å; M110-F225 HydrophobicContact CE-CD1 3.66Å; M110-F225 HydrophobicContact CE-CE1 3.42Å; M110-F225 VanDerWaalsContact CE-CE1 3.42Å; M110-G229 WeakPolarHBondContact CE-O 3.11Å; M110-I231 HydrophobicContact CE-CB 4.3Å; M110-I231 HydrophobicContact CE-CD1 3.78Å; M110-I231 HydrophobicContact CE-CG1 3.52Å
111	D	47.5	Very low	44.5	Very low	31 Å²	31	86.4 Å²	86.4	17%	0.166	44%	0.437	C	S	.	.			trans	-93.3	98	175.9	-153.2	-37.9	0	0	0	109.8	T109 S113 V114 F141 K164	T109-D111 PolarHBondContact O-N 2.64Å; D111-S113 PolarHBondContact O-N 2.84Å; D111-S113 WeakPolarHBondContact OD1-CB 3.38Å; D111-S113 PolarHBondContact OD1-N 3.47Å; D111-S113 PolarHBondContact OD1-OG 3.09Å; D111-V114 HydrophobicContact CB-CG2 4.42Å; D111-V114 PolarHBondContact O-N 3.01Å; D111-F141 HydrophobicContact CB-CE2 4.26Å; D111-F141 HydrophobicContact CB-CZ 3.71Å; D111-F141 VanDerWaalsContact OD2-CZ 3.29Å; D111-F141 WeakPolarHBondContact OD2-CZ 3.42Å; D111-K164 WeakPolarHBondContact OD2-CE 3.23Å; D111-K164 IonicContact OD2-NZ 3.67Å; D111-K164 PolarHBondContact OD2-NZ 3.21Å
112	R	48.5	Very low	46.6	Very low	182 Å²	182	85 Å²	85	69%	0.687	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-63.9	-12.8	174.3	-66.4	-174.5	179	179.5	-0.7	112.3	M110 V114 T115 A116	M110-R112 PolarHBondContact O-N 3.16Å; R112-V114 PolarHBondContact O-N 3.02Å; R112-T115 PolarHBondContact O-N 2.85Å; R112-T115 PolarHBondContact O-OG1 2.81Å; R112-A116 PolarHBondContact O-N 2.78Å
113	S	48	Very low	48.1	Very low	54 Å²	54	81.8 Å²	81.8	38%	0.378	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-61.6	-30.1	173.6	67	0	0	0	0	112.6	D111 T115 A116 L117	D111-S113 PolarHBondContact O-N 2.84Å; D111-S113 WeakPolarHBondContact OD1-CB 3.38Å; D111-S113 PolarHBondContact OD1-N 3.47Å; D111-S113 PolarHBondContact OD1-OG 3.09Å; S113-T115 PolarHBondContact O-N 3Å; S113-A116 CarbonylContact O-C 3.52Å; S113-A116 WeakPolarHBondContact O-CA 3.36Å; S113-A116 PolarHBondContact O-N 2.81Å; S113-L117 PolarHBondContact O-N 3.25Å
114	V	48.1	Very low	49.4	Very low	2 Å²	2	79.1 Å²	79.1	1%	0.012	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-65.9	-31	175.3	-175.5	0	0	0	0	111.1	D111 R112 A116 L117 F141 L162 V175 M443	D111-V114 HydrophobicContact CB-CG2 4.42Å; D111-V114 PolarHBondContact O-N 3.01Å; R112-V114 PolarHBondContact O-N 3.02Å; V114-A116 VanDerWaalsContact C-N 3.26Å; V114-A116 PolarHBondContact O-N 2.9Å; V114-L117 HydrophobicContact CG1-CD1 4.05Å; V114-L117 VanDerWaalsContact O-CD1 3.28Å; V114-L117 WeakPolarHBondContact O-CD1 3.23Å; V114-L117 WeakPolarHBondContact O-CG 3.29Å; V114-F141 HydrophobicContact CG2-CD2 4.34Å; V114-F141 HydrophobicContact CG2-CE2 3.72Å; V114-F141 HydrophobicContact CG2-CZ 4.31Å; V114-L162 HydrophobicContact CB-CD1 4.48Å; V114-L162 HydrophobicContact CG1-CD1 4.34Å; V114-L162 HydrophobicContact CG2-CD1 3.3Å; V114-V175 HydrophobicContact CG1-CG2 4.01Å; V114-M443 HydrophobicContact CG1-CE 3.91Å
115	T	49.7	Very low	50.1	Low	40 Å²	40	78.4 Å²	78.4	25%	0.245	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-77	-13.3	172.9	60.3	0	0	0	0	113.1	R112 S113 I174 Y193	R112-T115 PolarHBondContact O-N 2.85Å; R112-T115 PolarHBondContact O-OG1 2.81Å; S113-T115 PolarHBondContact O-N 3Å; T115-I174 WeakPolarHBondContact CG2-O 3.35Å; T115-Y193 WeakPolarHBondContact O-CD1 3.38Å; T115-Y193 WeakPolarHBondContact O-CE1 3.26Å
116	A	52.9	Low	50.5	Low	56 Å²	56	89.5 Å²	89.5	46%	0.463	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-105	13.4	-179	0	0	0	0	0	113.6	R112 S113 V114 R118	R112-A116 PolarHBondContact O-N 2.78Å; S113-A116 CarbonylContact O-C 3.52Å; S113-A116 WeakPolarHBondContact O-CA 3.36Å; S113-A116 PolarHBondContact O-N 2.81Å; V114-A116 VanDerWaalsContact C-N 3.26Å; V114-A116 PolarHBondContact O-N 2.9Å; A116-R118 PolarHBondContact O-N 2.81Å
117	L	58.8	Low	51.2	Low	15 Å²	15	97.9 Å²	97.9	8%	0.079	46%	0.455	C	S	.	.			trans	-61.2	130	-179.6	-65.5	172.1	0	0	0	110.9	S113 V114 W119 A136 E137 M443	S113-L117 PolarHBondContact O-N 3.25Å; V114-L117 HydrophobicContact CG1-CD1 4.05Å; V114-L117 VanDerWaalsContact O-CD1 3.28Å; V114-L117 WeakPolarHBondContact O-CD1 3.23Å; V114-L117 WeakPolarHBondContact O-CG 3.29Å; L117-W119 HydrophobicContact CD1-CZ2 4.4Å; L117-W119 PolarHBondContact O-N 2.85Å; L117-A136 HydrophobicContact CB-CB 3.7Å; L117-A136 HydrophobicContact CD1-CB 4.11Å; L117-A136 HydrophobicContact CG-CB 4.36Å; L117-E137 WeakPolarHBondContact CD2-O 3.43Å; L117-M443 HydrophobicContact CD1-SD 4.02Å
118	R	64.9	Low	51.8	Low	232 Å²	232	90.7 Å²	90.7	88%	0.875	43%	0.434	S	S	*	.			trans	-76.5	105.4	173.2	-71.2	-173.7	179	-173.4	0.3	109.6	A116	A116-R118 PolarHBondContact O-N 2.81Å
119	W	73.5	Confident	52.2	Low	56 Å²	56	100.4 Å²	100.4	21%	0.212	47%	0.468	C	S	.	.			trans	-81	124.4	176	-68.6	89.7	0	0	0	111.1	L117 K134 R135 A136 I191 L436 M443 L445	L117-W119 HydrophobicContact CD1-CZ2 4.4Å; L117-W119 PolarHBondContact O-N 2.85Å; W119-K134 HydrophobicContact CE3-CB 3.75Å; W119-K134 HydrophobicContact CZ3-CB 4.34Å; W119-R135 CarbonylContact C-O 3.57Å; W119-R135 WeakPolarHBondContact CA-O 3.36Å; W119-A136 HydrophobicContact CD2-CB 3.58Å; W119-A136 HydrophobicContact CE3-CB 3.75Å; W119-A136 HydrophobicContact CG-CB 4.16Å; W119-A136 HydrophobicContact CH2-CB 3.94Å; W119-A136 HydrophobicContact CZ2-CB 3.71Å; W119-A136 HydrophobicContact CZ3-CB 3.96Å; W119-I191 HydrophobicContact CD2-CD1 3.72Å; W119-I191 HydrophobicContact CE3-CD1 3.97Å; W119-I191 HydrophobicContact CH2-CD1 3.33Å; W119-I191 HydrophobicContact CZ2-CD1 3.08Å; W119-I191 HydrophobicContact CZ2-CG1 4.35Å; W119-I191 HydrophobicContact CZ2-CG2 4.41Å; W119-I191 HydrophobicContact CZ3-CD1 3.78Å; W119-L436 HydrophobicContact CH2-CD1 3.89Å; W119-M443 HydrophobicContact CH2-CB 3.59Å; W119-M443 HydrophobicContact CZ2-CB 4.21Å; W119-M443 HydrophobicContact CZ2-SD 4.5Å; W119-M443 HydrophobicContact CZ3-CB 4.37Å; W119-L445 HydrophobicContact CZ3-CB 4.26Å
120	S	74.5	Confident	52.9	Low	71 Å²	71	100.4 Å²	100.4	50%	0.497	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	137.9	172.7	58.6	0	0	0	0	110.5	K134 R135	S120-K134 CarbonylContact O-C 3.56Å; S120-K134 WeakPolarHBondContact O-CA 3.48Å; S120-R135 PolarHBondContact N-O 2.93Å; S120-R135 PolarHBondContact O-N 2.76Å; S120-R135 PolarHBondContact OG-O 3.3Å
121	R	69.4	Low	54	Low	144 Å²	144	99.4 Å²	99.4	54%	0.543	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	142.3	169.9	-66.1	-174.1	-170.3	-165.9	5.8	109.3	K134 E188	R121-K134 HydrophobicContact CG-CG 4.44Å; R121-E188 VanDerWaalsContact CZ-CD 3.48Å; R121-E188 IonicContact CZ-OE1 3.08Å; R121-E188 IonicContact CZ-OE2 3.45Å; R121-E188 IonicContact NE-OE2 2.72Å; R121-E188 IonicContact NH1-OE1 2.68Å; R121-E188 PolarHBondContact NH1-OE1 3.17Å; R121-E188 IonicContact NH1-OE2 3.79Å; R121-E188 IonicContact NH2-OE1 3.36Å; R121-E188 PolarHBondContact NH2-OE1 3.05Å; R121-E188 IonicContact NH2-OE2 2.8Å; R121-E188 PolarHBondContact NH2-OE2 3.36Å
122	Y	70	Confident	54.8	Low	56 Å²	56	100.6 Å²	100.6	22%	0.22	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	142	166.8	71.8	-76.7	0	0	0	109.4	A124 R133 R135 Q444	Y122-A124 PolarHBondContact O-N 2.85Å; Y122-R133 HydrophobicContact CD1-CB 4Å; Y122-R133 WeakPolarHBondContact CD1-O 3.48Å; Y122-R133 HydrophobicContact CE1-CB 3.28Å; Y122-R133 HydrophobicContact CE1-CG 4.48Å; Y122-R133 HydrophobicContact CE2-CB 4.01Å; Y122-R133 PolarHBondContact N-O 2.83Å; Y122-R133 VanDerWaalsContact N-O 3.09Å; Y122-R133 WeakPolarHBondContact OH-CB 3.35Å; Y122-R133 WeakPolarHBondContact OH-CD 3.47Å; Y122-R135 HydrophobicContact CD1-CB 4.17Å; Y122-R135 HydrophobicContact CD1-CG 3.93Å; Y122-R135 HydrophobicContact CE1-CB 4.12Å; Y122-R135 HydrophobicContact CE1-CG 3.44Å; Y122-R135 VanDerWaalsContact CE1-CG 3.44Å; Y122-R135 VanDerWaalsContact CE1-NE 3.33Å; Y122-R135 VanDerWaalsContact CZ-CZ 3.49Å; Y122-R135 PolarHBondContact OH-NE 2.75Å; Y122-R135 PolarHBondContact OH-NH2 2.89Å; Y122-Q444 HydrophobicContact CE1-CG 4.45Å; Y122-Q444 WeakPolarHBondContact OH-CG 3.33Å; Y122-Q444 PolarHBondContact OH-NE2 2.77Å; Y122-Q444 PolarHBondContact OH-OE1 2.97Å
123	G	55.8	Low	56.2	Low	69 Å²	69	94.7 Å²	94.7	71%	0.711	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.9	131.7	-179.4	0	0	0	0	0	111
124	A	51.9	Low	57.8	Low	17 Å²	17	92.7 Å²	92.7	14%	0.14	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-57.7	150.8	162.5	0	0	0	0	0	109.5	Y122 R126 T128 D131	Y122-A124 PolarHBondContact O-N 2.85Å; A124-R126 PolarHBondContact O-N 3.19Å; A124-T128 WeakPolarHBondContact CB-O 3.44Å; A124-D131 HydrophobicContact CB-CB 3.9Å; A124-D131 VanDerWaalsContact CB-O 3.25Å; A124-D131 WeakPolarHBondContact CB-O 3.15Å
125	Q	43.6	Very low	59.5	Low	167 Å²	167	96.7 Å²	96.7	78%	0.78	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-46.9	139.6	177.2	-79.3	177.8	-19.3	0	0	110.1	R127 T128	Q125-R127 PolarHBondContact O-N 3.4Å; Q125-T128 PolarHBondContact O-N 3.38Å
126	R	37.8	Very low	60.9	Low	246 Å²	246	94.9 Å²	94.9	93%	0.928	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.7	-19.6	-172.2	-83.5	-178.1	172.4	-179	-2	116.9	A124	A124-R126 PolarHBondContact O-N 3.19Å
127	R	41.4	Very low	62.3	Low	247 Å²	247	99.7 Å²	99.7	93%	0.932	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-23.2	179.1	-75.3	-173.5	171.3	-178.1	-2.4	115	Q125	Q125-R127 PolarHBondContact O-N 3.4Å
128	T	44	Very low	63.1	Low	52 Å²	52	99.1 Å²	99.1	32%	0.319	45%	0.449	S	S	.	.			trans	-117.8	73.6	174.6	59.4	0	0	0	0	110.3	A124 Q125 S130 D131	A124-T128 WeakPolarHBondContact CB-O 3.44Å; Q125-T128 PolarHBondContact O-N 3.38Å; T128-S130 PolarHBondContact O-N 2.82Å; T128-D131 VanDerWaalsContact CB-OD2 3.26Å; T128-D131 WeakPolarHBondContact CB-OD2 3.42Å; T128-D131 PolarHBondContact O-N 2.9Å; T128-D131 PolarHBondContact OG1-OD2 3.26Å
129	R	42.3	Very low	63.8	Low	246 Å²	246	90.3 Å²	90.3	93%	0.928	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-15.7	178.6	-81	-175	169.7	-179.7	-3.4	114
130	S	50	Low	64	Low	75 Å²	75	93.3 Å²	93.3	52%	0.524	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-12.5	-173.7	48.2	0	0	0	0	114.3	T128 L132 S449	T128-S130 PolarHBondContact O-N 2.82Å; S130-L132 PolarHBondContact O-N 2.97Å; S130-S449 WeakPolarHBondContact O-CB 3.41Å; S130-S449 WeakPolarHBondContact OG-CB 3.28Å; S130-S449 PolarHBondContact OG-OG 2.83Å
131	D	60.8	Low	64.3	Low	29 Å²	29	90 Å²	90	16%	0.155	43%	0.427	C	S	.	.			trans	-85.5	115.2	178.8	-63.6	-21.5	0	0	0	110.4	A124 T128 E447 S449	A124-D131 HydrophobicContact CB-CB 3.9Å; A124-D131 VanDerWaalsContact CB-O 3.25Å; A124-D131 WeakPolarHBondContact CB-O 3.15Å; T128-D131 VanDerWaalsContact CB-OD2 3.26Å; T128-D131 WeakPolarHBondContact CB-OD2 3.42Å; T128-D131 PolarHBondContact O-N 2.9Å; T128-D131 PolarHBondContact OG1-OD2 3.26Å; D131-E447 WeakPolarHBondContact CA-O 3.49Å; D131-E447 WeakPolarHBondContact CB-O 3.35Å; D131-S449 VanDerWaalsContact OD1-CB 3.28Å; D131-S449 WeakPolarHBondContact OD1-CB 3.49Å; D131-S449 PolarHBondContact OD1-N 2.82Å; D131-S449 PolarHBondContact OD1-OG 3.48Å
132	L	65.6	Low	65	Low	56 Å²	56	86.7 Å²	86.7	29%	0.293	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	133.6	171.5	-75.6	167.9	0	0	0	109.6	S130 E188 E447	S130-L132 PolarHBondContact O-N 2.97Å; L132-E188 HydrophobicContact CD1-CG 3.95Å; L132-E447 HydrophobicContact CB-CB 4.11Å; L132-E447 HydrophobicContact CB-CG 4.23Å; L132-E447 WeakPolarHBondContact CB-OE2 3.36Å; L132-E447 WeakPolarHBondContact CD1-OE2 3.47Å; L132-E447 PolarHBondContact O-N 3.31Å
133	R	77.5	Confident	65.6	Low	58 Å²	58	85 Å²	85	22%	0.219	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131	175.3	-54.5	-168.8	-176.8	-174.1	-3.2	111.4	Y122 L445	Y122-R133 HydrophobicContact CD1-CB 4Å; Y122-R133 WeakPolarHBondContact CD1-O 3.48Å; Y122-R133 HydrophobicContact CE1-CB 3.28Å; Y122-R133 HydrophobicContact CE1-CG 4.48Å; Y122-R133 HydrophobicContact CE2-CB 4.01Å; Y122-R133 PolarHBondContact N-O 2.83Å; Y122-R133 VanDerWaalsContact N-O 3.09Å; Y122-R133 WeakPolarHBondContact OH-CB 3.35Å; Y122-R133 WeakPolarHBondContact OH-CD 3.47Å; R133-L445 VanDerWaalsContact CA-O 3.29Å; R133-L445 WeakPolarHBondContact CA-O 3.19Å
134	K	80.4	Confident	66.6	Low	13 Å²	13	81.8 Å²	81.8	6%	0.057	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	142.6	175.7	-54.2	-178	-176.7	-179.1	0	109	W119 S120 R121 E188 L189 Q444 L445	W119-K134 HydrophobicContact CE3-CB 3.75Å; W119-K134 HydrophobicContact CZ3-CB 4.34Å; S120-K134 CarbonylContact O-C 3.56Å; S120-K134 WeakPolarHBondContact O-CA 3.48Å; R121-K134 HydrophobicContact CG-CG 4.44Å; K134-E188 IonicContact NZ-OE2 2.7Å; K134-E188 PolarHBondContact NZ-OE2 2.86Å; K134-L189 PolarHBondContact NZ-O 2.82Å; K134-Q444 CarbonylContact O-C 3.46Å; K134-Q444 VanDerWaalsContact O-CA 3.27Å; K134-Q444 WeakPolarHBondContact O-CA 3.36Å; K134-L445 HydrophobicContact CB-CB 4.33Å; K134-L445 HydrophobicContact CD-CD2 4.49Å; K134-L445 PolarHBondContact N-O 2.83Å; K134-L445 PolarHBondContact O-N 3.43Å
135	R	83.9	Confident	67.5	Low	85 Å²	85	81 Å²	81	32%	0.321	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	145.9	178.5	-91.1	170.6	-172.8	-177.5	5	111.7	W119 S120 Y122 V442 M443 Q444	W119-R135 CarbonylContact C-O 3.57Å; W119-R135 WeakPolarHBondContact CA-O 3.36Å; S120-R135 PolarHBondContact N-O 2.93Å; S120-R135 PolarHBondContact O-N 2.76Å; S120-R135 PolarHBondContact OG-O 3.3Å; Y122-R135 HydrophobicContact CD1-CB 4.17Å; Y122-R135 HydrophobicContact CD1-CG 3.93Å; Y122-R135 HydrophobicContact CE1-CB 4.12Å; Y122-R135 HydrophobicContact CE1-CG 3.44Å; Y122-R135 VanDerWaalsContact CE1-CG 3.44Å; Y122-R135 VanDerWaalsContact CE1-NE 3.33Å; Y122-R135 VanDerWaalsContact CZ-CZ 3.49Å; Y122-R135 PolarHBondContact OH-NE 2.75Å; Y122-R135 PolarHBondContact OH-NH2 2.89Å; R135-V442 HydrophobicContact CB-CG1 4.36Å; R135-V442 HydrophobicContact CG-CG1 3.93Å; R135-M443 CarbonylContact C-O 3.44Å; R135-M443 VanDerWaalsContact CA-O 3.29Å; R135-M443 WeakPolarHBondContact CA-O 3.31Å; R135-Q444 HydrophobicContact CG-CB 3.92Å; R135-Q444 HydrophobicContact CG-CG 4.14Å
136	A	79.9	Confident	68.9	Low	3 Å²	3	75.2 Å²	75.2	3%	0.025	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	130.9	175.6	0	0	0	0	0	110.1	L117 W119 M443	L117-A136 HydrophobicContact CB-CB 3.7Å; L117-A136 HydrophobicContact CD1-CB 4.11Å; L117-A136 HydrophobicContact CG-CB 4.36Å; W119-A136 HydrophobicContact CD2-CB 3.58Å; W119-A136 HydrophobicContact CE3-CB 3.75Å; W119-A136 HydrophobicContact CG-CB 4.16Å; W119-A136 HydrophobicContact CH2-CB 3.94Å; W119-A136 HydrophobicContact CZ2-CB 3.71Å; W119-A136 HydrophobicContact CZ3-CB 3.96Å; A136-M443 PolarHBondContact N-O 2.99Å; A136-M443 PolarHBondContact O-N 2.71Å
137	E	81.7	Confident	70.7	Confident	156 Å²	156	64 Å²	64	73%	0.729	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	126.7	170.9	-67.6	-178.1	-175.6	0	0	109.9	L117 G139	L117-E137 WeakPolarHBondContact CD2-O 3.43Å; E137-G139 PolarHBondContact O-N 3.13Å; E137-G139 VanDerWaalsContact O-N 3.12Å
138	M	76.7	Confident	72	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.02	26%	0.261	C	S	.	.			trans	-74.5	5.7	-179.3	-59.2	-168.6	-70	0	0	113.9	D140 F141 L162 M440 D441 M443	M138-D140 PolarHBondContact O-N 3.17Å; M138-F141 HydrophobicContact CB-CB 3.84Å; M138-F141 HydrophobicContact CB-CD2 4.22Å; M138-F141 HydrophobicContact CE-CB 4.43Å; M138-F141 WeakPolarHBondContact O-CD2 3.44Å; M138-F141 PolarHBondContact O-N 3.43Å; M138-L162 HydrophobicContact SD-CD2 3.91Å; M138-M440 WeakPolarHBondContact CE-O 3.4Å; M138-D441 WeakPolarHBondContact CB-O 2.91Å; M138-D441 VanDerWaalsContact CE-CA 3.47Å; M138-D441 WeakPolarHBondContact CG-O 3.47Å; M138-D441 PolarHBondContact N-O 3.42Å; M138-M443 HydrophobicContact CG-CE 4.2Å; M138-M443 HydrophobicContact CG-CG 3.72Å; M138-M443 HydrophobicContact SD-CE 3.44Å; M138-M443 WeakPolarHBondContact SD-CE 3.36Å; M138-M443 HydrophobicContact SD-CG 3.64Å; M138-M443 HydrophobicContact SD-SD 4.36Å
139	G	78.3	Confident	73.2	Confident	46 Å²	46	51.6 Å²	51.6	47%	0.474	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	-115.2	179.2	0	0	0	0	0	113	E137 F141	E137-G139 PolarHBondContact O-N 3.13Å; E137-G139 VanDerWaalsContact O-N 3.12Å; G139-F141 PolarHBondContact O-N 3.3Å; G139-F141 VanDerWaalsContact O-N 3.15Å
140	D	78.8	Confident	74.3	Confident	119 Å²	119	40.9 Å²	40.9	64%	0.636	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-7.5	-176.1	-69.9	-19.3	0	0	0	114	M138 K164 R165	M138-D140 PolarHBondContact O-N 3.17Å; D140-K164 CarbonylContact O-C 3.57Å; D140-K164 WeakPolarHBondContact O-CA 3.49Å; D140-R165 WeakPolarHBondContact O-CB 3.29Å; D140-R165 WeakPolarHBondContact O-CG 2.96Å; D140-R165 PolarHBondContact O-N 3.02Å
141	F	81	Confident	74.9	Confident	1 Å²	1	41 Å²	41	0%	0.004	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	137.1	177.1	-61.2	-73.3	0	0	0	111.8	D111 V114 M138 G139 L162 K163 K164 D441	D111-F141 HydrophobicContact CB-CE2 4.26Å; D111-F141 HydrophobicContact CB-CZ 3.71Å; D111-F141 VanDerWaalsContact OD2-CZ 3.29Å; D111-F141 WeakPolarHBondContact OD2-CZ 3.42Å; V114-F141 HydrophobicContact CG2-CD2 4.34Å; V114-F141 HydrophobicContact CG2-CE2 3.72Å; V114-F141 HydrophobicContact CG2-CZ 4.31Å; M138-F141 HydrophobicContact CB-CB 3.84Å; M138-F141 HydrophobicContact CB-CD2 4.22Å; M138-F141 HydrophobicContact CE-CB 4.43Å; M138-F141 WeakPolarHBondContact O-CD2 3.44Å; M138-F141 PolarHBondContact O-N 3.43Å; G139-F141 PolarHBondContact O-N 3.3Å; G139-F141 VanDerWaalsContact O-N 3.15Å; F141-L162 HydrophobicContact CB-CB 4.47Å; F141-L162 HydrophobicContact CD1-CB 3.36Å; F141-L162 HydrophobicContact CD1-CD1 4.14Å; F141-L162 HydrophobicContact CD1-CG 4.39Å; F141-L162 HydrophobicContact CD2-CD1 3.88Å; F141-L162 HydrophobicContact CE1-CB 3.58Å; F141-L162 HydrophobicContact CE1-CD1 4.12Å; F141-L162 HydrophobicContact CE2-CD1 3.91Å; F141-L162 HydrophobicContact CG-CB 3.9Å; F141-L162 HydrophobicContact CG-CD1 4.02Å; F141-L162 HydrophobicContact CZ-CB 4.31Å; F141-L162 HydrophobicContact CZ-CD1 4.02Å; F141-K163 CarbonylContact C-O 3.56Å; F141-K163 WeakPolarHBondContact CA-O 3.48Å; F141-K164 HydrophobicContact CD1-CB 4.38Å; F141-K164 HydrophobicContact CD1-CG 3.51Å; F141-K164 HydrophobicContact CE1-CD 4.07Å; F141-K164 VanDerWaalsContact CE1-CE 3.48Å; F141-K164 HydrophobicContact CE1-CG 3.28Å; F141-K164 HydrophobicContact CZ-CG 4.12Å; F141-D441 VanDerWaalsContact O-CB 3.31Å; F141-D441 WeakPolarHBondContact O-CB 3.43Å
142	K	83.4	Confident	74.8	Confident	76 Å²	76	42.3 Å²	42.3	33%	0.33	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-40.9	176.8	-168	-173.1	164.5	-177.5	0	111.4	K163 R165 M440 D441	K142-K163 PolarHBondContact N-O 2.75Å; K142-R165 HydrophobicContact CB-CG 4.08Å; K142-M440 HydrophobicContact CG-CE 4.19Å; K142-M440 CarbonylContact O-C 3.57Å; K142-D441 PolarHBondContact O-N 3.45Å; K142-D441 VanDerWaalsContact O-N 3.13Å
143	Y	82.9	Confident	74.7	Confident	19 Å²	19	45.9 Å²	45.9	8%	0.075	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.1	164.5	178.1	60.7	-83.1	0	0	0	112.7	L96 K163 Y415 M440	L96-Y143 HydrophobicContact CD1-CE2 3.41Å; L96-Y143 VanDerWaalsContact CD1-CE2 3.41Å; L96-Y143 WeakPolarHBondContact CD1-OH 3.4Å; L96-Y143 HydrophobicContact CD2-CE2 3.52Å; L96-Y143 WeakPolarHBondContact CD2-OH 3.27Å; L96-Y143 HydrophobicContact CG-CE2 3.89Å; L96-Y143 WeakPolarHBondContact CG-OH 3.32Å; Y143-K163 HydrophobicContact CD1-CB 4.35Å; Y143-K163 HydrophobicContact CE1-CB 3.94Å; Y143-K163 HydrophobicContact CE1-CG 3.92Å; Y143-K163 HydrophobicContact CE2-CB 4.23Å; Y143-K163 PolarHBondContact O-N 3.04Å; Y143-Y415 HydrophobicContact CD1-CD2 4.09Å; Y143-Y415 HydrophobicContact CE1-CD2 4.08Å; Y143-Y415 HydrophobicContact CE1-CG 4.26Å; Y143-M440 VanDerWaalsContact CA-O 3.27Å; Y143-M440 WeakPolarHBondContact CA-O 3.49Å; Y143-M440 HydrophobicContact CD1-CE 4.41Å
144	A	77	Confident	74	Confident	3 Å²	3	49.6 Å²	49.6	3%	0.025	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	129.9	164.6	0	0	0	0	0	110.1	M147 V161 L162 R419 C438	A144-M147 HydrophobicContact CB-CG 4.3Å; A144-V161 CarbonylContact C-O 3.59Å; A144-V161 WeakPolarHBondContact CA-O 3.29Å; A144-L162 HydrophobicContact CB-CD2 3.64Å; A144-R419 HydrophobicContact CB-CB 4.39Å; A144-R419 WeakPolarHBondContact O-CG 3.49Å; A144-C438 HydrophobicContact CB-CB 3.71Å; A144-C438 VanDerWaalsContact CB-SG 3.55Å
145	S	71	Confident	73.4	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.007	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-25.8	174.8	59	0	0	0	0	113.1	L96 V161 R419	L96-S145 VanDerWaalsContact CD2-CB 3.48Å; S145-V161 PolarHBondContact N-O 2.78Å; S145-V161 WeakPolarHBondContact OG-CB 3.48Å; S145-V161 WeakPolarHBondContact OG-CG1 3.35Å; S145-V161 PolarHBondContact OG-O 3.13Å; S145-V161 VanDerWaalsContact OG-O 3.14Å; S145-R419 PolarHBondContact O-NE 3.23Å
146	H	71.6	Confident	72.7	Confident	45 Å²	45	51 Å²	51	21%	0.208	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	145.9	-177.7	-59.7	79.4	0	0	0	109.1	S160 V161 F209	H146-S160 CarbonylContact O-C 3.54Å; H146-S160 VanDerWaalsContact O-CA 3.25Å; H146-S160 WeakPolarHBondContact O-CA 3.42Å; H146-V161 HydrophobicContact CB-CB 4.2Å; H146-V161 HydrophobicContact CB-CG2 4.17Å; H146-V161 PolarHBondContact O-N 2.86Å; H146-F209 HydrophobicContact CB-CE1 4.49Å
147	M	75.4	Confident	72.2	Confident	11 Å²	11	52.1 Å²	52.1	5%	0.054	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	145.6	169.4	-62	179.9	73.7	0	0	109.5	A144 I158 F159 R207 R419 V421 L436 C438	A144-M147 HydrophobicContact CB-CG 4.3Å; M147-I158 HydrophobicContact CE-CG2 4Å; M147-F159 CarbonylContact C-O 3.52Å; M147-F159 VanDerWaalsContact CA-O 3.31Å; M147-F159 WeakPolarHBondContact CA-O 3.41Å; M147-R207 PolarHBondContact O-NH1 2.62Å; M147-R419 HydrophobicContact CG-CB 3.85Å; M147-R419 HydrophobicContact SD-CB 3.88Å; M147-R419 VanDerWaalsContact SD-O 3.41Å; M147-V421 HydrophobicContact CB-CG1 3.82Å; M147-V421 HydrophobicContact CE-CG2 4.25Å; M147-L436 HydrophobicContact CE-CB 4.46Å; M147-L436 HydrophobicContact CE-CD2 3.76Å; M147-L436 HydrophobicContact CE-CG 3.91Å; M147-C438 HydrophobicContact SD-CB 4.04Å; M147-C438 PolarHBondContact SD-SG 2.7Å
148	V	70	Confident	71.7	Confident	13 Å²	13	44.7 Å²	44.7	8%	0.079	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	139.4	173.7	59	0	0	0	0	109.6	I158 F159 R207	V148-I158 CarbonylContact O-C 3.55Å; V148-I158 VanDerWaalsContact O-CA 3.29Å; V148-I158 WeakPolarHBondContact O-CA 3.48Å; V148-F159 HydrophobicContact CG1-CB 3.74Å; V148-F159 HydrophobicContact CG1-CD2 4.37Å; V148-F159 HydrophobicContact CG1-CG 4.47Å; V148-F159 PolarHBondContact N-O 2.96Å; V148-F159 PolarHBondContact O-N 2.94Å; V148-R207 HydrophobicContact CG2-CG 4.27Å; V148-R207 VanDerWaalsContact CG2-NE 3.32Å
149	A	69.4	Low	71.3	Confident	24 Å²	24	44.8 Å²	44.8	20%	0.198	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	127.3	169.1	0	0	0	0	0	109	Y151 I158 V421	A149-Y151 HydrophobicContact CB-CE2 3.84Å; A149-I158 HydrophobicContact CB-CG1 4.3Å; A149-V421 HydrophobicContact CB-CB 4.04Å; A149-V421 HydrophobicContact CB-CG1 4.06Å; A149-V421 HydrophobicContact CB-CG2 4.49Å
150	C	65.4	Low	70.9	Confident	22 Å²	22	42.6 Å²	42.6	15%	0.149	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	143.3	164.6	-63.5	0	0	0	0	107.3	P156 V157 F159	C150-P156 CarbonylContact O-C 3.53Å; C150-P156 WeakPolarHBondContact O-CA 3.03Å; C150-V157 PolarHBondContact N-O 3.47Å; C150-V157 PolarHBondContact O-N 2.64Å; C150-F159 HydrophobicContact CB-CE2 4.16Å
151	Y	62.8	Low	70.5	Confident	76 Å²	76	37.3 Å²	37.3	30%	0.298	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	132	-178.9	-66.4	-94.3	0	0	0	109.7	A149 K155 P156 N377 H422 G423 W426	A149-Y151 HydrophobicContact CB-CE2 3.84Å; Y151-K155 WeakPolarHBondContact CA-O 3.25Å; Y151-P156 HydrophobicContact CD1-CB 4.02Å; Y151-P156 HydrophobicContact CE1-CB 3.73Å; Y151-P156 HydrophobicContact CE1-CG 4.41Å; Y151-N377 HydrophobicContact CD1-CB 4.37Å; Y151-N377 HydrophobicContact CD2-CB 4.1Å; Y151-N377 HydrophobicContact CE1-CB 4.04Å; Y151-N377 HydrophobicContact CE2-CB 3.76Å; Y151-N377 HydrophobicContact CG-CB 4.39Å; Y151-H422 PolarHBondContact OH-O 2.78Å; Y151-G423 WeakPolarHBondContact OH-CA 3.47Å; Y151-W426 AromaticContact CE1-CD1 3.84Å; Y151-W426 AromaticContact CE1-NE1 3.71Å; Y151-W426 AromaticContact CZ-NE1 3.74Å; Y151-W426 PolarHBondContact OH-NE1 3.26Å
152	K	58.7	Low	70	Confident	58 Å²	58	37.3 Å²	37.3	25%	0.252	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	125.4	172.3	-179.9	177.5	174.3	-172.5	0	107.9	R154 K155 H199 D227	K152-R154 PolarHBondContact O-N 3.18Å; K152-R154 VanDerWaalsContact O-N 3.15Å; K152-K155 PolarHBondContact N-O 2.88Å; K152-K155 WeakPolarHBondContact O-CA 3.29Å; K152-K155 WeakPolarHBondContact O-CB 3.5Å; K152-K155 PolarHBondContact O-N 3.29Å; K152-H199 WeakPolarHBondContact CE-O 3.28Å; K152-H199 PolarHBondContact NZ-O 3.49Å; K152-D227 VanDerWaalsContact NZ-CG 3.34Å; K152-D227 IonicContact NZ-OD1 2.7Å; K152-D227 PolarHBondContact NZ-OD1 3.49Å; K152-D227 IonicContact NZ-OD2 3.13Å
153	D	62.4	Low	69.4	Low	131 Å²	131	34.3 Å²	34.3	70%	0.701	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.1	40.5	-176.2	-51.8	-41.6	0	0	0	113.3	K155	D153-K155 PolarHBondContact O-N 3.3Å; D153-K155 VanDerWaalsContact O-N 3.16Å
154	R	64.1	Low	68.8	Low	135 Å²	135	36 Å²	36	51%	0.509	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	7.8	-175	-51.5	-179.2	-179.9	-167.6	-1.8	115.4	K152 N429	K152-R154 PolarHBondContact O-N 3.18Å; K152-R154 VanDerWaalsContact O-N 3.15Å; R154-N429 PolarHBondContact NH1-OD1 2.97Å
155	K	67.8	Low	68.8	Low	125 Å²	125	41.1 Å²	41.1	54%	0.543	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	128.6	174.2	-61.9	175.7	-176.9	173.2	0	110.4	Y151 K152 D153	Y151-K155 WeakPolarHBondContact CA-O 3.25Å; K152-K155 PolarHBondContact N-O 2.88Å; K152-K155 WeakPolarHBondContact O-CA 3.29Å; K152-K155 WeakPolarHBondContact O-CB 3.5Å; K152-K155 PolarHBondContact O-N 3.29Å; D153-K155 PolarHBondContact O-N 3.3Å; D153-K155 VanDerWaalsContact O-N 3.16Å
156	P	69	Low	69	Low	2 Å²	2	49.6 Å²	49.6	1%	0.013	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	133.9	177.4	31.2	-33.2	0	0	0	111.6	C150 Y151 I158 T177 W426	C150-P156 CarbonylContact O-C 3.53Å; C150-P156 WeakPolarHBondContact O-CA 3.03Å; Y151-P156 HydrophobicContact CD1-CB 4.02Å; Y151-P156 HydrophobicContact CE1-CB 3.73Å; Y151-P156 HydrophobicContact CE1-CG 4.41Å; P156-I158 HydrophobicContact CB-CG1 4.37Å; P156-T177 WeakPolarHBondContact CD-OG1 3.42Å; P156-T177 HydrophobicContact CG-CG2 4.2Å; P156-T177 VanDerWaalsContact CG-OG1 3.23Å; P156-T177 WeakPolarHBondContact CG-OG1 3.36Å; P156-W426 HydrophobicContact CB-CD2 4.41Å; P156-W426 HydrophobicContact CG-CB 4.28Å; P156-W426 HydrophobicContact CG-CD2 3.69Å; P156-W426 HydrophobicContact CG-CE3 4.13Å; P156-W426 HydrophobicContact CG-CG 3.73Å
157	V	69.1	Low	68.5	Low	28 Å²	28	49.8 Å²	49.8	17%	0.17	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121.2	161.6	-176.9	0	0	0	0	107	C150 F159 I174	C150-V157 PolarHBondContact N-O 3.47Å; C150-V157 PolarHBondContact O-N 2.64Å; V157-F159 HydrophobicContact CB-CE2 4.24Å; V157-F159 HydrophobicContact CG1-CD2 4.39Å; V157-F159 HydrophobicContact CG1-CE2 3.66Å; V157-F159 HydrophobicContact CG1-CZ 3.85Å; V157-I174 HydrophobicContact CG1-CG2 4.01Å
158	I	71.4	Confident	67.3	Low	0 Å²	0	54 Å²	54	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.4	-170.7	-55.4	162.2	0	0	0	108.9	M147 V148 A149 P156 I174 V175 T177 V421 W426 L436	M147-I158 HydrophobicContact CE-CG2 4Å; V148-I158 CarbonylContact O-C 3.55Å; V148-I158 VanDerWaalsContact O-CA 3.29Å; V148-I158 WeakPolarHBondContact O-CA 3.48Å; A149-I158 HydrophobicContact CB-CG1 4.3Å; P156-I158 HydrophobicContact CB-CG1 4.37Å; I158-I174 CarbonylContact O-C 3.49Å; I158-I174 WeakPolarHBondContact O-CA 3.27Å; I158-V175 HydrophobicContact CB-CB 4.24Å; I158-V175 PolarHBondContact N-O 2.96Å; I158-V175 PolarHBondContact O-N 2.88Å; I158-T177 HydrophobicContact CD1-CG2 4.35Å; I158-V421 HydrophobicContact CD1-CG2 3.84Å; I158-V421 HydrophobicContact CG1-CG2 4.02Å; I158-V421 HydrophobicContact CG2-CG1 4.24Å; I158-V421 HydrophobicContact CG2-CG2 3.76Å; I158-W426 HydrophobicContact CD1-CH2 3.46Å; I158-W426 VanDerWaalsContact CD1-CH2 3.46Å; I158-W426 HydrophobicContact CD1-CZ2 4.11Å; I158-W426 HydrophobicContact CD1-CZ3 3.86Å; I158-L436 HydrophobicContact CB-CD2 4.45Å; I158-L436 HydrophobicContact CD1-CB 4.15Å; I158-L436 HydrophobicContact CD1-CD2 3.51Å; I158-L436 HydrophobicContact CD1-CG 4.47Å; I158-L436 HydrophobicContact CG2-CD2 4.08Å
159	F	68.6	Low	66.3	Low	6 Å²	6	54.2 Å²	54.2	3%	0.026	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	135.8	175.3	-59.4	-99.5	0	0	0	109.3	M147 V148 C150 V157 G173 I174 F225	M147-F159 CarbonylContact C-O 3.52Å; M147-F159 VanDerWaalsContact CA-O 3.31Å; M147-F159 WeakPolarHBondContact CA-O 3.41Å; V148-F159 HydrophobicContact CG1-CB 3.74Å; V148-F159 HydrophobicContact CG1-CD2 4.37Å; V148-F159 HydrophobicContact CG1-CG 4.47Å; V148-F159 PolarHBondContact N-O 2.96Å; V148-F159 PolarHBondContact O-N 2.94Å; C150-F159 HydrophobicContact CB-CE2 4.16Å; V157-F159 HydrophobicContact CB-CE2 4.24Å; V157-F159 HydrophobicContact CG1-CD2 4.39Å; V157-F159 HydrophobicContact CG1-CE2 3.66Å; V157-F159 HydrophobicContact CG1-CZ 3.85Å; F159-G173 WeakPolarHBondContact CA-O 3.37Å; F159-I174 HydrophobicContact CD1-CD1 3.91Å; F159-I174 HydrophobicContact CD1-CG1 3.7Å; F159-I174 HydrophobicContact CE1-CD1 3.63Å; F159-I174 HydrophobicContact CE1-CG1 3.91Å; F159-F225 HydrophobicContact CD1-CD1 4.43Å; F159-F225 HydrophobicContact CD1-CE1 4.24Å; F159-F225 HydrophobicContact CD1-CZ 4.34Å; F159-F225 HydrophobicContact CE1-CB 4.26Å; F159-F225 AromaticContact CE1-CD1 3.72Å; F159-F225 HydrophobicContact CE1-CD1 3.72Å; F159-F225 HydrophobicContact CE1-CD2 4.11Å; F159-F225 AromaticContact CE1-CE1 3.98Å; F159-F225 HydrophobicContact CE1-CE1 3.98Å; F159-F225 HydrophobicContact CE1-CE2 4.39Å; F159-F225 AromaticContact CE1-CG 3.76Å; F159-F225 HydrophobicContact CE1-CG 3.76Å; F159-F225 HydrophobicContact CE1-CZ 4.32Å; F159-F225 HydrophobicContact CZ-CB 4.39Å; F159-F225 HydrophobicContact CZ-CG 4.3Å
160	S	70	Confident	65.8	Low	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	137.4	179.1	-55.4	0	0	0	0	110.6	H146 I172 G173	H146-S160 CarbonylContact O-C 3.54Å; H146-S160 VanDerWaalsContact O-CA 3.25Å; H146-S160 WeakPolarHBondContact O-CA 3.42Å; S160-I172 CarbonylContact O-C 3.52Å; S160-I172 WeakPolarHBondContact O-CA 3.46Å; S160-G173 PolarHBondContact N-O 2.74Å; S160-G173 PolarHBondContact O-N 3.46Å
161	V	70.1	Confident	65.5	Low	8 Å²	8	54.4 Å²	54.4	5%	0.048	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	114.6	168.5	-178.5	0	0	0	0	108.4	A144 S145 H146 N170 S171 F209	A144-V161 CarbonylContact C-O 3.59Å; A144-V161 WeakPolarHBondContact CA-O 3.29Å; S145-V161 PolarHBondContact N-O 2.78Å; S145-V161 WeakPolarHBondContact OG-CB 3.48Å; S145-V161 WeakPolarHBondContact OG-CG1 3.35Å; S145-V161 PolarHBondContact OG-O 3.13Å; S145-V161 VanDerWaalsContact OG-O 3.14Å; H146-V161 HydrophobicContact CB-CB 4.2Å; H146-V161 HydrophobicContact CB-CG2 4.17Å; H146-V161 PolarHBondContact O-N 2.86Å; V161-N170 HydrophobicContact CG1-CB 3.79Å; V161-S171 CarbonylContact C-O 3.58Å; V161-S171 WeakPolarHBondContact CA-O 3.5Å; V161-F209 HydrophobicContact CB-CE1 4.45Å; V161-F209 HydrophobicContact CG2-CD1 3.43Å; V161-F209 VanDerWaalsContact CG2-CD1 3.43Å; V161-F209 HydrophobicContact CG2-CE1 3.04Å; V161-F209 HydrophobicContact CG2-CE2 4.25Å; V161-F209 HydrophobicContact CG2-CG 4.2Å; V161-F209 HydrophobicContact CG2-CZ 3.5Å; V161-F209 VanDerWaalsContact CG2-CZ 3.5Å
162	L	69.6	Low	65.5	Low	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	139.5	-172.6	-53.3	179.6	0	0	0	111.2	V114 M138 F141 A144 N170 S171 M443	V114-L162 HydrophobicContact CB-CD1 4.48Å; V114-L162 HydrophobicContact CG1-CD1 4.34Å; V114-L162 HydrophobicContact CG2-CD1 3.3Å; M138-L162 HydrophobicContact SD-CD2 3.91Å; F141-L162 HydrophobicContact CB-CB 4.47Å; F141-L162 HydrophobicContact CD1-CB 3.36Å; F141-L162 HydrophobicContact CD1-CD1 4.14Å; F141-L162 HydrophobicContact CD1-CG 4.39Å; F141-L162 HydrophobicContact CD2-CD1 3.88Å; F141-L162 HydrophobicContact CE1-CB 3.58Å; F141-L162 HydrophobicContact CE1-CD1 4.12Å; F141-L162 HydrophobicContact CE2-CD1 3.91Å; F141-L162 HydrophobicContact CG-CB 3.9Å; F141-L162 HydrophobicContact CG-CD1 4.02Å; F141-L162 HydrophobicContact CZ-CB 4.31Å; F141-L162 HydrophobicContact CZ-CD1 4.02Å; A144-L162 HydrophobicContact CB-CD2 3.64Å; L162-N170 WeakPolarHBondContact O-CA 3.36Å; L162-S171 PolarHBondContact N-O 2.94Å; L162-S171 PolarHBondContact O-N 2.79Å; L162-M443 HydrophobicContact CD2-CE 4.19Å
163	K	71.2	Confident	65.8	Low	13 Å²	13	48.4 Å²	48.4	6%	0.057	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	121.3	174.5	-173.4	58.2	162.6	174.3	0	110	L96 E98 F141 K142 Y143 S167 E168	L96-K163 HydrophobicContact CD2-CB 3.52Å; L96-K163 HydrophobicContact CD2-CD 3.96Å; L96-K163 HydrophobicContact CD2-CG 3.87Å; E98-K163 IonicContact OE2-NZ 3.15Å; E98-K163 PolarHBondContact OE2-NZ 3.02Å; F141-K163 CarbonylContact C-O 3.56Å; F141-K163 WeakPolarHBondContact CA-O 3.48Å; K142-K163 PolarHBondContact N-O 2.75Å; Y143-K163 HydrophobicContact CD1-CB 4.35Å; Y143-K163 HydrophobicContact CE1-CB 3.94Å; Y143-K163 HydrophobicContact CE1-CG 3.92Å; Y143-K163 HydrophobicContact CE2-CB 4.23Å; Y143-K163 PolarHBondContact O-N 3.04Å; K163-S167 WeakPolarHBondContact CE-O 3.45Å; K163-S167 PolarHBondContact NZ-O 2.93Å; K163-E168 VanDerWaalsContact NZ-C 3.3Å; K163-E168 VanDerWaalsContact NZ-CA 3.35Å; K163-E168 PolarHBondContact NZ-O 3.22Å
164	K	70.6	Confident	65.9	Low	55 Å²	55	43 Å²	43	24%	0.239	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	147.8	174.5	-76.7	-171.8	-178.4	-165.8	0	111	D111 D140 F141 S171	D111-K164 WeakPolarHBondContact OD2-CE 3.23Å; D111-K164 IonicContact OD2-NZ 3.67Å; D111-K164 PolarHBondContact OD2-NZ 3.21Å; D140-K164 CarbonylContact O-C 3.57Å; D140-K164 WeakPolarHBondContact O-CA 3.49Å; F141-K164 HydrophobicContact CD1-CB 4.38Å; F141-K164 HydrophobicContact CD1-CG 3.51Å; F141-K164 HydrophobicContact CE1-CD 4.07Å; F141-K164 VanDerWaalsContact CE1-CE 3.48Å; F141-K164 HydrophobicContact CE1-CG 3.28Å; F141-K164 HydrophobicContact CZ-CG 4.12Å; K164-S171 WeakPolarHBondContact CE-OG 3.21Å
165	R	76	Confident	66.1	Low	110 Å²	110	36.7 Å²	36.7	42%	0.415	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	138.4	167.7	-66.8	175.6	-164.8	-94.4	-3.1	108.3	D140 K142 S167 D441	D140-R165 WeakPolarHBondContact O-CB 3.29Å; D140-R165 WeakPolarHBondContact O-CG 2.96Å; D140-R165 PolarHBondContact O-N 3.02Å; K142-R165 HydrophobicContact CB-CG 4.08Å; R165-S167 PolarHBondContact O-N 2.81Å; R165-D441 IonicContact CZ-OD2 3.05Å; R165-D441 IonicContact NH2-OD2 4Å; R165-D441 PolarHBondContact NH2-OD2 3.24Å
166	N	75.3	Confident	66.1	Low	180 Å²	180	32.9 Å²	32.9	96%	0.963	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	24.5	176.9	-49.7	-28.5	0	0	0	114.3
167	S	60.7	Low	66.2	Low	48 Å²	48	33.3 Å²	33.3	34%	0.336	17%	0.17	S	C	.	.			trans	-131.3	134.4	178.7	176	0	0	0	0	110	K163 R165 G169	K163-S167 WeakPolarHBondContact CE-O 3.45Å; K163-S167 PolarHBondContact NZ-O 2.93Å; R165-S167 PolarHBondContact O-N 2.81Å; S167-G169 PolarHBondContact O-N 3.35Å; S167-G169 PolarHBondContact OG-N 2.81Å
168	E	51	Low	66.3	Low	100 Å²	100	36 Å²	36	47%	0.467	18%	0.179	S	C	.	.	S	Bend	trans	-73.6	-21.3	175.3	-63.7	-177.5	158.6	0	0	111.3	E98 K163	E98-E168 HydrophobicContact CB-CB 4.39Å; E98-E168 HydrophobicContact CB-CG 4.44Å; K163-E168 VanDerWaalsContact NZ-C 3.3Å; K163-E168 VanDerWaalsContact NZ-CA 3.35Å; K163-E168 PolarHBondContact NZ-O 3.22Å
169	G	50.2	Low	66.2	Low	18 Å²	18	38 Å²	38	19%	0.186	19%	0.191	C	C	.	.			trans	-78.5	149.9	-174.8	0	0	0	0	0	115.2	S167	S167-G169 PolarHBondContact O-N 3.35Å; S167-G169 PolarHBondContact OG-N 2.81Å
170	N	57.6	Low	66.3	Low	46 Å²	46	41.2 Å²	41.2	25%	0.246	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	144.7	165.4	-71.8	-31.6	0	0	0	110.4	L96 V97 V161 L162	L96-N170 WeakPolarHBondContact CD2-OD1 3.32Å; L96-N170 VanDerWaalsContact O-CG 3.29Å; L96-N170 PolarHBondContact O-ND2 3.32Å; L96-N170 PolarHBondContact O-OD1 3.14Å; V97-N170 WeakPolarHBondContact CG2-ND2 3.31Å; V161-N170 HydrophobicContact CG1-CB 3.79Å; L162-N170 WeakPolarHBondContact O-CA 3.36Å
171	S	60	Low	66.2	Low	4 Å²	4	50.4 Å²	50.4	3%	0.028	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	150.3	169.7	-53.2	0	0	0	0	109.6	V161 L162 K164	V161-S171 CarbonylContact C-O 3.58Å; V161-S171 WeakPolarHBondContact CA-O 3.5Å; L162-S171 PolarHBondContact N-O 2.94Å; L162-S171 PolarHBondContact O-N 2.79Å; K164-S171 WeakPolarHBondContact CE-OG 3.21Å
172	I	61.9	Low	66	Low	8 Å²	8	50.9 Å²	50.9	4%	0.041	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	118.2	170.6	-60.7	-175.5	0	0	0	107.6	I108 S160 I174 F209 F225	I108-I172 HydrophobicContact CD1-CD1 4.16Å; I108-I172 HydrophobicContact CG2-CB 4.22Å; I108-I172 HydrophobicContact CG2-CD1 3.59Å; I108-I172 HydrophobicContact CG2-CG1 3.68Å; S160-I172 CarbonylContact O-C 3.52Å; S160-I172 WeakPolarHBondContact O-CA 3.46Å; I172-I174 HydrophobicContact CG2-CG1 4.32Å; I172-F209 HydrophobicContact CD1-CD2 4.34Å; I172-F209 HydrophobicContact CD1-CE2 4.06Å; I172-F225 HydrophobicContact CD1-CZ 3.99Å; I172-F225 HydrophobicContact CG2-CE1 4.4Å; I172-F225 HydrophobicContact CG2-CZ 4.4Å
173	G	64.3	Low	65.9	Low	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	142.1	168.7	0	0	0	0	0	110.2	F159 S160	F159-G173 WeakPolarHBondContact CA-O 3.37Å; S160-G173 PolarHBondContact N-O 2.74Å; S160-G173 PolarHBondContact O-N 3.46Å
174	I	66.2	Low	65.9	Low	17 Å²	17	61 Å²	61	9%	0.087	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	128.3	175.8	-59.4	177.6	0	0	0	107.9	M110 T115 V157 I158 F159 I172 F225 G229	M110-I174 HydrophobicContact CE-CD1 4Å; M110-I174 HydrophobicContact SD-CD1 4.47Å; T115-I174 WeakPolarHBondContact CG2-O 3.35Å; V157-I174 HydrophobicContact CG1-CG2 4.01Å; I158-I174 CarbonylContact O-C 3.49Å; I158-I174 WeakPolarHBondContact O-CA 3.27Å; F159-I174 HydrophobicContact CD1-CD1 3.91Å; F159-I174 HydrophobicContact CD1-CG1 3.7Å; F159-I174 HydrophobicContact CE1-CD1 3.63Å; F159-I174 HydrophobicContact CE1-CG1 3.91Å; I172-I174 HydrophobicContact CG2-CG1 4.32Å; I174-F225 HydrophobicContact CD1-CD1 4.18Å; I174-F225 HydrophobicContact CD1-CE1 4.24Å; I174-G229 WeakPolarHBondContact CD1-O 2.77Å
175	V	68.4	Low	65.7	Low	3 Å²	3	60 Å²	60	2%	0.018	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	124.3	177.1	176.6	0	0	0	0	107.4	V114 I158 I191 L436 M443	V114-V175 HydrophobicContact CG1-CG2 4.01Å; I158-V175 HydrophobicContact CB-CB 4.24Å; I158-V175 PolarHBondContact N-O 2.96Å; I158-V175 PolarHBondContact O-N 2.88Å; V175-I191 HydrophobicContact CG1-CD1 4.13Å; V175-I191 HydrophobicContact CG1-CG1 4.21Å; V175-I191 HydrophobicContact CG1-CG2 3.73Å; V175-L436 HydrophobicContact CB-CD2 4.41Å; V175-L436 HydrophobicContact CG1-CD2 4.1Å; V175-M443 HydrophobicContact CG2-CE 4.34Å; V175-M443 HydrophobicContact CG2-SD 4Å
176	R	67.5	Low	65.2	Low	44 Å²	44	60.8 Å²	60.8	17%	0.166	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	144.2	172.3	-66.7	177.4	-176.8	-131.7	-21.5	108.7	I191 S192 D227 R228 G229	R176-I191 CarbonylContact O-C 3.39Å; R176-I191 VanDerWaalsContact O-CA 3.3Å; R176-I191 WeakPolarHBondContact O-CA 3.13Å; R176-S192 WeakPolarHBondContact CB-OG 3.38Å; R176-S192 PolarHBondContact O-N 2.79Å; R176-D227 PolarHBondContact NH1-O 2.96Å; R176-D227 VanDerWaalsContact NH2-C 3.26Å; R176-D227 PolarHBondContact NH2-O 2.68Å; R176-R228 VanDerWaalsContact NH2-CA 3.34Å; R176-R228 PolarHBondContact NH2-O 3.37Å; R176-G229 VanDerWaalsContact NH2-N 3.13Å
177	T	70.8	Confident	64.7	Low	11 Å²	11	56.3 Å²	56.3	7%	0.067	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	146.9	168.5	72.9	0	0	0	0	110.2	P156 I158 L189 D190 W426	P156-T177 WeakPolarHBondContact CD-OG1 3.42Å; P156-T177 HydrophobicContact CG-CG2 4.2Å; P156-T177 VanDerWaalsContact CG-OG1 3.23Å; P156-T177 WeakPolarHBondContact CG-OG1 3.36Å; I158-T177 HydrophobicContact CD1-CG2 4.35Å; T177-L189 HydrophobicContact CG2-CD2 4.3Å; T177-D190 CarbonylContact C-O 3.53Å; T177-D190 VanDerWaalsContact CA-O 3.29Å; T177-D190 WeakPolarHBondContact CA-O 3.39Å; T177-W426 HydrophobicContact CG2-CE3 4.31Å; T177-W426 HydrophobicContact CG2-CZ3 4.36Å
178	K	71.2	Confident	65.2	Low	85 Å²	85	54.3 Å²	54.3	37%	0.37	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	136.9	170.6	-178.4	-179.1	174.8	-161.4	0	106.9	E180 L189 D190	K178-E180 HydrophobicContact CD-CG 3.99Å; K178-E180 WeakPolarHBondContact CD-OE1 3.4Å; K178-E180 WeakPolarHBondContact CE-OE1 3.5Å; K178-E180 HydrophobicContact CG-CG 3.99Å; K178-E180 IonicContact NZ-OE1 3.81Å; K178-E180 PolarHBondContact NZ-OE1 3.01Å; K178-L189 CarbonylContact O-C 3.54Å; K178-D190 PolarHBondContact N-O 2.88Å; K178-D190 PolarHBondContact O-N 2.86Å; K178-D190 VanDerWaalsContact O-O 3.1Å
179	V	70.1	Confident	66.1	Low	42 Å²	42	49.6 Å²	49.6	26%	0.255	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	120.7	172.4	-169	0	0	0	0	107.5	M187 E188 L189 W426 Y427	V179-M187 HydrophobicContact CB-CE 4.35Å; V179-M187 HydrophobicContact CG1-CB 4.02Å; V179-M187 HydrophobicContact CG1-CE 3.45Å; V179-M187 VanDerWaalsContact CG1-CE 3.45Å; V179-E188 CarbonylContact C-O 3.58Å; V179-E188 WeakPolarHBondContact CA-O 3.35Å; V179-L189 HydrophobicContact CG2-CD2 4.15Å; V179-W426 WeakPolarHBondContact CG2-O 3.19Å; V179-Y427 HydrophobicContact CG1-CD1 3.67Å; V179-Y427 HydrophobicContact CG1-CE1 4.05Å; V179-Y427 HydrophobicContact CG2-CD1 4.37Å
180	E	69.2	Low	67	Low	74 Å²	74	51.3 Å²	51.3	35%	0.346	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	152.7	177.8	-61.8	-157.7	153.6	0	0	110.7	K178 M187 E188 D190	K178-E180 HydrophobicContact CD-CG 3.99Å; K178-E180 WeakPolarHBondContact CD-OE1 3.4Å; K178-E180 WeakPolarHBondContact CE-OE1 3.5Å; K178-E180 HydrophobicContact CG-CG 3.99Å; K178-E180 IonicContact NZ-OE1 3.81Å; K178-E180 PolarHBondContact NZ-OE1 3.01Å; E180-M187 CarbonylContact O-C 3.57Å; E180-M187 WeakPolarHBondContact O-CA 3.25Å; E180-E188 PolarHBondContact N-O 2.89Å; E180-E188 PolarHBondContact O-N 3.38Å; E180-D190 HydrophobicContact CG-CB 4.06Å
181	R	68.4	Low	67.4	Low	193 Å²	193	49.7 Å²	49.7	73%	0.728	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	113.9	173.8	-163.2	174.1	-171.1	-176.5	-0.8	108.6	G185 M187	R181-G185 PolarHBondContact NE-O 2.91Å; R181-G185 VanDerWaalsContact NE-O 3.16Å; R181-M187 HydrophobicContact CB-SD 3.84Å; R181-M187 HydrophobicContact CG-SD 4.02Å
182	A	67	Low	67.1	Low	17 Å²	17	50.8 Å²	50.8	14%	0.14	27%	0.266	C	S	.	.			trans	-69.3	164.8	177.1	0	0	0	0	0	111.9	N184 G185 H186 E188	A182-N184 VanDerWaalsContact CB-OD1 3.31Å; A182-N184 WeakPolarHBondContact CB-OD1 3.46Å; A182-N184 PolarHBondContact O-N 2.96Å; A182-N184 VanDerWaalsContact O-N 3.15Å; A182-G185 WeakPolarHBondContact O-CA 3.45Å; A182-G185 PolarHBondContact O-N 2.91Å; A182-H186 WeakPolarHBondContact CB-O 3.36Å; A182-H186 PolarHBondContact N-O 3.35Å; A182-E188 HydrophobicContact CB-CG 3.83Å; A182-E188 WeakPolarHBondContact CB-OE1 3.31Å
183	S	67.3	Low	66.4	Low	134 Å²	134	57.3 Å²	57.3	94%	0.937	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-24.7	-179	54	0	0	0	0	114	G185	S183-G185 PolarHBondContact O-N 2.61Å
184	N	70.3	Confident	65.1	Low	93 Å²	93	60.7 Å²	60.7	50%	0.497	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	2.5	173.4	65.4	0.4	0	0	0	113.5	A182 H186	A182-N184 VanDerWaalsContact CB-OD1 3.31Å; A182-N184 WeakPolarHBondContact CB-OD1 3.46Å; A182-N184 PolarHBondContact O-N 2.96Å; A182-N184 VanDerWaalsContact O-N 3.15Å; N184-H186 VanDerWaalsContact C-N 3.31Å; N184-H186 PolarHBondContact O-N 2.84Å; N184-H186 WeakPolarHBondContact OD1-CB 3.33Å; N184-H186 PolarHBondContact OD1-N 2.9Å
185	G	66.4	Low	63.2	Low	34 Å²	34	67.5 Å²	67.5	35%	0.351	34%	0.344	S	S	.	.	S	Bend	trans	84.8	-9.7	180	0	0	0	0	0	115.4	R181 A182 S183	R181-G185 PolarHBondContact NE-O 2.91Å; R181-G185 VanDerWaalsContact NE-O 3.16Å; A182-G185 WeakPolarHBondContact O-CA 3.45Å; A182-G185 PolarHBondContact O-N 2.91Å; S183-G185 PolarHBondContact O-N 2.61Å
186	H	65.9	Low	61.1	Low	126 Å²	126	72 Å²	72	58%	0.583	37%	0.372	S	S	*	.			trans	-76	145.9	176.6	-72.8	-84.2	0	0	0	111.5	A182 N184	A182-H186 WeakPolarHBondContact CB-O 3.36Å; A182-H186 PolarHBondContact N-O 3.35Å; N184-H186 VanDerWaalsContact C-N 3.31Å; N184-H186 PolarHBondContact O-N 2.84Å; N184-H186 WeakPolarHBondContact OD1-CB 3.33Å; N184-H186 PolarHBondContact OD1-N 2.9Å
187	M	64.9	Low	58.9	Low	85 Å²	85	76.5 Å²	76.5	42%	0.419	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	131.4	170.7	-62.1	-62.2	-79.5	0	0	108.9	V179 E180 R181 Y427	V179-M187 HydrophobicContact CB-CE 4.35Å; V179-M187 HydrophobicContact CG1-CB 4.02Å; V179-M187 HydrophobicContact CG1-CE 3.45Å; V179-M187 VanDerWaalsContact CG1-CE 3.45Å; E180-M187 CarbonylContact O-C 3.57Å; E180-M187 WeakPolarHBondContact O-CA 3.25Å; R181-M187 HydrophobicContact CB-SD 3.84Å; R181-M187 HydrophobicContact CG-SD 4.02Å; M187-Y427 HydrophobicContact CB-CD1 4.23Å; M187-Y427 HydrophobicContact CB-CE1 4.33Å; M187-Y427 WeakPolarHBondContact O-CE1 3.4Å
188	E	70.8	Confident	56.5	Low	7 Å²	7	86.2 Å²	86.2	3%	0.033	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	148.4	176.6	-66.3	-171.3	-163.6	0	0	110.6	R121 L132 K134 V179 E180 A182 D190 Y427	R121-E188 VanDerWaalsContact CZ-CD 3.48Å; R121-E188 IonicContact CZ-OE1 3.08Å; R121-E188 IonicContact CZ-OE2 3.45Å; R121-E188 IonicContact NE-OE2 2.72Å; R121-E188 IonicContact NH1-OE1 2.68Å; R121-E188 PolarHBondContact NH1-OE1 3.17Å; R121-E188 IonicContact NH1-OE2 3.79Å; R121-E188 IonicContact NH2-OE1 3.36Å; R121-E188 PolarHBondContact NH2-OE1 3.05Å; R121-E188 IonicContact NH2-OE2 2.8Å; R121-E188 PolarHBondContact NH2-OE2 3.36Å; L132-E188 HydrophobicContact CD1-CG 3.95Å; K134-E188 IonicContact NZ-OE2 2.7Å; K134-E188 PolarHBondContact NZ-OE2 2.86Å; V179-E188 CarbonylContact C-O 3.58Å; V179-E188 WeakPolarHBondContact CA-O 3.35Å; E180-E188 PolarHBondContact N-O 2.89Å; E180-E188 PolarHBondContact O-N 3.38Å; A182-E188 HydrophobicContact CB-CG 3.83Å; A182-E188 WeakPolarHBondContact CB-OE1 3.31Å; E188-D190 PolarHBondContact O-N 3.49Å; E188-Y427 WeakPolarHBondContact CA-OH 3.1Å
189	L	70.8	Confident	54.2	Low	0 Å²	0	87.7 Å²	87.7	0%	0	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	107.9	166.8	-81.1	158.5	0	0	0	107.9	K134 T177 K178 V179 W426 Y427 A434 L445 E447	K134-L189 PolarHBondContact NZ-O 2.82Å; T177-L189 HydrophobicContact CG2-CD2 4.3Å; K178-L189 CarbonylContact O-C 3.54Å; V179-L189 HydrophobicContact CG2-CD2 4.15Å; L189-W426 HydrophobicContact CD1-CB 3.73Å; L189-W426 HydrophobicContact CD1-CE3 3.93Å; L189-W426 HydrophobicContact CD2-CB 4Å; L189-W426 HydrophobicContact CG-CB 4.44Å; L189-Y427 HydrophobicContact CB-CE1 4.49Å; L189-Y427 HydrophobicContact CD1-CD2 3.92Å; L189-Y427 HydrophobicContact CD1-CE1 4.41Å; L189-Y427 HydrophobicContact CD1-CE2 3.31Å; L189-Y427 HydrophobicContact CG-CD1 4.43Å; L189-Y427 HydrophobicContact CG-CD2 4.25Å; L189-Y427 HydrophobicContact CG-CE1 3.86Å; L189-Y427 HydrophobicContact CG-CE2 3.71Å; L189-Y427 VanDerWaalsContact CG-CZ 3.47Å; L189-Y427 WeakPolarHBondContact CG-OH 3.37Å; L189-Y427 PolarHBondContact N-OH 3.41Å; L189-A434 HydrophobicContact CD1-CB 3.83Å; L189-L445 HydrophobicContact CB-CD2 3.82Å; L189-E447 HydrophobicContact CD1-CG 4.47Å
190	D	68.6	Low	51.9	Low	55 Å²	55	90.1 Å²	90.1	29%	0.294	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	153.6	162.6	-160.7	26.3	0	0	0	110.7	T177 K178 E180 E188	T177-D190 CarbonylContact C-O 3.53Å; T177-D190 VanDerWaalsContact CA-O 3.29Å; T177-D190 WeakPolarHBondContact CA-O 3.39Å; K178-D190 PolarHBondContact N-O 2.88Å; K178-D190 PolarHBondContact O-N 2.86Å; K178-D190 VanDerWaalsContact O-O 3.1Å; E180-D190 HydrophobicContact CG-CB 4.06Å; E188-D190 PolarHBondContact O-N 3.49Å
191	I	65.5	Low	49.8	Very low	12 Å²	12	88.8 Å²	88.8	6%	0.062	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	103.7	175.3	-72.3	171.9	0	0	0	106.7	W119 V175 R176 L445	W119-I191 HydrophobicContact CD2-CD1 3.72Å; W119-I191 HydrophobicContact CE3-CD1 3.97Å; W119-I191 HydrophobicContact CH2-CD1 3.33Å; W119-I191 HydrophobicContact CZ2-CD1 3.08Å; W119-I191 HydrophobicContact CZ2-CG1 4.35Å; W119-I191 HydrophobicContact CZ2-CG2 4.41Å; W119-I191 HydrophobicContact CZ3-CD1 3.78Å; V175-I191 HydrophobicContact CG1-CD1 4.13Å; V175-I191 HydrophobicContact CG1-CG1 4.21Å; V175-I191 HydrophobicContact CG1-CG2 3.73Å; R176-I191 CarbonylContact O-C 3.39Å; R176-I191 VanDerWaalsContact O-CA 3.3Å; R176-I191 WeakPolarHBondContact O-CA 3.13Å; I191-L445 HydrophobicContact CD1-CD2 4.42Å
192	S	54.4	Low	47.6	Very low	27 Å²	27	83.7 Å²	83.7	19%	0.189	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	140.3	-170.4	53.4	0	0	0	0	112.4	R176	R176-S192 WeakPolarHBondContact CB-OG 3.38Å; R176-S192 PolarHBondContact O-N 2.79Å
193	Y	46.4	Very low	45.5	Very low	145 Å²	145	91 Å²	91	57%	0.569	48%	0.483	S	S	*	.			trans	-64.7	149.2	158.6	-62.8	-88.9	0	0	0	109.1	T115 E195	T115-Y193 WeakPolarHBondContact O-CD1 3.38Å; T115-Y193 WeakPolarHBondContact O-CE1 3.26Å; Y193-E195 PolarHBondContact O-N 2.82Å
194	P	36.9	Very low	43.4	Very low	70 Å²	70	85.3 Å²	85.3	46%	0.455	45%	0.446	S	S	.	.			trans	-70.1	100.8	-176.7	26.8	-30.8	0	0	0	110.8
195	E	27.7	Very low	41.3	Very low	160 Å²	160	82 Å²	82	75%	0.748	43%	0.429	S	S	*	.			trans	-88.4	138	161.3	-71.1	-177.1	172.8	0	0	110	Y193	Y193-E195 PolarHBondContact O-N 2.82Å
196	T	23.1	Very low	39.5	Very low	99 Å²	99	80.5 Å²	80.5	61%	0.607	41%	0.414	S	S	*	.			trans	-70.6	119.7	-170.7	44.9	0	0	0	0	113.6
197	M	21.6	Very low	37.9	Very low	137 Å²	137	79.7 Å²	79.7	68%	0.675	41%	0.405	S	S	*	.			trans	-145.4	147.9	157.4	-87.4	-158.3	-74.8	0	0	111.3	D227	M197-D227 WeakPolarHBondContact O-CB 3.45Å
198	W	21	Very low	36.3	Very low	215 Å²	215	76.1 Å²	76.1	81%	0.814	39%	0.389	S	S	*	.			trans	-98.7	115.6	-178.2	-63.9	82.9	0	0	0	110.8
199	H	22.9	Very low	34.7	Very low	116 Å²	116	77 Å²	77	54%	0.537	39%	0.393	S	S	.	.			trans	-159.1	108.7	156.7	-54.9	-76.9	0	0	0	112.5	K152 I201 D227	K152-H199 WeakPolarHBondContact CE-O 3.28Å; K152-H199 PolarHBondContact NZ-O 3.49Å; H199-I201 PolarHBondContact O-N 2.99Å; H199-D227 VanDerWaalsContact C-CG 3.46Å; H199-D227 VanDerWaalsContact CA-OD2 3.3Å; H199-D227 WeakPolarHBondContact CA-OD2 3.02Å; H199-D227 PolarHBondContact N-OD2 2.82Å
200	S	21.5	Very low	32.8	Very low	93 Å²	93	78.1 Å²	78.1	65%	0.65	40%	0.4	S	S	*	.			trans	-23.6	114	173.1	-169.2	0	0	0	0	115.8	C202 D227	S200-C202 PolarHBondContact O-N 3.18Å; S200-C202 PolarHBondContact OG-SG 2.7Å; S200-D227 PolarHBondContact N-OD2 3.22Å
201	I	23.8	Very low	30.9	Very low	47 Å²	47	76.4 Å²	76.4	24%	0.241	39%	0.391	C	S	.	.			trans	-71.4	75.9	168.1	-52.1	-178.7	0	0	0	107.8	H199 D203 D226 D227	H199-I201 PolarHBondContact O-N 2.99Å; I201-D203 VanDerWaalsContact C-N 3.31Å; I201-D203 PolarHBondContact O-N 3.17Å; I201-D226 WeakPolarHBondContact CD1-O 3.08Å; I201-D227 WeakPolarHBondContact CG1-OD1 3.24Å
202	C	22.2	Very low	29.2	Very low	85 Å²	85	79.3 Å²	79.3	57%	0.574	40%	0.401	S	S	*	.	S	Bend	trans	-72.5	-17.1	-179.7	-81.4	0	0	0	0	114	S200	S200-C202 PolarHBondContact O-N 3.18Å; S200-C202 PolarHBondContact OG-SG 2.7Å
203	D	24.1	Very low	27.9	Very low	170 Å²	170	78.8 Å²	78.8	91%	0.909	40%	0.397	S	S	*	.	S	Bend	trans	-128.6	18.3	-174.4	-68.7	-35.6	0	0	0	114.8	I201	I201-D203 VanDerWaalsContact C-N 3.31Å; I201-D203 PolarHBondContact O-N 3.17Å
204	G	22.6	Very low	27.2	Very low	16 Å²	16	77.6 Å²	77.6	17%	0.165	40%	0.399	C	S	.	.			trans	-138.5	42.3	-173.4	0	0	0	0	0	113.6	A206	G204-A206 PolarHBondContact O-N 3.04Å
205	V	26	Very low	27.1	Very low	24 Å²	24	79.3 Å²	79.3	15%	0.145	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-59.9	132.1	172.1	176.4	0	0	0	0	108.7	F248 P252	V205-F248 HydrophobicContact CB-CE1 4.25Å; V205-F248 HydrophobicContact CB-CZ 4.2Å; V205-F248 HydrophobicContact CG1-CE1 3.99Å; V205-F248 HydrophobicContact CG1-CZ 4.13Å; V205-F248 WeakPolarHBondContact O-CE2 3.28Å; V205-F248 WeakPolarHBondContact O-CZ 2.95Å; V205-P252 HydrophobicContact CB-CB 4.13Å; V205-P252 HydrophobicContact CG2-CB 3.6Å; V205-P252 HydrophobicContact CG2-CG 4.48Å
206	A	29.6	Very low	27.8	Very low	2 Å²	2	73.9 Å²	73.9	2%	0.017	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	140.6	-174.6	0	0	0	0	0	111.7	G204 A208 F225	G204-A206 PolarHBondContact O-N 3.04Å; A206-A208 PolarHBondContact O-N 3.3Å; A206-F225 HydrophobicContact CB-CD2 3.29Å; A206-F225 HydrophobicContact CB-CE2 3.07Å; A206-F225 HydrophobicContact CB-CZ 4.22Å
207	R	31.9	Very low	29.3	Very low	109 Å²	109	70.2 Å²	70.2	41%	0.411	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-48.1	132.2	177.1	-70.6	-178.7	175.7	166.7	-1.2	110	M147 V148 F209	M147-R207 PolarHBondContact O-NH1 2.62Å; V148-R207 HydrophobicContact CG2-CG 4.27Å; V148-R207 VanDerWaalsContact CG2-NE 3.32Å; R207-F209 WeakPolarHBondContact O-CD2 3.08Å; R207-F209 WeakPolarHBondContact O-CE2 3.44Å; R207-F209 PolarHBondContact O-N 2.83Å
208	A	31.7	Very low	31.3	Very low	9 Å²	9	64 Å²	64	7%	0.074	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	121	177.5	0	0	0	0	0	109.6	F93 A206 V220 V221 V246	F93-A208 WeakPolarHBondContact CE1-O 3.38Å; F93-A208 VanDerWaalsContact CE2-O 3.31Å; F93-A208 WeakPolarHBondContact CE2-O 3.31Å; F93-A208 WeakPolarHBondContact CZ-O 3.47Å; A206-A208 PolarHBondContact O-N 3.3Å; A208-V220 HydrophobicContact CB-CG1 3.67Å; A208-V221 CarbonylContact C-O 3.55Å; A208-V221 WeakPolarHBondContact CA-O 3.09Å; A208-V221 VanDerWaalsContact CB-O 3.28Å; A208-V221 WeakPolarHBondContact CB-O 3.19Å; A208-V246 HydrophobicContact CB-CG1 3.76Å
209	F	36.7	Very low	33.4	Very low	27 Å²	27	55.5 Å²	55.5	12%	0.118	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	143.7	176.5	-61.4	-75.4	0	0	0	109.9	F93 H146 V161 I172 R207 V221	F93-F209 HydrophobicContact CE1-CB 4.34Å; F93-F209 HydrophobicContact CE1-CD1 4.16Å; H146-F209 HydrophobicContact CB-CE1 4.49Å; V161-F209 HydrophobicContact CB-CE1 4.45Å; V161-F209 HydrophobicContact CG2-CD1 3.43Å; V161-F209 VanDerWaalsContact CG2-CD1 3.43Å; V161-F209 HydrophobicContact CG2-CE1 3.04Å; V161-F209 HydrophobicContact CG2-CE2 4.25Å; V161-F209 HydrophobicContact CG2-CG 4.2Å; V161-F209 HydrophobicContact CG2-CZ 3.5Å; V161-F209 VanDerWaalsContact CG2-CZ 3.5Å; I172-F209 HydrophobicContact CD1-CD2 4.34Å; I172-F209 HydrophobicContact CD1-CE2 4.06Å; R207-F209 WeakPolarHBondContact O-CD2 3.08Å; R207-F209 WeakPolarHBondContact O-CE2 3.44Å; R207-F209 PolarHBondContact O-N 2.83Å; F209-V221 PolarHBondContact N-O 2.7Å; F209-V221 VanDerWaalsContact N-O 3.09Å; F209-V221 WeakPolarHBondContact O-CB 3.34Å; F209-V221 WeakPolarHBondContact O-CG2 3.2Å; F209-V221 PolarHBondContact O-N 2.91Å
210	T	30.8	Very low	35.7	Very low	23 Å²	23	50 Å²	50	14%	0.141	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	144.8	168.4	69.2	0	0	0	0	113.4	F93 K219 V220 V243 V246	F93-T210 HydrophobicContact CB-CG2 3.92Å; F93-T210 VanDerWaalsContact CB-OG1 3.23Å; F93-T210 WeakPolarHBondContact CB-OG1 3.47Å; F93-T210 HydrophobicContact CD1-CG2 3.83Å; F93-T210 VanDerWaalsContact CD1-N 3.3Å; F93-T210 WeakPolarHBondContact CD1-OG1 3.47Å; F93-T210 HydrophobicContact CD2-CG2 4.25Å; F93-T210 VanDerWaalsContact CE1-N 3.31Å; F93-T210 HydrophobicContact CG-CG2 3.67Å; F93-T210 WeakPolarHBondContact CG-OG1 3.39Å; T210-K219 CarbonylContact C-O 3.52Å; T210-K219 WeakPolarHBondContact CA-O 3.37Å; T210-K219 WeakPolarHBondContact CB-O 3.37Å; T210-K219 WeakPolarHBondContact CG2-O 3.23Å; T210-V220 HydrophobicContact CG2-CB 4.4Å; T210-V220 HydrophobicContact CG2-CG2 3.83Å; T210-V243 HydrophobicContact CG2-CB 3.89Å; T210-V243 HydrophobicContact CG2-CG1 3.53Å; T210-V243 HydrophobicContact CG2-CG2 4.29Å; T210-V246 HydrophobicContact CG2-CG2 3.77Å
211	V	28.5	Very low	37.9	Very low	19 Å²	19	45.7 Å²	45.7	12%	0.115	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	117.4	178.2	178	0	0	0	0	107	V97 L100 V105 K219 V221	V97-V211 HydrophobicContact CB-CG1 4.41Å; V97-V211 HydrophobicContact CG1-CG1 3.77Å; V97-V211 HydrophobicContact CG2-CB 4.41Å; V97-V211 HydrophobicContact CG2-CG1 4.22Å; V97-V211 HydrophobicContact CG2-CG2 4.37Å; L100-V211 HydrophobicContact CD1-CG1 3.51Å; L100-V211 HydrophobicContact CG-CG1 4.35Å; V105-V211 HydrophobicContact CG1-CG1 4.48Å; V105-V211 HydrophobicContact CG1-CG2 4.29Å; V105-V211 HydrophobicContact CG2-CG1 4.38Å; V211-K219 HydrophobicContact CB-CB 4.44Å; V211-K219 PolarHBondContact N-O 3.42Å; V211-K219 PolarHBondContact O-N 2.75Å; V211-V221 HydrophobicContact CG2-CG2 4.24Å
212	R	29	Very low	40.2	Very low	72 Å²	72	44.6 Å²	44.6	27%	0.272	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	136.2	175.4	-171.4	175.9	177.3	159.8	3.1	110.1
213	N	28.1	Very low	42.4	Very low	17 Å²	17	40.6 Å²	40.6	9%	0.091	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	131.5	157.8	-173.3	-7.8	0	0	0	108.1	T215 D216 G217	N213-T215 VanDerWaalsContact CG-OG1 3.22Å; N213-T215 PolarHBondContact ND2-OG1 3.32Å; N213-T215 PolarHBondContact O-N 3.32Å; N213-T215 PolarHBondContact OD1-N 2.84Å; N213-T215 PolarHBondContact OD1-OG1 3.45Å; N213-D216 HydrophobicContact CB-CB 4.12Å; N213-D216 PolarHBondContact ND2-OD2 2.8Å; N213-D216 PolarHBondContact O-N 2.81Å; N213-G217 PolarHBondContact N-O 3.2Å; N213-G217 PolarHBondContact O-N 3.19Å; N213-G217 VanDerWaalsContact O-N 3.16Å; N213-G217 VanDerWaalsContact O-O 3.11Å
214	I	32.4	Very low	44.4	Very low	119 Å²	119	33.9 Å²	33.9	61%	0.61	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-30	176.8	-62.4	177.9	0	0	0	110.7	L99	L99-I214 HydrophobicContact CD2-CB 4.06Å; L99-I214 HydrophobicContact CD2-CD1 3.97Å; L99-I214 HydrophobicContact CD2-CG1 4.06Å; L99-I214 HydrophobicContact CG-CD1 4.26Å
215	T	34.6	Very low	46.2	Very low	107 Å²	107	33.8 Å²	33.8	66%	0.656	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-28.2	179.9	61.1	0	0	0	0	114.2	N213	N213-T215 VanDerWaalsContact CG-OG1 3.22Å; N213-T215 PolarHBondContact ND2-OG1 3.32Å; N213-T215 PolarHBondContact O-N 3.32Å; N213-T215 PolarHBondContact OD1-N 2.84Å; N213-T215 PolarHBondContact OD1-OG1 3.45Å
216	D	42.7	Very low	47.6	Very low	46 Å²	46	34.7 Å²	34.7	25%	0.246	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.1	0.3	-163.5	-62.6	-45.1	0	0	0	116.2	Y102 N213 R238	Y102-D216 HydrophobicContact CD2-CB 4.24Å; Y102-D216 WeakPolarHBondContact CD2-OD2 3.45Å; Y102-D216 HydrophobicContact CE2-CB 4.39Å; N213-D216 HydrophobicContact CB-CB 4.12Å; N213-D216 PolarHBondContact ND2-OD2 2.8Å; N213-D216 PolarHBondContact O-N 2.81Å; D216-R238 PolarHBondContact O-NE 2.86Å; D216-R238 PolarHBondContact O-NH2 3.35Å; D216-R238 IonicContact OD1-NH2 3.47Å
217	G	52.7	Low	48.7	Very low	22 Å²	22	35.6 Å²	35.6	23%	0.227	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	99.8	-168.2	179.8	0	0	0	0	0	114.5	N213	N213-G217 PolarHBondContact N-O 3.2Å; N213-G217 PolarHBondContact O-N 3.19Å; N213-G217 VanDerWaalsContact O-N 3.16Å; N213-G217 VanDerWaalsContact O-O 3.11Å
218	S	64.5	Low	49.5	Very low	6 Å²	6	36 Å²	36	4%	0.042	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	155.4	176.2	-57.7	0	0	0	0	110.5	M239 N241 V243	S218-M239 PolarHBondContact N-O 2.86Å; S218-M239 WeakPolarHBondContact O-CA 3.45Å; S218-M239 WeakPolarHBondContact O-CB 3.43Å; S218-M239 PolarHBondContact O-N 3.26Å; S218-N241 PolarHBondContact OG-O 2.81Å; S218-V243 PolarHBondContact OG-N 2.97Å
219	K	65.1	Low	50.5	Low	36 Å²	36	35.7 Å²	35.7	16%	0.157	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143.7	168	-65.7	-178.4	-179.8	179.8	0	109	T210 V211 M237	T210-K219 CarbonylContact C-O 3.52Å; T210-K219 WeakPolarHBondContact CA-O 3.37Å; T210-K219 WeakPolarHBondContact CB-O 3.37Å; T210-K219 WeakPolarHBondContact CG2-O 3.23Å; V211-K219 HydrophobicContact CB-CB 4.44Å; V211-K219 PolarHBondContact N-O 3.42Å; V211-K219 PolarHBondContact O-N 2.75Å; K219-M237 CarbonylContact C-O 3.53Å; K219-M237 VanDerWaalsContact CA-O 3.24Å; K219-M237 WeakPolarHBondContact CA-O 3.28Å
220	V	71.5	Confident	51.5	Low	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	132.7	165.4	-173.3	0	0	0	0	107.1	A208 T210 F236 M237 M239 V243 V246 V257 Y268	A208-V220 HydrophobicContact CB-CG1 3.67Å; T210-V220 HydrophobicContact CG2-CB 4.4Å; T210-V220 HydrophobicContact CG2-CG2 3.83Å; V220-F236 WeakPolarHBondContact O-CA 3.38Å; V220-M237 HydrophobicContact CB-CB 4.37Å; V220-M237 HydrophobicContact CB-CE 3.65Å; V220-M237 HydrophobicContact CG1-CE 4.4Å; V220-M237 HydrophobicContact CG2-CE 3.41Å; V220-M237 VanDerWaalsContact CG2-CE 3.41Å; V220-M237 PolarHBondContact N-O 3.21Å; V220-M237 PolarHBondContact O-N 3.02Å; V220-M239 HydrophobicContact CG2-CG 4.12Å; V220-V243 HydrophobicContact CG2-CG1 4.4Å; V220-V243 HydrophobicContact CG2-CG2 3.82Å; V220-V246 HydrophobicContact CG1-CG1 4.07Å; V220-V246 HydrophobicContact CG1-CG2 3.93Å; V220-V246 HydrophobicContact CG2-CG2 4.22Å; V220-V257 HydrophobicContact CG1-CG2 4.44Å; V220-V257 HydrophobicContact CG2-CG1 4Å; V220-V257 HydrophobicContact CG2-CG2 4.14Å; V220-Y268 WeakPolarHBondContact CG1-OH 3.37Å; V220-Y268 PolarHBondContact O-OH 2.72Å
221	V	68.2	Low	52.9	Low	3 Å²	3	38 Å²	38	2%	0.018	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	121.6	-175.5	-169.5	0	0	0	0	109.1	A208 F209 V211 M234 Q235 F236	A208-V221 CarbonylContact C-O 3.55Å; A208-V221 WeakPolarHBondContact CA-O 3.09Å; A208-V221 VanDerWaalsContact CB-O 3.28Å; A208-V221 WeakPolarHBondContact CB-O 3.19Å; F209-V221 PolarHBondContact N-O 2.7Å; F209-V221 VanDerWaalsContact N-O 3.09Å; F209-V221 WeakPolarHBondContact O-CB 3.34Å; F209-V221 WeakPolarHBondContact O-CG2 3.2Å; F209-V221 PolarHBondContact O-N 2.91Å; V211-V221 HydrophobicContact CG2-CG2 4.24Å; V221-M234 HydrophobicContact CG1-CG 3.64Å; V221-M234 HydrophobicContact CG1-SD 4.09Å; V221-Q235 CarbonylContact C-O 3.57Å; V221-Q235 WeakPolarHBondContact CA-O 3.37Å; V221-F236 HydrophobicContact CB-CD1 4.24Å; V221-F236 HydrophobicContact CB-CE1 4.31Å; V221-F236 HydrophobicContact CG1-CD1 3.89Å; V221-F236 HydrophobicContact CG1-CE1 3.66Å; V221-F236 HydrophobicContact CG1-CZ 4.26Å; V221-F236 HydrophobicContact CG2-CD1 3.57Å; V221-F236 HydrophobicContact CG2-CE1 3.68Å
222	R	72.3	Confident	54.8	Low	25 Å²	25	41.4 Å²	41.4	9%	0.094	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	127.5	166.8	176.1	177.9	174.6	-81.1	-8	108.5	V224 D233 M234 Q235 P252 Y268	R222-V224 VanDerWaalsContact CZ-CG2 3.44Å; R222-V224 VanDerWaalsContact NH1-CG2 3.29Å; R222-V224 VanDerWaalsContact NH2-CG2 3.27Å; R222-D233 IonicContact NH1-OD2 2.91Å; R222-D233 PolarHBondContact NH1-OD2 2.85Å; R222-M234 WeakPolarHBondContact O-CA 3.22Å; R222-Q235 HydrophobicContact CB-CB 4.41Å; R222-Q235 PolarHBondContact N-O 2.85Å; R222-Q235 PolarHBondContact O-N 2.91Å; R222-P252 PolarHBondContact NE-O 3.14Å; R222-Y268 HydrophobicContact CB-CD1 4.16Å; R222-Y268 HydrophobicContact CB-CD2 3.97Å; R222-Y268 HydrophobicContact CB-CE1 3.94Å; R222-Y268 HydrophobicContact CB-CE2 3.74Å; R222-Y268 HydrophobicContact CB-CG 4.18Å; R222-Y268 HydrophobicContact CG-CD2 4.4Å
223	C	66.8	Low	56.7	Low	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132.1	175.7	-64.4	0	0	0	0	109.3	F225	C223-F225 HydrophobicContact CB-CD2 4.18Å; C223-F225 HydrophobicContact CB-CE2 3.37Å; C223-F225 HydrophobicContact CB-CZ 3.92Å
224	V	66.1	Low	58.6	Low	30 Å²	30	42.3 Å²	42.3	18%	0.182	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	130.5	170.9	-172.3	0	0	0	0	107.7	R222 I231 V232 D233	R222-V224 VanDerWaalsContact CZ-CG2 3.44Å; R222-V224 VanDerWaalsContact NH1-CG2 3.29Å; R222-V224 VanDerWaalsContact NH2-CG2 3.27Å; V224-I231 WeakPolarHBondContact O-CA 3.16Å; V224-V232 HydrophobicContact CB-CG2 3.96Å; V224-V232 HydrophobicContact CG1-CG2 3.71Å; V224-V232 WeakPolarHBondContact O-CG2 3.11Å; V224-V232 PolarHBondContact O-N 3.22Å; V224-D233 HydrophobicContact CB-CB 3.91Å; V224-D233 HydrophobicContact CG2-CB 3.87Å; V224-D233 PolarHBondContact N-O 2.8Å; V224-D233 PolarHBondContact O-N 3.24Å
225	F	60.8	Low	60.6	Low	13 Å²	13	38.9 Å²	38.9	6%	0.057	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	142.3	180	-64	-99.6	0	0	0	109	M110 F159 I172 I174 A206 C223 G229 D230 I231	M110-F225 HydrophobicContact CE-CD1 3.66Å; M110-F225 HydrophobicContact CE-CE1 3.42Å; M110-F225 VanDerWaalsContact CE-CE1 3.42Å; F159-F225 HydrophobicContact CD1-CD1 4.43Å; F159-F225 HydrophobicContact CD1-CE1 4.24Å; F159-F225 HydrophobicContact CD1-CZ 4.34Å; F159-F225 HydrophobicContact CE1-CB 4.26Å; F159-F225 AromaticContact CE1-CD1 3.72Å; F159-F225 HydrophobicContact CE1-CD1 3.72Å; F159-F225 HydrophobicContact CE1-CD2 4.11Å; F159-F225 AromaticContact CE1-CE1 3.98Å; F159-F225 HydrophobicContact CE1-CE1 3.98Å; F159-F225 HydrophobicContact CE1-CE2 4.39Å; F159-F225 AromaticContact CE1-CG 3.76Å; F159-F225 HydrophobicContact CE1-CG 3.76Å; F159-F225 HydrophobicContact CE1-CZ 4.32Å; F159-F225 HydrophobicContact CZ-CB 4.39Å; F159-F225 HydrophobicContact CZ-CG 4.3Å; I172-F225 HydrophobicContact CD1-CZ 3.99Å; I172-F225 HydrophobicContact CG2-CE1 4.4Å; I172-F225 HydrophobicContact CG2-CZ 4.4Å; I174-F225 HydrophobicContact CD1-CD1 4.18Å; I174-F225 HydrophobicContact CD1-CE1 4.24Å; A206-F225 HydrophobicContact CB-CD2 3.29Å; A206-F225 HydrophobicContact CB-CE2 3.07Å; A206-F225 HydrophobicContact CB-CZ 4.22Å; C223-F225 HydrophobicContact CB-CD2 4.18Å; C223-F225 HydrophobicContact CB-CE2 3.37Å; C223-F225 HydrophobicContact CB-CZ 3.92Å; F225-G229 WeakPolarHBondContact CD1-O 3.45Å; F225-D230 CarbonylContact C-O 3.56Å; F225-D230 VanDerWaalsContact CA-O 3.23Å; F225-D230 WeakPolarHBondContact CA-O 3.31Å; F225-I231 HydrophobicContact CD1-CG1 3.78Å; F225-I231 HydrophobicContact CE1-CD1 4.02Å; F225-I231 HydrophobicContact CE1-CG1 3.38Å; F225-I231 HydrophobicContact CE2-CG1 4.47Å; F225-I231 HydrophobicContact CZ-CD1 4.24Å; F225-I231 HydrophobicContact CZ-CG1 3.77Å
226	D	56.1	Low	62.4	Low	44 Å²	44	37.9 Å²	37.9	24%	0.235	19%	0.193	C	C	.	.			trans	-82	-175.1	167.6	73.6	8.6	0	0	0	111.8	I201 R228 G229 D230 V232	I201-D226 WeakPolarHBondContact CD1-O 3.08Å; D226-R228 PolarHBondContact O-N 3.09Å; D226-R228 VanDerWaalsContact OD1-CA 3.3Å; D226-R228 WeakPolarHBondContact OD1-CA 3.34Å; D226-R228 VanDerWaalsContact OD1-CB 3.28Å; D226-R228 WeakPolarHBondContact OD1-CB 3.46Å; D226-R228 PolarHBondContact OD1-N 2.77Å; D226-G229 WeakPolarHBondContact O-CA 3.47Å; D226-G229 PolarHBondContact O-N 3.3Å; D226-G229 PolarHBondContact OD1-N 2.85Å; D226-D230 PolarHBondContact N-O 3.01Å; D226-D230 PolarHBondContact OD1-N 2.82Å; D226-V232 HydrophobicContact CB-CG1 3.72Å
227	D	52.4	Low	63.9	Low	21 Å²	21	36 Å²	36	11%	0.112	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-5.8	179.1	-60.6	-56.6	0	0	0	115.6	K152 R176 M197 H199 S200 I201 G229	K152-D227 VanDerWaalsContact NZ-CG 3.34Å; K152-D227 IonicContact NZ-OD1 2.7Å; K152-D227 PolarHBondContact NZ-OD1 3.49Å; K152-D227 IonicContact NZ-OD2 3.13Å; R176-D227 PolarHBondContact NH1-O 2.96Å; R176-D227 VanDerWaalsContact NH2-C 3.26Å; R176-D227 PolarHBondContact NH2-O 2.68Å; M197-D227 WeakPolarHBondContact O-CB 3.45Å; H199-D227 VanDerWaalsContact C-CG 3.46Å; H199-D227 VanDerWaalsContact CA-OD2 3.3Å; H199-D227 WeakPolarHBondContact CA-OD2 3.02Å; H199-D227 PolarHBondContact N-OD2 2.82Å; S200-D227 PolarHBondContact N-OD2 3.22Å; I201-D227 WeakPolarHBondContact CG1-OD1 3.24Å; D227-G229 VanDerWaalsContact C-N 3.28Å
228	R	48.4	Very low	65	Low	118 Å²	118	41.6 Å²	41.6	45%	0.445	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-9.7	166.3	-58.7	177.1	179.7	-168.5	-0.9	110.5	R176 D226 D230	R176-R228 VanDerWaalsContact NH2-CA 3.34Å; R176-R228 PolarHBondContact NH2-O 3.37Å; D226-R228 PolarHBondContact O-N 3.09Å; D226-R228 VanDerWaalsContact OD1-CA 3.3Å; D226-R228 WeakPolarHBondContact OD1-CA 3.34Å; D226-R228 VanDerWaalsContact OD1-CB 3.28Å; D226-R228 WeakPolarHBondContact OD1-CB 3.46Å; D226-R228 PolarHBondContact OD1-N 2.77Å; R228-D230 VanDerWaalsContact C-N 3.25Å; R228-D230 WeakPolarHBondContact CB-OD2 3.36Å
229	G	53.4	Low	65.4	Low	2 Å²	2	41.8 Å²	41.8	2%	0.021	20%	0.198	C	C	.	.	S	Bend	trans	77.3	17.6	-172.2	0	0	0	0	0	110.6	M110 I174 R176 F225 D226 D227	M110-G229 WeakPolarHBondContact CE-O 3.11Å; I174-G229 WeakPolarHBondContact CD1-O 2.77Å; R176-G229 VanDerWaalsContact NH2-N 3.13Å; F225-G229 WeakPolarHBondContact CD1-O 3.45Å; D226-G229 WeakPolarHBondContact O-CA 3.47Å; D226-G229 PolarHBondContact O-N 3.3Å; D226-G229 PolarHBondContact OD1-N 2.85Å; D227-G229 VanDerWaalsContact C-N 3.28Å
230	D	56.3	Low	65.8	Low	51 Å²	51	49.2 Å²	49.2	27%	0.273	23%	0.233	S	C	.	.			trans	-80.4	145.7	172.5	-67.4	-50	0	0	0	109.6	F225 D226 R228 V232	F225-D230 CarbonylContact C-O 3.56Å; F225-D230 VanDerWaalsContact CA-O 3.23Å; F225-D230 WeakPolarHBondContact CA-O 3.31Å; D226-D230 PolarHBondContact N-O 3.01Å; D226-D230 PolarHBondContact OD1-N 2.82Å; R228-D230 VanDerWaalsContact C-N 3.25Å; R228-D230 WeakPolarHBondContact CB-OD2 3.36Å; D230-V232 PolarHBondContact O-N 3.33Å
231	I	60.3	Low	66	Low	47 Å²	47	51.9 Å²	51.9	24%	0.241	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	121.1	177.2	-69.3	153.8	0	0	0	108.5	I108 M110 V224 F225 M234	I108-I231 HydrophobicContact CB-CD1 4.11Å; I108-I231 HydrophobicContact CG2-CD1 3.82Å; M110-I231 HydrophobicContact CE-CB 4.3Å; M110-I231 HydrophobicContact CE-CD1 3.78Å; M110-I231 HydrophobicContact CE-CG1 3.52Å; V224-I231 WeakPolarHBondContact O-CA 3.16Å; F225-I231 HydrophobicContact CD1-CG1 3.78Å; F225-I231 HydrophobicContact CE1-CD1 4.02Å; F225-I231 HydrophobicContact CE1-CG1 3.38Å; F225-I231 HydrophobicContact CE2-CG1 4.47Å; F225-I231 HydrophobicContact CZ-CD1 4.24Å; F225-I231 HydrophobicContact CZ-CG1 3.77Å; I231-M234 HydrophobicContact CD1-CE 3.78Å; I231-M234 HydrophobicContact CG2-CB 4.22Å; I231-M234 HydrophobicContact CG2-CE 3.87Å
232	V	68.7	Low	66.4	Low	91 Å²	91	52.8 Å²	52.8	55%	0.552	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	-25.4	177.9	-67.7	0	0	0	0	113.4	V224 D226 D230	V224-V232 HydrophobicContact CB-CG2 3.96Å; V224-V232 HydrophobicContact CG1-CG2 3.71Å; V224-V232 WeakPolarHBondContact O-CG2 3.11Å; V224-V232 PolarHBondContact O-N 3.22Å; D226-V232 HydrophobicContact CB-CG1 3.72Å; D230-V232 PolarHBondContact O-N 3.33Å
233	D	69.3	Low	66.6	Low	59 Å²	59	51.8 Å²	51.8	32%	0.316	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	140.3	175.8	175.6	40.6	0	0	0	109.8	R222 V224	R222-D233 IonicContact NH1-OD2 2.91Å; R222-D233 PolarHBondContact NH1-OD2 2.85Å; V224-D233 HydrophobicContact CB-CB 3.91Å; V224-D233 HydrophobicContact CG2-CB 3.87Å; V224-D233 PolarHBondContact N-O 2.8Å; V224-D233 PolarHBondContact O-N 3.24Å
234	M	69	Low	67	Low	48 Å²	48	52.7 Å²	52.7	24%	0.236	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	120	178.6	-170.6	179.9	-56.3	0	0	109.6	I108 V221 R222 I231 F236	I108-M234 HydrophobicContact CB-CE 3.94Å; I108-M234 HydrophobicContact CD1-CE 3.45Å; I108-M234 VanDerWaalsContact CD1-CE 3.45Å; I108-M234 HydrophobicContact CD1-SD 3.84Å; I108-M234 HydrophobicContact CG1-CE 3.73Å; I108-M234 HydrophobicContact CG1-SD 4.16Å; V221-M234 HydrophobicContact CG1-CG 3.64Å; V221-M234 HydrophobicContact CG1-SD 4.09Å; R222-M234 WeakPolarHBondContact O-CA 3.22Å; I231-M234 HydrophobicContact CD1-CE 3.78Å; I231-M234 HydrophobicContact CG2-CB 4.22Å; I231-M234 HydrophobicContact CG2-CE 3.87Å; M234-F236 HydrophobicContact CG-CE1 4.39Å; M234-F236 HydrophobicContact CG-CE2 3.84Å; M234-F236 HydrophobicContact CG-CZ 3.71Å; M234-F236 HydrophobicContact SD-CE1 4.04Å; M234-F236 HydrophobicContact SD-CE2 3.92Å; M234-F236 HydrophobicContact SD-CZ 3.29Å; M234-F236 WeakPolarHBondContact SD-CZ 3.24Å
235	Q	74	Confident	67.6	Low	48 Å²	48	51.3 Å²	51.3	22%	0.224	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	145	-176.7	-60	174.3	-42.8	0	0	109.7	V221 R222 Y268	V221-Q235 CarbonylContact C-O 3.57Å; V221-Q235 WeakPolarHBondContact CA-O 3.37Å; R222-Q235 HydrophobicContact CB-CB 4.41Å; R222-Q235 PolarHBondContact N-O 2.85Å; R222-Q235 PolarHBondContact O-N 2.91Å; Q235-Y268 HydrophobicContact CB-CD1 3.66Å; Q235-Y268 HydrophobicContact CB-CE1 4.22Å; Q235-Y268 HydrophobicContact CB-CG 4.42Å; Q235-Y268 VanDerWaalsContact OE1-CB 3.23Å
236	F	72.1	Confident	68.5	Low	85 Å²	85	51.7 Å²	51.7	37%	0.373	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	136.2	-174.5	-59.2	-91.4	0	0	0	110.3	V105 V220 V221 M234	V105-F236 HydrophobicContact CB-CE1 4.28Å; V105-F236 HydrophobicContact CG1-CE1 3.62Å; V105-F236 HydrophobicContact CG1-CZ 4.24Å; V220-F236 WeakPolarHBondContact O-CA 3.38Å; V221-F236 HydrophobicContact CB-CD1 4.24Å; V221-F236 HydrophobicContact CB-CE1 4.31Å; V221-F236 HydrophobicContact CG1-CD1 3.89Å; V221-F236 HydrophobicContact CG1-CE1 3.66Å; V221-F236 HydrophobicContact CG1-CZ 4.26Å; V221-F236 HydrophobicContact CG2-CD1 3.57Å; V221-F236 HydrophobicContact CG2-CE1 3.68Å; M234-F236 HydrophobicContact CG-CE1 4.39Å; M234-F236 HydrophobicContact CG-CE2 3.84Å; M234-F236 HydrophobicContact CG-CZ 3.71Å; M234-F236 HydrophobicContact SD-CE1 4.04Å; M234-F236 HydrophobicContact SD-CE2 3.92Å; M234-F236 HydrophobicContact SD-CZ 3.29Å; M234-F236 WeakPolarHBondContact SD-CZ 3.24Å
237	M	73.3	Confident	69.6	Low	8 Å²	8	50.8 Å²	50.8	4%	0.039	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	122.2	165.3	-179.8	-175.5	63.4	0	0	108.3	K219 V220 M239 V257 Y266 Y268	K219-M237 CarbonylContact C-O 3.53Å; K219-M237 VanDerWaalsContact CA-O 3.24Å; K219-M237 WeakPolarHBondContact CA-O 3.28Å; V220-M237 HydrophobicContact CB-CB 4.37Å; V220-M237 HydrophobicContact CB-CE 3.65Å; V220-M237 HydrophobicContact CG1-CE 4.4Å; V220-M237 HydrophobicContact CG2-CE 3.41Å; V220-M237 VanDerWaalsContact CG2-CE 3.41Å; V220-M237 PolarHBondContact N-O 3.21Å; V220-M237 PolarHBondContact O-N 3.02Å; M237-M239 HydrophobicContact CE-CG 3.75Å; M237-M239 HydrophobicContact CE-SD 3.5Å; M237-M239 VanDerWaalsContact CE-SD 3.5Å; M237-M239 HydrophobicContact CG-SD 4.39Å; M237-M239 HydrophobicContact SD-SD 3.97Å; M237-V257 HydrophobicContact CE-CB 4.35Å; M237-V257 HydrophobicContact CE-CG1 4.34Å; M237-V257 HydrophobicContact CE-CG2 3.71Å; M237-Y266 HydrophobicContact CB-CD1 4.15Å; M237-Y266 HydrophobicContact CB-CE1 3.98Å; M237-Y266 HydrophobicContact CG-CD1 4.12Å; M237-Y266 HydrophobicContact CG-CD2 4.1Å; M237-Y266 HydrophobicContact CG-CE1 4.09Å; M237-Y266 HydrophobicContact CG-CE2 4.08Å; M237-Y266 HydrophobicContact CG-CG 4.11Å; M237-Y266 WeakPolarHBondContact SD-CB 3.47Å; M237-Y266 HydrophobicContact SD-CD1 3.65Å; M237-Y266 HydrophobicContact SD-CD2 3.44Å; M237-Y266 WeakPolarHBondContact SD-CD2 3.28Å; M237-Y266 HydrophobicContact SD-CE1 4.21Å; M237-Y266 HydrophobicContact SD-CE2 4.04Å; M237-Y266 HydrophobicContact SD-CG 3.2Å; M237-Y268 HydrophobicContact CB-CE1 4.03Å
238	R	76.2	Confident	70.7	Confident	139 Å²	139	53.5 Å²	53.5	53%	0.525	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	138.8	171.8	-171.7	177.6	-176.4	174.2	-2.4	109.2	D216	D216-R238 PolarHBondContact O-NE 2.86Å; D216-R238 PolarHBondContact O-NH2 3.35Å; D216-R238 IonicContact OD1-NH2 3.47Å
239	M	72.2	Confident	72.3	Confident	10 Å²	10	48.4 Å²	48.4	5%	0.049	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	127.1	-177.6	-73.9	-61.3	-64.4	0	0	109.8	S218 V220 M237 V243 V257 T259 L264	S218-M239 PolarHBondContact N-O 2.86Å; S218-M239 WeakPolarHBondContact O-CA 3.45Å; S218-M239 WeakPolarHBondContact O-CB 3.43Å; S218-M239 PolarHBondContact O-N 3.26Å; V220-M239 HydrophobicContact CG2-CG 4.12Å; M237-M239 HydrophobicContact CE-CG 3.75Å; M237-M239 HydrophobicContact CE-SD 3.5Å; M237-M239 VanDerWaalsContact CE-SD 3.5Å; M237-M239 HydrophobicContact CG-SD 4.39Å; M237-M239 HydrophobicContact SD-SD 3.97Å; M239-V243 HydrophobicContact CB-CG2 3.98Å; M239-V243 HydrophobicContact CE-CG2 4.44Å; M239-V243 HydrophobicContact CG-CG2 3.72Å; M239-V257 HydrophobicContact CE-CG1 4.37Å; M239-T259 HydrophobicContact CE-CG2 3.43Å; M239-T259 VanDerWaalsContact CE-CG2 3.43Å; M239-L264 HydrophobicContact CE-CD1 3.37Å; M239-L264 HydrophobicContact CE-CG 4.36Å; M239-L264 HydrophobicContact SD-CD1 3.79Å
240	E	75.3	Confident	73.6	Confident	191 Å²	191	51.1 Å²	51.1	89%	0.893	26%	0.259	S	S	*	.	S	Bend	trans	-72.2	-43.1	173.4	-62.5	-174.2	168.8	0	0	110.8
241	N	75.2	Confident	74.8	Confident	57 Å²	57	50.7 Å²	50.7	31%	0.305	26%	0.26	S	S	.	.	S	Bend	trans	-80.7	157.5	178	-62.6	-31.2	0	0	0	112.1	S218 V243 T259 N261	S218-N241 PolarHBondContact OG-O 2.81Å; N241-V243 PolarHBondContact O-N 2.71Å; N241-T259 HydrophobicContact CB-CG2 4.31Å; N241-N261 PolarHBondContact ND2-OD1 3.01Å
242	T	75.9	Confident	75.4	Confident	22 Å²	22	51.5 Å²	51.5	14%	0.135	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-64.1	125.8	170.8	-55.2	0	0	0	0	109.4	K244 T259 E260	T242-K244 HydrophobicContact CG2-CD 4.43Å; T242-T259 VanDerWaalsContact O-CA 3.25Å; T242-T259 WeakPolarHBondContact O-CA 3.26Å; T242-T259 WeakPolarHBondContact O-CB 3.39Å; T242-E260 WeakPolarHBondContact CB-OE1 3.32Å; T242-E260 PolarHBondContact O-N 2.77Å; T242-E260 PolarHBondContact OG1-OE1 3.31Å
243	V	76.1	Confident	76	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.024	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	129.4	170.8	178.9	0	0	0	0	108.9	F93 T210 S218 V220 M239 N241 S245 V246 V257	F93-V243 HydrophobicContact CB-CG1 4.34Å; T210-V243 HydrophobicContact CG2-CB 3.89Å; T210-V243 HydrophobicContact CG2-CG1 3.53Å; T210-V243 HydrophobicContact CG2-CG2 4.29Å; S218-V243 PolarHBondContact OG-N 2.97Å; V220-V243 HydrophobicContact CG2-CG1 4.4Å; V220-V243 HydrophobicContact CG2-CG2 3.82Å; M239-V243 HydrophobicContact CB-CG2 3.98Å; M239-V243 HydrophobicContact CE-CG2 4.44Å; M239-V243 HydrophobicContact CG-CG2 3.72Å; N241-V243 PolarHBondContact O-N 2.71Å; V243-S245 WeakPolarHBondContact CG1-O 3.39Å; V243-V246 HydrophobicContact CG1-CG2 3.81Å; V243-V257 HydrophobicContact CB-CG1 4.39Å; V243-V257 HydrophobicContact CG1-CG1 3.71Å; V243-V257 HydrophobicContact CG2-CG1 3.86Å
244	K	76.1	Confident	76.8	Confident	19 Å²	19	46.3 Å²	46.3	8%	0.083	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	-10	-179.4	-61.5	-72.2	-173.6	172.6	0	112	P92 T242 G258 E260 S282 A283	P92-K244 CarbonylContact C-O 3.59Å; P92-K244 WeakPolarHBondContact CD-O 3.47Å; P92-K244 CarbonylContact O-C 3.35Å; T242-K244 HydrophobicContact CG2-CD 4.43Å; K244-G258 PolarHBondContact N-O 2.97Å; K244-E260 HydrophobicContact CG-CG 4.45Å; K244-S282 WeakPolarHBondContact CD-OG 2.96Å; K244-S282 VanDerWaalsContact CE-OG 3.3Å; K244-S282 WeakPolarHBondContact CE-OG 3.26Å; K244-S282 VanDerWaalsContact CG-OG 3.29Å; K244-S282 WeakPolarHBondContact CG-OG 2.98Å; K244-A283 WeakPolarHBondContact CB-O 3.39Å
245	S	77.9	Confident	77.4	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	150.5	178.7	-54.3	0	0	0	0	112	P92 V243 V257 G258 A283 A285 V286	P92-S245 WeakPolarHBondContact CD-OG 3.36Å; P92-S245 WeakPolarHBondContact CG-OG 3.4Å; P92-S245 PolarHBondContact O-N 3.29Å; V243-S245 WeakPolarHBondContact CG1-O 3.39Å; S245-V257 CarbonylContact O-C 3.55Å; S245-V257 WeakPolarHBondContact O-CA 3.36Å; S245-G258 PolarHBondContact N-O 3.24Å; S245-G258 PolarHBondContact O-N 2.99Å; S245-A283 PolarHBondContact OG-O 2.82Å; S245-A285 WeakPolarHBondContact OG-CA 3.33Å; S245-A285 PolarHBondContact OG-N 3.45Å; S245-V286 VanDerWaalsContact CB-CG2 3.46Å; S245-V286 PolarHBondContact OG-N 3.04Å
246	V	80.2	Confident	78	Confident	22 Å²	22	42 Å²	42	13%	0.133	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	136.3	160.2	-168.4	0	0	0	0	110	F93 A208 T210 V220 V243 A255 T256 V257	F93-V246 HydrophobicContact CD2-CB 3.74Å; F93-V246 HydrophobicContact CD2-CG2 3.52Å; F93-V246 HydrophobicContact CE2-CB 3.59Å; F93-V246 HydrophobicContact CE2-CG2 3.79Å; F93-V246 HydrophobicContact CG-CG2 4.27Å; A208-V246 HydrophobicContact CB-CG1 3.76Å; T210-V246 HydrophobicContact CG2-CG2 3.77Å; V220-V246 HydrophobicContact CG1-CG1 4.07Å; V220-V246 HydrophobicContact CG1-CG2 3.93Å; V220-V246 HydrophobicContact CG2-CG2 4.22Å; V243-V246 HydrophobicContact CG1-CG2 3.81Å; V246-A255 HydrophobicContact CG1-CB 4.23Å; V246-T256 CarbonylContact C-O 3.6Å; V246-T256 VanDerWaalsContact CA-O 3.3Å; V246-T256 WeakPolarHBondContact CA-O 3.33Å; V246-V257 HydrophobicContact CG1-CG2 4.1Å; V246-V257 HydrophobicContact CG2-CG1 4.44Å; V246-V257 HydrophobicContact CG2-CG2 4.32Å
247	A	79.4	Confident	78.7	Confident	24 Å²	24	37.9 Å²	37.9	20%	0.198	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	166.1	168.4	0	0	0	0	0	109.5	T256 V286	A247-T256 PolarHBondContact N-O 3.34Å; A247-T256 PolarHBondContact O-N 2.94Å; A247-V286 HydrophobicContact CB-CG2 4.1Å; A247-V286 WeakPolarHBondContact CB-O 3.36Å
248	F	74.9	Confident	79.4	Confident	79 Å²	79	37.5 Å²	37.5	35%	0.346	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	153.5	166.8	-73.4	-70.3	0	0	0	110.5	V205 Y288	V205-F248 HydrophobicContact CB-CE1 4.25Å; V205-F248 HydrophobicContact CB-CZ 4.2Å; V205-F248 HydrophobicContact CG1-CE1 3.99Å; V205-F248 HydrophobicContact CG1-CZ 4.13Å; V205-F248 WeakPolarHBondContact O-CE2 3.28Å; V205-F248 WeakPolarHBondContact O-CZ 2.95Å; F248-Y288 WeakPolarHBondContact O-CB 3.38Å
249	G	81.6	Confident	79.9	Confident	10 Å²	10	30.9 Å²	30.9	10%	0.103	17%	0.174	C	C	.	.			trans	-97.8	-154.1	166.6	0	0	0	0	0	111.7	S251 V254 Y288	G249-S251 PolarHBondContact O-N 2.97Å; G249-S251 VanDerWaalsContact O-N 3.14Å; G249-V254 PolarHBondContact N-O 3.07Å; G249-Y288 VanDerWaalsContact C-CD1 3.4Å
250	P	82.5	Confident	80.5	Confident	60 Å²	60	34.8 Å²	34.8	39%	0.39	19%	0.192	S	C	.	.	S	Bend	trans	-64	-15.8	-177.9	21.9	-33.7	0	0	0	115.1	V254 M265 Y288	P250-V254 HydrophobicContact CG-CB 4.47Å; P250-V254 HydrophobicContact CG-CG1 4.43Å; P250-M265 HydrophobicContact CG-CE 4.22Å; P250-Y288 VanDerWaalsContact CA-CE1 3.4Å; P250-Y288 HydrophobicContact CB-CE1 3.93Å; P250-Y288 WeakPolarHBondContact CB-OH 3.2Å
251	S	80.9	Confident	81	Confident	42 Å²	42	29.6 Å²	29.6	29%	0.294	17%	0.17	S	C	.	.	S	Bend	trans	-143.2	162.8	178.2	71.2	0	0	0	0	110.6	G249 T253 V254	G249-S251 PolarHBondContact O-N 2.97Å; G249-S251 VanDerWaalsContact O-N 3.14Å; S251-T253 PolarHBondContact O-N 2.76Å; S251-T253 PolarHBondContact OG-OG1 3.25Å; S251-V254 PolarHBondContact O-N 2.8Å; S251-V254 WeakPolarHBondContact OG-CG2 3.43Å
252	P	73.3	Confident	81.9	Confident	63 Å²	63	27.2 Å²	27.2	41%	0.409	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-10.8	179.5	-19.8	31.7	0	0	0	114.4	V205 R222	V205-P252 HydrophobicContact CB-CB 4.13Å; V205-P252 HydrophobicContact CG2-CB 3.6Å; V205-P252 HydrophobicContact CG2-CG 4.48Å; R222-P252 PolarHBondContact NE-O 3.14Å
253	T	81.1	Confident	82.7	Confident	37 Å²	37	26.2 Å²	26.2	23%	0.227	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-3	175.6	62.3	0	0	0	0	112.7	S251 Y268 T269	S251-T253 PolarHBondContact O-N 2.76Å; S251-T253 PolarHBondContact OG-OG1 3.25Å; T253-Y268 WeakPolarHBondContact O-CD2 3.45Å; T253-Y268 PolarHBondContact O-N 3.47Å; T253-T269 WeakPolarHBondContact CB-OG1 3.23Å; T253-T269 WeakPolarHBondContact CG2-OG1 3.28Å
254	V	84.7	Confident	83.5	Confident	5 Å²	5	26.4 Å²	26.4	3%	0.03	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	131.5	178.7	-178.8	0	0	0	0	110	G249 P250 S251 M265 Y266 D267 M274	G249-V254 PolarHBondContact N-O 3.07Å; P250-V254 HydrophobicContact CG-CB 4.47Å; P250-V254 HydrophobicContact CG-CG1 4.43Å; S251-V254 PolarHBondContact O-N 2.8Å; S251-V254 WeakPolarHBondContact OG-CG2 3.43Å; V254-M265 HydrophobicContact CG1-CE 3.95Å; V254-Y266 CarbonylContact C-O 3.54Å; V254-Y266 VanDerWaalsContact CA-O 3.28Å; V254-Y266 WeakPolarHBondContact CA-O 3.46Å; V254-D267 HydrophobicContact CG2-CB 4.18Å; V254-M274 HydrophobicContact CG1-SD 3.85Å; V254-M274 HydrophobicContact CG2-SD 3.75Å
255	A	83	Confident	84.2	Confident	4 Å²	4	25.6 Å²	25.6	3%	0.033	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	138.7	173.3	0	0	0	0	0	111.1	V246 V257 M265 Y266 Y268	V246-A255 HydrophobicContact CG1-CB 4.23Å; A255-V257 HydrophobicContact CB-CG2 4.23Å; A255-M265 CarbonylContact O-C 3.59Å; A255-M265 VanDerWaalsContact O-CA 3.31Å; A255-M265 WeakPolarHBondContact O-CA 3.23Å; A255-Y266 PolarHBondContact N-O 3.03Å; A255-Y266 PolarHBondContact O-N 3.25Å; A255-Y268 HydrophobicContact CB-CE2 3.75Å
256	T	86.6	Confident	84.7	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	121.3	171	-55.7	0	0	0	0	108.1	V246 A247 V263 L264 M265 V286 V295	V246-T256 CarbonylContact C-O 3.6Å; V246-T256 VanDerWaalsContact CA-O 3.3Å; V246-T256 WeakPolarHBondContact CA-O 3.33Å; A247-T256 PolarHBondContact N-O 3.34Å; A247-T256 PolarHBondContact O-N 2.94Å; T256-V263 HydrophobicContact CG2-CG1 3.61Å; T256-L264 CarbonylContact C-O 3.44Å; T256-L264 WeakPolarHBondContact CA-O 3.09Å; T256-M265 HydrophobicContact CG2-CG 4.3Å; T256-V286 HydrophobicContact CG2-CB 4.16Å; T256-V286 HydrophobicContact CG2-CG2 3.86Å; T256-V286 WeakPolarHBondContact O-CG2 3.42Å; T256-V295 HydrophobicContact CG2-CG1 3.78Å; T256-V295 HydrophobicContact CG2-CG2 4.27Å
257	V	87.3	Confident	85.2	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	113.5	-167.6	-178.8	0	0	0	0	109.7	V220 M237 M239 V243 S245 V246 A255 T259 V263 L264	V220-V257 HydrophobicContact CG1-CG2 4.44Å; V220-V257 HydrophobicContact CG2-CG1 4Å; V220-V257 HydrophobicContact CG2-CG2 4.14Å; M237-V257 HydrophobicContact CE-CB 4.35Å; M237-V257 HydrophobicContact CE-CG1 4.34Å; M237-V257 HydrophobicContact CE-CG2 3.71Å; M239-V257 HydrophobicContact CE-CG1 4.37Å; V243-V257 HydrophobicContact CB-CG1 4.39Å; V243-V257 HydrophobicContact CG1-CG1 3.71Å; V243-V257 HydrophobicContact CG2-CG1 3.86Å; S245-V257 CarbonylContact O-C 3.55Å; S245-V257 WeakPolarHBondContact O-CA 3.36Å; V246-V257 HydrophobicContact CG1-CG2 4.1Å; V246-V257 HydrophobicContact CG2-CG1 4.44Å; V246-V257 HydrophobicContact CG2-CG2 4.32Å; A255-V257 HydrophobicContact CB-CG2 4.23Å; V257-T259 HydrophobicContact CG1-CG2 4.36Å; V257-V263 CarbonylContact O-C 3.53Å; V257-V263 WeakPolarHBondContact O-CA 3.35Å; V257-L264 HydrophobicContact CB-CB 4.49Å; V257-L264 PolarHBondContact N-O 3.03Å; V257-L264 PolarHBondContact O-N 3.36Å
258	G	88	Confident	85.3	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	138.3	172.7	0	0	0	0	0	110.7	K244 S245	K244-G258 PolarHBondContact N-O 2.97Å; S245-G258 PolarHBondContact N-O 3.24Å; S245-G258 PolarHBondContact O-N 2.99Å
259	T	85.9	Confident	86	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	-172.9	178.7	76.7	0	0	0	0	111.1	M239 N241 T242 V257 N261 S262 A283	M239-T259 HydrophobicContact CE-CG2 3.43Å; M239-T259 VanDerWaalsContact CE-CG2 3.43Å; N241-T259 HydrophobicContact CB-CG2 4.31Å; T242-T259 VanDerWaalsContact O-CA 3.25Å; T242-T259 WeakPolarHBondContact O-CA 3.26Å; T242-T259 WeakPolarHBondContact O-CB 3.39Å; V257-T259 HydrophobicContact CG1-CG2 4.36Å; T259-N261 PolarHBondContact O-N 3.02Å; T259-N261 PolarHBondContact OG1-N 2.86Å; T259-N261 PolarHBondContact OG1-OD1 2.95Å; T259-S262 PolarHBondContact N-O 2.65Å; T259-S262 PolarHBondContact OG1-N 3.16Å; T259-S262 PolarHBondContact OG1-O 2.96Å; T259-S262 PolarHBondContact OG1-OG 3.01Å; T259-A283 PolarHBondContact O-N 3.43Å
260	E	84.5	Confident	86.5	Confident	91 Å²	91	34.7 Å²	34.7	43%	0.425	18%	0.183	S	C	.	.	S	Bend	trans	-64.3	-23.4	177	-75.9	174.7	-173.6	0	0	114.4	T242 K244 E281 S282	T242-E260 WeakPolarHBondContact CB-OE1 3.32Å; T242-E260 PolarHBondContact O-N 2.77Å; T242-E260 PolarHBondContact OG1-OE1 3.31Å; K244-E260 HydrophobicContact CG-CG 4.45Å; E260-E281 CarbonylContact O-C 3.51Å; E260-S282 VanDerWaalsContact O-CA 3.23Å; E260-S282 WeakPolarHBondContact O-CA 3.44Å; E260-S282 PolarHBondContact O-N 3.11Å
261	N	86.8	Confident	86.9	Confident	83 Å²	83	39.5 Å²	39.5	44%	0.444	20%	0.197	S	C	.	.	S	Bend	trans	-143.9	-2.2	-172.3	60.2	-4.5	0	0	0	114.6	N241 T259 C279	N241-N261 PolarHBondContact ND2-OD1 3.01Å; T259-N261 PolarHBondContact O-N 3.02Å; T259-N261 PolarHBondContact OG1-N 2.86Å; T259-N261 PolarHBondContact OG1-OD1 2.95Å; N261-C279 CarbonylContact C-O 3.51Å; N261-C279 WeakPolarHBondContact CA-O 3.45Å; N261-C279 CarbonylContact O-C 3.46Å; N261-C279 PolarHBondContact O-N 3.35Å
262	S	92.4	Very high	87.5	Confident	7 Å²	7	39.6 Å²	39.6	5%	0.049	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	165	178.1	70.5	0	0	0	0	113.1	T259 D276 L277	T259-S262 PolarHBondContact N-O 2.65Å; T259-S262 PolarHBondContact OG1-N 3.16Å; T259-S262 PolarHBondContact OG1-O 2.96Å; T259-S262 PolarHBondContact OG1-OG 3.01Å; S262-D276 WeakPolarHBondContact CB-OD1 3.36Å; S262-D276 PolarHBondContact OG-OD1 3.15Å; S262-L277 CarbonylContact C-O 3.59Å; S262-L277 VanDerWaalsContact CA-O 3.27Å; S262-L277 WeakPolarHBondContact CA-O 3.11Å; S262-L277 WeakPolarHBondContact CB-O 3.4Å
263	V	93.5	Very high	88.4	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.1	162.8	179.7	0	0	0	0	108.8	T256 V257 L277 A283 V286 V295 A297	T256-V263 HydrophobicContact CG2-CG1 3.61Å; V257-V263 CarbonylContact O-C 3.53Å; V257-V263 WeakPolarHBondContact O-CA 3.35Å; V263-L277 HydrophobicContact CB-CB 4.25Å; V263-L277 PolarHBondContact N-O 2.77Å; V263-L277 WeakPolarHBondContact O-CB 3.32Å; V263-L277 PolarHBondContact O-N 2.77Å; V263-A283 HydrophobicContact CG2-CB 3.65Å; V263-V286 HydrophobicContact CG1-CG1 4.04Å; V263-V286 HydrophobicContact CG2-CG1 3.65Å; V263-V295 HydrophobicContact CG1-CG1 3.84Å; V263-A297 HydrophobicContact CG2-CB 3.61Å
264	L	92	Very high	89	Confident	9 Å²	9	42.6 Å²	42.6	5%	0.047	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	142.7	176.7	-56.4	-174.8	0	0	0	110.3	M239 T256 V257 I273 Y275 D276	M239-L264 HydrophobicContact CE-CD1 3.37Å; M239-L264 HydrophobicContact CE-CG 4.36Å; M239-L264 HydrophobicContact SD-CD1 3.79Å; T256-L264 CarbonylContact C-O 3.44Å; T256-L264 WeakPolarHBondContact CA-O 3.09Å; V257-L264 HydrophobicContact CB-CB 4.49Å; V257-L264 PolarHBondContact N-O 3.03Å; V257-L264 PolarHBondContact O-N 3.36Å; L264-I273 HydrophobicContact CD1-CD1 4.21Å; L264-I273 HydrophobicContact CD2-CG2 4.4Å; L264-Y275 CarbonylContact C-O 3.2Å; L264-Y275 WeakPolarHBondContact CA-O 3.43Å; L264-D276 HydrophobicContact CD2-CB 3.71Å; L264-D276 WeakPolarHBondContact CD2-OD1 3.23Å
265	M	91.1	Very high	89.4	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	123.9	160.1	-68.5	-178.8	70.7	0	0	109	P250 V254 A255 T256 I273 M274 Y275 Y288 V295 L309	P250-M265 HydrophobicContact CG-CE 4.22Å; V254-M265 HydrophobicContact CG1-CE 3.95Å; A255-M265 CarbonylContact O-C 3.59Å; A255-M265 VanDerWaalsContact O-CA 3.31Å; A255-M265 WeakPolarHBondContact O-CA 3.23Å; T256-M265 HydrophobicContact CG2-CG 4.3Å; M265-I273 CarbonylContact O-C 3.55Å; M265-M274 HydrophobicContact CB-CB 4.32Å; M265-M274 PolarHBondContact O-N 2.84Å; M265-Y275 HydrophobicContact CB-CD2 4.12Å; M265-Y275 HydrophobicContact CG-CD2 4.47Å; M265-Y275 PolarHBondContact N-O 2.84Å; M265-Y275 PolarHBondContact O-N 3.37Å; M265-Y275 HydrophobicContact SD-CD2 3.8Å; M265-Y275 HydrophobicContact SD-CE2 4.47Å; M265-Y275 HydrophobicContact SD-CG 4.42Å; M265-Y288 HydrophobicContact CE-CD2 4.24Å; M265-Y288 HydrophobicContact CE-CE2 4.39Å; M265-V295 HydrophobicContact SD-CG2 3.76Å; M265-L309 HydrophobicContact CE-CD1 3.84Å; M265-L309 HydrophobicContact SD-CD1 3.38Å; M265-L309 WeakPolarHBondContact SD-CD1 3.18Å; M265-L309 HydrophobicContact SD-CD2 3.84Å; M265-L309 HydrophobicContact SD-CG 4.25Å
266	Y	88.9	Confident	89.9	Confident	28 Å²	28	51.1 Å²	51.1	11%	0.11	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	130.4	-176.2	-176.4	-97.4	0	0	0	111.2	M237 V254 A255 Y268 K271 S272 I273	M237-Y266 HydrophobicContact CB-CD1 4.15Å; M237-Y266 HydrophobicContact CB-CE1 3.98Å; M237-Y266 HydrophobicContact CG-CD1 4.12Å; M237-Y266 HydrophobicContact CG-CD2 4.1Å; M237-Y266 HydrophobicContact CG-CE1 4.09Å; M237-Y266 HydrophobicContact CG-CE2 4.08Å; M237-Y266 HydrophobicContact CG-CG 4.11Å; M237-Y266 WeakPolarHBondContact SD-CB 3.47Å; M237-Y266 HydrophobicContact SD-CD1 3.65Å; M237-Y266 HydrophobicContact SD-CD2 3.44Å; M237-Y266 WeakPolarHBondContact SD-CD2 3.28Å; M237-Y266 HydrophobicContact SD-CE1 4.21Å; M237-Y266 HydrophobicContact SD-CE2 4.04Å; M237-Y266 HydrophobicContact SD-CG 3.2Å; V254-Y266 CarbonylContact C-O 3.54Å; V254-Y266 VanDerWaalsContact CA-O 3.28Å; V254-Y266 WeakPolarHBondContact CA-O 3.46Å; A255-Y266 PolarHBondContact N-O 3.03Å; A255-Y266 PolarHBondContact O-N 3.25Å; Y266-Y268 HydrophobicContact CD1-CD1 4.07Å; Y266-Y268 HydrophobicContact CD1-CD2 4.14Å; Y266-Y268 HydrophobicContact CD1-CE1 4.17Å; Y266-Y268 HydrophobicContact CD1-CE2 4.22Å; Y266-Y268 HydrophobicContact CD1-CG 4.06Å; Y266-Y268 AromaticContact CE1-CD1 3.72Å; Y266-Y268 HydrophobicContact CE1-CD1 3.72Å; Y266-Y268 HydrophobicContact CE1-CE1 4.02Å; Y266-Y268 HydrophobicContact CE1-CG 4.01Å; Y266-K271 VanDerWaalsContact OH-C 3.26Å; Y266-K271 WeakPolarHBondContact OH-CA 3.34Å; Y266-K271 PolarHBondContact OH-O 2.85Å; Y266-S272 VanDerWaalsContact CD2-C 3.5Å; Y266-S272 WeakPolarHBondContact CD2-O 3.3Å; Y266-I273 HydrophobicContact CD2-CG1 4.01Å
267	D	90.5	Very high	90.3	Very high	13 Å²	13	51.5 Å²	51.5	7%	0.07	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	114.3	173.5	-175.3	-28.9	0	0	0	109.5	V254 T269 R270 K271 S272 M274	V254-D267 HydrophobicContact CG2-CB 4.18Å; D267-T269 VanDerWaalsContact C-N 3.33Å; D267-T269 PolarHBondContact O-N 3.16Å; D267-T269 WeakPolarHBondContact OD1-CA 3.28Å; D267-T269 VanDerWaalsContact OD1-CB 3.23Å; D267-T269 WeakPolarHBondContact OD1-CB 3.27Å; D267-T269 PolarHBondContact OD1-N 3.34Å; D267-R270 HydrophobicContact CB-CB 4.07Å; D267-R270 HydrophobicContact CB-CG 4.38Å; D267-R270 PolarHBondContact OD1-N 3.06Å; D267-R270 VanDerWaalsContact OD2-CD 3.26Å; D267-R270 WeakPolarHBondContact OD2-CD 3.44Å; D267-R270 WeakPolarHBondContact OD2-CG 3.45Å; D267-R270 IonicContact OD2-NE 2.63Å; D267-R270 PolarHBondContact OD2-NE 2.94Å; D267-K271 VanDerWaalsContact O-CA 3.24Å; D267-K271 WeakPolarHBondContact O-CA 3.39Å; D267-K271 PolarHBondContact O-N 2.87Å; D267-S272 PolarHBondContact N-O 2.83Å; D267-S272 PolarHBondContact O-N 2.98Å; D267-M274 HydrophobicContact CB-CG 3.95Å; D267-M274 HydrophobicContact CB-SD 3.82Å
268	Y	81.7	Confident	90.5	Very high	6 Å²	6	54.9 Å²	54.9	2%	0.024	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-26.6	179.3	-75.8	-82.9	0	0	0	113.9	V220 R222 Q235 M237 T253 A255 Y266 K271	V220-Y268 WeakPolarHBondContact CG1-OH 3.37Å; V220-Y268 PolarHBondContact O-OH 2.72Å; R222-Y268 HydrophobicContact CB-CD1 4.16Å; R222-Y268 HydrophobicContact CB-CD2 3.97Å; R222-Y268 HydrophobicContact CB-CE1 3.94Å; R222-Y268 HydrophobicContact CB-CE2 3.74Å; R222-Y268 HydrophobicContact CB-CG 4.18Å; R222-Y268 HydrophobicContact CG-CD2 4.4Å; Q235-Y268 HydrophobicContact CB-CD1 3.66Å; Q235-Y268 HydrophobicContact CB-CE1 4.22Å; Q235-Y268 HydrophobicContact CB-CG 4.42Å; Q235-Y268 VanDerWaalsContact OE1-CB 3.23Å; M237-Y268 HydrophobicContact CB-CE1 4.03Å; T253-Y268 WeakPolarHBondContact O-CD2 3.45Å; T253-Y268 PolarHBondContact O-N 3.47Å; A255-Y268 HydrophobicContact CB-CE2 3.75Å; Y266-Y268 HydrophobicContact CD1-CD1 4.07Å; Y266-Y268 HydrophobicContact CD1-CD2 4.14Å; Y266-Y268 HydrophobicContact CD1-CE1 4.17Å; Y266-Y268 HydrophobicContact CD1-CE2 4.22Å; Y266-Y268 HydrophobicContact CD1-CG 4.06Å; Y266-Y268 AromaticContact CE1-CD1 3.72Å; Y266-Y268 HydrophobicContact CE1-CD1 3.72Å; Y266-Y268 HydrophobicContact CE1-CE1 4.02Å; Y266-Y268 HydrophobicContact CE1-CG 4.01Å; Y268-K271 WeakPolarHBondContact O-CG 3.22Å
269	T	88.8	Confident	90.7	Very high	97 Å²	97	55.1 Å²	55.1	60%	0.595	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-46.7	176.4	-55.7	0	0	0	0	109.8	T253 D267 K271	T253-T269 WeakPolarHBondContact CB-OG1 3.23Å; T253-T269 WeakPolarHBondContact CG2-OG1 3.28Å; D267-T269 VanDerWaalsContact C-N 3.33Å; D267-T269 PolarHBondContact O-N 3.16Å; D267-T269 WeakPolarHBondContact OD1-CA 3.28Å; D267-T269 VanDerWaalsContact OD1-CB 3.23Å; D267-T269 WeakPolarHBondContact OD1-CB 3.27Å; D267-T269 PolarHBondContact OD1-N 3.34Å; T269-K271 VanDerWaalsContact C-N 3.31Å
270	R	93.2	Very high	90.9	Very high	183 Å²	183	59 Å²	59	69%	0.691	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-15.4	178.2	-62.2	178.8	-176.3	-176.5	0.9	113.3	D267 S272	D267-R270 HydrophobicContact CB-CB 4.07Å; D267-R270 HydrophobicContact CB-CG 4.38Å; D267-R270 PolarHBondContact OD1-N 3.06Å; D267-R270 VanDerWaalsContact OD2-CD 3.26Å; D267-R270 WeakPolarHBondContact OD2-CD 3.44Å; D267-R270 WeakPolarHBondContact OD2-CG 3.45Å; D267-R270 IonicContact OD2-NE 2.63Å; D267-R270 PolarHBondContact OD2-NE 2.94Å; R270-S272 WeakPolarHBondContact CB-OG 3.48Å; R270-S272 PolarHBondContact O-N 2.73Å
271	K	91.2	Very high	91.2	Very high	160 Å²	160	57.8 Å²	57.8	70%	0.696	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	35.9	-172.5	-60	-179.7	179.6	175.9	0	113	Y266 D267 Y268 T269	Y266-K271 VanDerWaalsContact OH-C 3.26Å; Y266-K271 WeakPolarHBondContact OH-CA 3.34Å; Y266-K271 PolarHBondContact OH-O 2.85Å; D267-K271 VanDerWaalsContact O-CA 3.24Å; D267-K271 WeakPolarHBondContact O-CA 3.39Å; D267-K271 PolarHBondContact O-N 2.87Å; Y268-K271 WeakPolarHBondContact O-CG 3.22Å; T269-K271 VanDerWaalsContact C-N 3.31Å
272	S	93.8	Very high	91.2	Very high	45 Å²	45	55.2 Å²	55.2	32%	0.315	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	146.5	-172.4	63.9	0	0	0	0	112.2	Y266 D267 R270 M274	Y266-S272 VanDerWaalsContact CD2-C 3.5Å; Y266-S272 WeakPolarHBondContact CD2-O 3.3Å; D267-S272 PolarHBondContact N-O 2.83Å; D267-S272 PolarHBondContact O-N 2.98Å; R270-S272 WeakPolarHBondContact CB-OG 3.48Å; R270-S272 PolarHBondContact O-N 2.73Å; S272-M274 PolarHBondContact O-N 2.94Å
273	I	92.2	Very high	91.2	Very high	94 Å²	94	54.9 Å²	54.9	48%	0.482	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	122.3	167	-61.5	171.4	0	0	0	108	L264 M265 Y266 Y275 D276	L264-I273 HydrophobicContact CD1-CD1 4.21Å; L264-I273 HydrophobicContact CD2-CG2 4.4Å; M265-I273 CarbonylContact O-C 3.55Å; Y266-I273 HydrophobicContact CD2-CG1 4.01Å; I273-Y275 VanDerWaalsContact CG2-O 3.24Å; I273-Y275 WeakPolarHBondContact CG2-O 3.33Å; I273-D276 HydrophobicContact CG2-CB 4.49Å
274	M	91.9	Very high	90.8	Very high	69 Å²	69	55.7 Å²	55.7	34%	0.34	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-42.2	175.4	-61.9	177.7	65.6	0	0	111.6	V254 M265 D267 S272	V254-M274 HydrophobicContact CG1-SD 3.85Å; V254-M274 HydrophobicContact CG2-SD 3.75Å; M265-M274 HydrophobicContact CB-CB 4.32Å; M265-M274 PolarHBondContact O-N 2.84Å; D267-M274 HydrophobicContact CB-CG 3.95Å; D267-M274 HydrophobicContact CB-SD 3.82Å; S272-M274 PolarHBondContact O-N 2.94Å
275	Y	93.6	Very high	90.6	Very high	87 Å²	87	55.3 Å²	55.3	34%	0.341	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	141.4	-179.1	-65	-88.1	0	0	0	110	L264 M265 I273 L309	L264-Y275 CarbonylContact C-O 3.2Å; L264-Y275 WeakPolarHBondContact CA-O 3.43Å; M265-Y275 HydrophobicContact CB-CD2 4.12Å; M265-Y275 HydrophobicContact CG-CD2 4.47Å; M265-Y275 PolarHBondContact N-O 2.84Å; M265-Y275 PolarHBondContact O-N 3.37Å; M265-Y275 HydrophobicContact SD-CD2 3.8Å; M265-Y275 HydrophobicContact SD-CE2 4.47Å; M265-Y275 HydrophobicContact SD-CG 4.42Å; I273-Y275 VanDerWaalsContact CG2-O 3.24Å; I273-Y275 WeakPolarHBondContact CG2-O 3.33Å; Y275-L309 HydrophobicContact CD1-CD2 4.06Å; Y275-L309 HydrophobicContact CD2-CD2 4.18Å; Y275-L309 HydrophobicContact CE1-CB 4.25Å; Y275-L309 HydrophobicContact CE1-CD2 4.22Å; Y275-L309 HydrophobicContact CE2-CB 4.44Å; Y275-L309 HydrophobicContact CE2-CD1 4.33Å; Y275-L309 HydrophobicContact CE2-CD2 4.36Å; Y275-L309 HydrophobicContact CG-CD2 4.04Å; Y275-L309 PolarHBondContact OH-O 2.79Å
276	D	93.5	Very high	90.6	Very high	101 Å²	101	55.6 Å²	55.6	54%	0.54	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	104.4	167.6	-173.4	-2.4	0	0	0	107.9	S262 L264 I273	S262-D276 WeakPolarHBondContact CB-OD1 3.36Å; S262-D276 PolarHBondContact OG-OD1 3.15Å; L264-D276 HydrophobicContact CD2-CB 3.71Å; L264-D276 WeakPolarHBondContact CD2-OD1 3.23Å; I273-D276 HydrophobicContact CG2-CB 4.49Å
277	L	95.1	Very high	90.7	Very high	7 Å²	7	55 Å²	55	4%	0.037	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	109.5	-170.9	-56.7	172	0	0	0	108.9	S262 V263 C279 V295 F307 L309	S262-L277 CarbonylContact C-O 3.59Å; S262-L277 VanDerWaalsContact CA-O 3.27Å; S262-L277 WeakPolarHBondContact CA-O 3.11Å; S262-L277 WeakPolarHBondContact CB-O 3.4Å; V263-L277 HydrophobicContact CB-CB 4.25Å; V263-L277 PolarHBondContact N-O 2.77Å; V263-L277 WeakPolarHBondContact O-CB 3.32Å; V263-L277 PolarHBondContact O-N 2.77Å; L277-C279 PolarHBondContact O-N 2.86Å; L277-V295 HydrophobicContact CD1-CB 4.18Å; L277-V295 HydrophobicContact CD1-CG1 4.31Å; L277-V295 HydrophobicContact CD1-CG2 4.41Å; L277-F307 HydrophobicContact CB-CD1 3.97Å; L277-F307 HydrophobicContact CB-CE1 3.91Å; L277-F307 HydrophobicContact CB-CE2 4.48Å; L277-F307 HydrophobicContact CB-CG 4.29Å; L277-F307 HydrophobicContact CB-CZ 4.18Å; L277-F307 HydrophobicContact CD1-CB 3.84Å; L277-F307 HydrophobicContact CD1-CD1 4.25Å; L277-F307 HydrophobicContact CD1-CD2 4.16Å; L277-F307 HydrophobicContact CD1-CG 3.84Å; L277-F307 HydrophobicContact CD2-CB 4.45Å; L277-F307 HydrophobicContact CD2-CD1 4.1Å; L277-F307 HydrophobicContact CD2-CG 4.44Å; L277-F307 HydrophobicContact CG-CD1 4.33Å; L277-F307 HydrophobicContact CG-CG 4.42Å; L277-L309 HydrophobicContact CD1-CD2 3.95Å; L277-L309 HydrophobicContact CD2-CD2 4.44Å
278	P	92.9	Very high	90.6	Very high	71 Å²	71	56 Å²	56	46%	0.461	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	132	-175.1	24.8	-34.2	0	0	0	111.9	G314	P278-G314 WeakPolarHBondContact CD-O 3.4Å
279	C	91	Very high	91	Very high	5 Å²	5	56.7 Å²	56.7	3%	0.034	29%	0.287	C	S	.	.			trans	-120.7	118.8	174.3	-75.4	0	0	0	0	109.4	N261 L277 E281	N261-C279 CarbonylContact C-O 3.51Å; N261-C279 WeakPolarHBondContact CA-O 3.45Å; N261-C279 CarbonylContact O-C 3.46Å; N261-C279 PolarHBondContact O-N 3.35Å; L277-C279 PolarHBondContact O-N 2.86Å; C279-E281 WeakPolarHBondContact CB-O 3.11Å; C279-E281 PolarHBondContact O-N 3.42Å; C279-E281 VanDerWaalsContact O-N 3.15Å
280	P	90.1	Very high	90.5	Very high	82 Å²	82	56.8 Å²	56.8	53%	0.532	28%	0.284	S	S	.	.	S	Bend	trans	-63.1	-21.2	-178.3	-23.8	32.9	0	0	0	115
281	E	90.6	Very high	89.8	Confident	66 Å²	66	56 Å²	56	31%	0.308	29%	0.29	S	S	.	.	S	Bend	trans	-131.8	166.6	173.9	-62.9	178.6	-150.5	0	0	109.1	E260 C279 A283 C299 G300 R301	E260-E281 CarbonylContact O-C 3.51Å; C279-E281 WeakPolarHBondContact CB-O 3.11Å; C279-E281 PolarHBondContact O-N 3.42Å; C279-E281 VanDerWaalsContact O-N 3.15Å; E281-A283 PolarHBondContact O-N 3.41Å; E281-C299 PolarHBondContact N-SG 3.01Å; E281-C299 PolarHBondContact O-SG 2.74Å; E281-G300 WeakPolarHBondContact OE2-CA 3.49Å; E281-R301 PolarHBondContact OE2-N 2.86Å
282	S	88	Confident	89.1	Confident	29 Å²	29	48.7 Å²	48.7	20%	0.203	26%	0.26	C	S	.	.			trans	-48.1	125.1	177.2	-178.3	0	0	0	0	112.2	K244 E260 Q284 A298	K244-S282 WeakPolarHBondContact CD-OG 2.96Å; K244-S282 VanDerWaalsContact CE-OG 3.3Å; K244-S282 WeakPolarHBondContact CE-OG 3.26Å; K244-S282 VanDerWaalsContact CG-OG 3.29Å; K244-S282 WeakPolarHBondContact CG-OG 2.98Å; E260-S282 VanDerWaalsContact O-CA 3.23Å; E260-S282 WeakPolarHBondContact O-CA 3.44Å; E260-S282 PolarHBondContact O-N 3.11Å; S282-Q284 VanDerWaalsContact C-N 3.29Å; S282-Q284 PolarHBondContact O-N 3.5Å; S282-A298 VanDerWaalsContact O-O 3.14Å
283	A	91	Very high	88.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.251	C	S	.	.			trans	-75.4	84.7	173.7	0	0	0	0	0	109	K244 S245 T259 V263 E281 A285 V286 A297 A298	K244-A283 WeakPolarHBondContact CB-O 3.39Å; S245-A283 PolarHBondContact OG-O 2.82Å; T259-A283 PolarHBondContact O-N 3.43Å; V263-A283 HydrophobicContact CG2-CB 3.65Å; E281-A283 PolarHBondContact O-N 3.41Å; A283-A285 VanDerWaalsContact C-N 3.26Å; A283-A285 PolarHBondContact O-N 2.91Å; A283-V286 HydrophobicContact CB-CG1 4.18Å; A283-A297 HydrophobicContact CB-CB 4.45Å; A283-A298 CarbonylContact C-O 3.51Å; A283-A298 WeakPolarHBondContact CA-O 3.31Å
284	Q	85.6	Confident	89	Confident	16 Å²	16	43.6 Å²	43.6	8%	0.075	23%	0.233	C	C	.	.			trans	-74.4	-12.7	-170	-167.3	48.3	69.1	0	0	114	N90 L91 P92 S282 A298 C326 F342	N90-Q284 HydrophobicContact CB-CG 4.11Å; N90-Q284 PolarHBondContact O-NE2 2.84Å; L91-Q284 PolarHBondContact O-NE2 2.93Å; L91-Q284 VanDerWaalsContact O-O 3.05Å; P92-Q284 WeakPolarHBondContact CD-O 3.19Å; S282-Q284 VanDerWaalsContact C-N 3.29Å; S282-Q284 PolarHBondContact O-N 3.5Å; Q284-A298 HydrophobicContact CB-CB 4.46Å; Q284-A298 WeakPolarHBondContact CB-O 3.37Å; Q284-A298 PolarHBondContact N-O 2.86Å; Q284-C326 HydrophobicContact CG-CB 4.33Å; Q284-F342 HydrophobicContact CG-CE2 4.16Å; Q284-F342 HydrophobicContact CG-CZ 3.92Å
285	A	88.8	Confident	89.2	Confident	2 Å²	2	40.3 Å²	40.3	2%	0.017	22%	0.216	C	C	.	.			trans	-157.8	147.2	167.1	0	0	0	0	0	106.9	P92 S245 A283 A297 A298 M328	P92-A285 HydrophobicContact CG-CB 4.25Å; S245-A285 WeakPolarHBondContact OG-CA 3.33Å; S245-A285 PolarHBondContact OG-N 3.45Å; A283-A285 VanDerWaalsContact C-N 3.26Å; A283-A285 PolarHBondContact O-N 2.91Å; A285-A297 CarbonylContact O-C 3.59Å; A285-A297 WeakPolarHBondContact O-CA 3.11Å; A285-A298 HydrophobicContact CB-CB 3.96Å; A285-A298 PolarHBondContact O-N 2.81Å; A285-M328 VanDerWaalsContact C-CE 3.4Å; A285-M328 HydrophobicContact CB-CB 4.5Å; A285-M328 HydrophobicContact CB-CE 3.71Å; A285-M328 HydrophobicContact CB-CG 4.06Å; A285-M328 WeakPolarHBondContact O-CE 3.15Å
286	V	90.9	Very high	89.3	Confident	6 Å²	6	36.2 Å²	36.2	4%	0.036	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	145.8	172.2	-55.3	0	0	0	0	110.8	S245 A247 T256 V263 A283 F296 A297	S245-V286 VanDerWaalsContact CB-CG2 3.46Å; S245-V286 PolarHBondContact OG-N 3.04Å; A247-V286 HydrophobicContact CB-CG2 4.1Å; A247-V286 WeakPolarHBondContact CB-O 3.36Å; T256-V286 HydrophobicContact CG2-CB 4.16Å; T256-V286 HydrophobicContact CG2-CG2 3.86Å; T256-V286 WeakPolarHBondContact O-CG2 3.42Å; V263-V286 HydrophobicContact CG1-CG1 4.04Å; V263-V286 HydrophobicContact CG2-CG1 3.65Å; A283-V286 HydrophobicContact CB-CG1 4.18Å; V286-F296 VanDerWaalsContact CA-O 3.23Å; V286-F296 WeakPolarHBondContact CA-O 3.47Å; V286-A297 HydrophobicContact CG1-CB 4.37Å
287	V	89.7	Confident	89.4	Confident	16 Å²	16	31.4 Å²	31.4	10%	0.097	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	148.6	171.6	-67.8	0	0	0	0	109.6	F296 M328 L330	V287-F296 HydrophobicContact CG2-CB 3.74Å; V287-F296 HydrophobicContact CG2-CD2 4.23Å; V287-F296 HydrophobicContact CG2-CG 4.37Å; V287-F296 PolarHBondContact N-O 3.42Å; V287-F296 PolarHBondContact O-N 3.02Å; V287-M328 HydrophobicContact CG1-CB 3.83Å; V287-M328 HydrophobicContact CG2-CB 4.25Å; V287-M328 HydrophobicContact CG2-CE 4.14Å; V287-M328 HydrophobicContact CG2-SD 4.33Å; V287-L330 HydrophobicContact CB-CD1 3.68Å; V287-L330 HydrophobicContact CB-CG 3.77Å; V287-L330 HydrophobicContact CG1-CG 4.31Å; V287-L330 HydrophobicContact CG2-CD1 3.76Å; V287-L330 HydrophobicContact CG2-CD2 3.81Å; V287-L330 HydrophobicContact CG2-CG 3.62Å
288	Y	88.2	Confident	89.3	Confident	35 Å²	35	31 Å²	31	14%	0.137	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	132.4	175.5	170.3	-98	0	0	0	109.6	F248 G249 P250 M265 D290 V295 L309 L330	F248-Y288 WeakPolarHBondContact O-CB 3.38Å; G249-Y288 VanDerWaalsContact C-CD1 3.4Å; P250-Y288 VanDerWaalsContact CA-CE1 3.4Å; P250-Y288 HydrophobicContact CB-CE1 3.93Å; P250-Y288 WeakPolarHBondContact CB-OH 3.2Å; M265-Y288 HydrophobicContact CE-CD2 4.24Å; M265-Y288 HydrophobicContact CE-CE2 4.39Å; Y288-D290 VanDerWaalsContact CE1-CA 3.48Å; Y288-D290 HydrophobicContact CE1-CB 3.81Å; Y288-D290 WeakPolarHBondContact CE1-OD1 3.4Å; Y288-D290 PolarHBondContact OH-OD1 3.04Å; Y288-D290 VanDerWaalsContact OH-OD1 3.04Å; Y288-V295 HydrophobicContact CD2-CG2 3.98Å; Y288-L309 HydrophobicContact CD2-CD1 4.33Å; Y288-L309 HydrophobicContact CE2-CD1 3.9Å; Y288-L330 WeakPolarHBondContact O-CD1 3.09Å
289	K	90	Very high	89.4	Confident	19 Å²	19	27.7 Å²	27.7	8%	0.083	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	113	-177.1	-176.7	-176.4	167.9	-76.9	0	109.1	G293 E294 F296 L330 D334 F351	K289-G293 PolarHBondContact O-N 3.19Å; K289-G293 VanDerWaalsContact O-N 3.17Å; K289-E294 HydrophobicContact CB-CB 4.22Å; K289-E294 WeakPolarHBondContact CD-OE2 3.48Å; K289-E294 PolarHBondContact N-O 3.19Å; K289-E294 IonicContact NZ-OE2 3.95Å; K289-E294 PolarHBondContact NZ-OE2 3.19Å; K289-E294 PolarHBondContact O-N 3.21Å; K289-E294 VanDerWaalsContact O-N 3.11Å; K289-F296 HydrophobicContact CB-CD2 4.27Å; K289-F296 HydrophobicContact CB-CE2 3.74Å; K289-F296 HydrophobicContact CD-CE2 3.54Å; K289-F296 HydrophobicContact CD-CZ 3.96Å; K289-F296 HydrophobicContact CG-CE2 4.25Å; K289-L330 HydrophobicContact CB-CD1 4Å; K289-D334 WeakPolarHBondContact CE-O 3.44Å; K289-D334 WeakPolarHBondContact CE-OD2 3.38Å; K289-D334 WeakPolarHBondContact CG-OD1 3.37Å; K289-D334 IonicContact NZ-OD1 3.62Å; K289-D334 IonicContact NZ-OD2 3.34Å; K289-D334 PolarHBondContact NZ-OD2 3.04Å; K289-F351 HydrophobicContact CD-CD2 3.97Å; K289-F351 HydrophobicContact CD-CE2 3.74Å; K289-F351 VanDerWaalsContact CE-CD2 3.48Å
290	D	80.3	Confident	89.3	Confident	100 Å²	100	28.2 Å²	28.2	54%	0.535	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-53.8	-162.9	-166.2	36.4	0	0	0	114.1	Y288 G292 G293	Y288-D290 VanDerWaalsContact CE1-CA 3.48Å; Y288-D290 HydrophobicContact CE1-CB 3.81Å; Y288-D290 WeakPolarHBondContact CE1-OD1 3.4Å; Y288-D290 PolarHBondContact OH-OD1 3.04Å; Y288-D290 VanDerWaalsContact OH-OD1 3.04Å; D290-G292 PolarHBondContact O-N 3.09Å; D290-G293 PolarHBondContact O-N 3.04Å
291	M	77.7	Confident	89.3	Confident	166 Å²	166	31.5 Å²	31.5	82%	0.818	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.7	-176	-63.9	-78.5	-127.4	0	0	113.2	D334	M291-D334 WeakPolarHBondContact CB-OD2 3.28Å
292	G	77.2	Confident	89.4	Confident	6 Å²	6	33.4 Å²	33.4	6%	0.062	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-18.9	175.9	0	0	0	0	0	114.7	D290 R310	D290-G292 PolarHBondContact O-N 3.09Å; G292-R310 PolarHBondContact O-NE 3.05Å; G292-R310 PolarHBondContact O-NH2 3.16Å
293	G	89.7	Confident	89.7	Confident	13 Å²	13	32.1 Å²	32.1	13%	0.134	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	40.1	-164.1	0	0	0	0	0	111.8	K289 D290 L309	K289-G293 PolarHBondContact O-N 3.19Å; K289-G293 VanDerWaalsContact O-N 3.17Å; D290-G293 PolarHBondContact O-N 3.04Å; G293-L309 VanDerWaalsContact O-CB 3.31Å; G293-L309 WeakPolarHBondContact O-CB 3.1Å; G293-L309 VanDerWaalsContact O-CG 3.28Å; G293-L309 WeakPolarHBondContact O-CG 3.38Å; G293-L309 PolarHBondContact O-N 3.16Å
294	E	94.1	Very high	89.9	Confident	20 Å²	20	32.1 Å²	32.1	9%	0.093	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	141.6	-174.6	-68.3	169.3	105.8	0	0	111.5	K289 F296 F307 Y318	K289-E294 HydrophobicContact CB-CB 4.22Å; K289-E294 WeakPolarHBondContact CD-OE2 3.48Å; K289-E294 PolarHBondContact N-O 3.19Å; K289-E294 IonicContact NZ-OE2 3.95Å; K289-E294 PolarHBondContact NZ-OE2 3.19Å; K289-E294 PolarHBondContact O-N 3.21Å; K289-E294 VanDerWaalsContact O-N 3.11Å; E294-F296 HydrophobicContact CB-CE2 3.95Å; E294-F296 HydrophobicContact CB-CZ 4.38Å; E294-F307 CarbonylContact C-O 3.52Å; E294-F307 VanDerWaalsContact CA-O 3.25Å; E294-F307 WeakPolarHBondContact CA-O 3.2Å; E294-Y318 VanDerWaalsContact OE1-CE1 3.27Å; E294-Y318 WeakPolarHBondContact OE1-CE1 3.01Å; E294-Y318 PolarHBondContact OE1-OH 3.15Å
295	V	95.1	Very high	90.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	129	168.9	173.5	0	0	0	0	109	T256 V263 M265 L277 Y288 A306 F307 L309	T256-V295 HydrophobicContact CG2-CG1 3.78Å; T256-V295 HydrophobicContact CG2-CG2 4.27Å; V263-V295 HydrophobicContact CG1-CG1 3.84Å; M265-V295 HydrophobicContact SD-CG2 3.76Å; L277-V295 HydrophobicContact CD1-CB 4.18Å; L277-V295 HydrophobicContact CD1-CG1 4.31Å; L277-V295 HydrophobicContact CD1-CG2 4.41Å; Y288-V295 HydrophobicContact CD2-CG2 3.98Å; V295-A306 CarbonylContact O-C 3.54Å; V295-A306 WeakPolarHBondContact O-CA 3.01Å; V295-F307 HydrophobicContact CB-CB 4.37Å; V295-F307 PolarHBondContact N-O 3.24Å; V295-F307 PolarHBondContact O-N 3.48Å; V295-L309 HydrophobicContact CG2-CD1 4.07Å; V295-L309 HydrophobicContact CG2-CD2 4.04Å; V295-L309 HydrophobicContact CG2-CG 4.24Å
296	F	95.1	Very high	90.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.1	172.5	-63.1	-94.4	0	0	0	109.8	V286 V287 K289 E294 I304 L305 A306 Y318 L320 M328 M337 F351	V286-F296 VanDerWaalsContact CA-O 3.23Å; V286-F296 WeakPolarHBondContact CA-O 3.47Å; V287-F296 HydrophobicContact CG2-CB 3.74Å; V287-F296 HydrophobicContact CG2-CD2 4.23Å; V287-F296 HydrophobicContact CG2-CG 4.37Å; V287-F296 PolarHBondContact N-O 3.42Å; V287-F296 PolarHBondContact O-N 3.02Å; K289-F296 HydrophobicContact CB-CD2 4.27Å; K289-F296 HydrophobicContact CB-CE2 3.74Å; K289-F296 HydrophobicContact CD-CE2 3.54Å; K289-F296 HydrophobicContact CD-CZ 3.96Å; K289-F296 HydrophobicContact CG-CE2 4.25Å; E294-F296 HydrophobicContact CB-CE2 3.95Å; E294-F296 HydrophobicContact CB-CZ 4.38Å; F296-I304 HydrophobicContact CB-CG2 3.79Å; F296-I304 HydrophobicContact CD1-CG2 3.91Å; F296-I304 HydrophobicContact CG-CG2 4.34Å; F296-L305 CarbonylContact C-O 3.53Å; F296-L305 VanDerWaalsContact CA-O 3.31Å; F296-L305 WeakPolarHBondContact CA-O 3.29Å; F296-A306 HydrophobicContact CD1-CB 3.76Å; F296-A306 HydrophobicContact CE1-CB 3.57Å; F296-A306 HydrophobicContact CZ-CB 4.32Å; F296-Y318 HydrophobicContact CE1-CE2 4.26Å; F296-Y318 WeakPolarHBondContact CE1-OH 3.35Å; F296-Y318 WeakPolarHBondContact CZ-OH 3.23Å; F296-L320 HydrophobicContact CD1-CD1 4.44Å; F296-L320 HydrophobicContact CE1-CD1 4.41Å; F296-M328 HydrophobicContact CB-CE 4.31Å; F296-M328 HydrophobicContact CB-SD 4.37Å; F296-M337 HydrophobicContact CB-CE 4.2Å; F296-M337 HydrophobicContact CD1-CE 3.52Å; F296-M337 HydrophobicContact CD2-CE 4.25Å; F296-M337 HydrophobicContact CE1-CE 3.88Å; F296-M337 HydrophobicContact CG-CE 3.72Å; F296-M337 HydrophobicContact CZ-CE 4.41Å; F296-F351 HydrophobicContact CE1-CD1 4.41Å; F296-F351 HydrophobicContact CZ-CD1 4.3Å; F296-F351 HydrophobicContact CZ-CE1 4.38Å
297	A	96	Very high	91	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	120.3	179.2	0	0	0	0	0	111	V263 A283 A285 V286 C299 I304 L305 F307	V263-A297 HydrophobicContact CG2-CB 3.61Å; A283-A297 HydrophobicContact CB-CB 4.45Å; A285-A297 CarbonylContact O-C 3.59Å; A285-A297 WeakPolarHBondContact O-CA 3.11Å; V286-A297 HydrophobicContact CG1-CB 4.37Å; A297-C299 PolarHBondContact O-N 3.29Å; A297-I304 CarbonylContact O-C 3.53Å; A297-I304 WeakPolarHBondContact O-CA 2.99Å; A297-L305 PolarHBondContact N-O 3.08Å; A297-L305 PolarHBondContact O-N 2.66Å; A297-F307 HydrophobicContact CB-CE2 3.93Å
298	A	94.4	Very high	91.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	105.4	174.1	0	0	0	0	0	110.1	S282 A283 Q284 A285 I304 C325 M328	S282-A298 VanDerWaalsContact O-O 3.14Å; A283-A298 CarbonylContact C-O 3.51Å; A283-A298 WeakPolarHBondContact CA-O 3.31Å; Q284-A298 HydrophobicContact CB-CB 4.46Å; Q284-A298 WeakPolarHBondContact CB-O 3.37Å; Q284-A298 PolarHBondContact N-O 2.86Å; A285-A298 HydrophobicContact CB-CB 3.96Å; A285-A298 PolarHBondContact O-N 2.81Å; A298-I304 HydrophobicContact CB-CG1 4.25Å; A298-C325 HydrophobicContact CB-CB 3.82Å; A298-C325 WeakPolarHBondContact CB-O 3.24Å; A298-M328 HydrophobicContact CB-CE 4.09Å; A298-M328 HydrophobicContact CB-SD 4.48Å
299	C	94	Very high	91.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.148	C	C	.	.			trans	-109.3	56.8	-168.9	-165.5	0	0	0	0	111	E281 A297 R301 R302 G303 L305	E281-C299 PolarHBondContact N-SG 3.01Å; E281-C299 PolarHBondContact O-SG 2.74Å; A297-C299 PolarHBondContact O-N 3.29Å; C299-R301 PolarHBondContact O-N 2.76Å; C299-R302 HydrophobicContact CB-CB 4.3Å; C299-R302 WeakPolarHBondContact O-CA 3.47Å; C299-R302 VanDerWaalsContact O-CB 3.31Å; C299-R302 WeakPolarHBondContact O-CB 3.14Å; C299-R302 PolarHBondContact O-N 2.7Å; C299-G303 PolarHBondContact N-O 3.13Å; C299-L305 HydrophobicContact CB-CD1 3.83Å; C299-L305 HydrophobicContact CB-CG 3.84Å
300	G	89.1	Confident	91.5	Very high	16 Å²	16	38 Å²	38	17%	0.165	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	55.3	-124	174.7	0	0	0	0	0	114	E281 R302 G303 P323 H324	E281-G300 WeakPolarHBondContact OE2-CA 3.49Å; G300-R302 PolarHBondContact O-N 3.49Å; G300-G303 PolarHBondContact O-N 2.66Å; G300-P323 WeakPolarHBondContact O-CA 2.99Å; G300-H324 PolarHBondContact O-N 3.22Å
301	R	90.7	Very high	91.9	Very high	152 Å²	152	37.9 Å²	37.9	57%	0.574	17%	0.172	S	C	*	.	G	3₁₀ helix	trans	-68.2	-18.9	-179.6	-70.3	178.5	177.9	-166.7	-4.4	112.5	E281 C299 G303 R319 H324	E281-R301 PolarHBondContact OE2-N 2.86Å; C299-R301 PolarHBondContact O-N 2.76Å; R301-G303 PolarHBondContact O-N 3.42Å; R301-R319 PolarHBondContact O-NH2 3.3Å; R301-H324 VanDerWaalsContact CG-CE1 3.4Å; R301-H324 WeakPolarHBondContact CG-CE1 3.49Å
302	R	91.6	Very high	92.1	Very high	106 Å²	106	36.1 Å²	36.1	40%	0.4	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-80.1	7.8	176.6	-62.3	-176.6	173.4	-96.8	-0.1	113.6	C299 G300 R319	C299-R302 HydrophobicContact CB-CB 4.3Å; C299-R302 WeakPolarHBondContact O-CA 3.47Å; C299-R302 VanDerWaalsContact O-CB 3.31Å; C299-R302 WeakPolarHBondContact O-CB 3.14Å; C299-R302 PolarHBondContact O-N 2.7Å; G300-R302 PolarHBondContact O-N 3.49Å; R302-R319 VanDerWaalsContact CA-CZ 3.43Å; R302-R319 VanDerWaalsContact CA-NH2 3.34Å; R302-R319 WeakPolarHBondContact O-CD 3.15Å; R302-R319 WeakPolarHBondContact O-CG 3.31Å; R302-R319 PolarHBondContact O-NE 3.29Å; R302-R319 PolarHBondContact O-NH1 3.36Å; R302-R319 PolarHBondContact O-NH2 2.86Å
303	G	93.8	Very high	92.2	Very high	1 Å²	1	39 Å²	39	1%	0.01	20%	0.201	C	C	.	.			trans	65.3	-149.8	177.9	0	0	0	0	0	112	C299 G300 R301 A322	C299-G303 PolarHBondContact N-O 3.13Å; G300-G303 PolarHBondContact O-N 2.66Å; R301-G303 PolarHBondContact O-N 3.42Å; G303-A322 WeakPolarHBondContact CA-O 3.44Å
304	I	96.6	Very high	92	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	122.2	-178.8	-61.2	161.3	0	0	0	109	F296 A297 A298 R319 L320 A322 C325 M328 M337 T339	F296-I304 HydrophobicContact CB-CG2 3.79Å; F296-I304 HydrophobicContact CD1-CG2 3.91Å; F296-I304 HydrophobicContact CG-CG2 4.34Å; A297-I304 CarbonylContact O-C 3.53Å; A297-I304 WeakPolarHBondContact O-CA 2.99Å; A298-I304 HydrophobicContact CB-CG1 4.25Å; I304-R319 CarbonylContact O-C 3.49Å; I304-R319 VanDerWaalsContact O-CA 3.29Å; I304-R319 WeakPolarHBondContact O-CA 3.25Å; I304-L320 HydrophobicContact CB-CB 4.17Å; I304-L320 HydrophobicContact CB-CD1 4.38Å; I304-L320 HydrophobicContact CD1-CD1 4.44Å; I304-L320 HydrophobicContact CG2-CD1 4.39Å; I304-L320 PolarHBondContact N-O 3.42Å; I304-L320 PolarHBondContact O-N 2.82Å; I304-A322 HydrophobicContact CB-CB 4.38Å; I304-A322 HydrophobicContact CD1-CB 3.51Å; I304-A322 HydrophobicContact CG1-CB 3.72Å; I304-C325 HydrophobicContact CD1-CB 4.2Å; I304-C325 HydrophobicContact CG1-CB 4.09Å; I304-M328 HydrophobicContact CD1-CG 4.5Å; I304-M328 HydrophobicContact CD1-SD 3.67Å; I304-M328 HydrophobicContact CG1-SD 3.94Å; I304-M328 HydrophobicContact CG2-SD 3.97Å; I304-M337 HydrophobicContact CD1-SD 3.86Å; I304-T339 HydrophobicContact CD1-CG2 3.75Å
305	L	96.6	Very high	91.8	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	131.6	173.8	-54.3	-176.9	0	0	0	109.2	F296 A297 C299 F307 Y316 R319	F296-L305 CarbonylContact C-O 3.53Å; F296-L305 VanDerWaalsContact CA-O 3.31Å; F296-L305 WeakPolarHBondContact CA-O 3.29Å; A297-L305 PolarHBondContact N-O 3.08Å; A297-L305 PolarHBondContact O-N 2.66Å; C299-L305 HydrophobicContact CB-CD1 3.83Å; C299-L305 HydrophobicContact CB-CG 3.84Å; L305-F307 HydrophobicContact CB-CD2 4.48Å; L305-F307 HydrophobicContact CB-CE2 3.75Å; L305-F307 HydrophobicContact CB-CZ 4.07Å; L305-F307 HydrophobicContact CD1-CZ 4.12Å; L305-Y316 HydrophobicContact CB-CG 4.24Å; L305-Y316 HydrophobicContact CD1-CD1 4.1Å; L305-Y316 HydrophobicContact CD2-CD1 4Å; L305-Y316 HydrophobicContact CD2-CD2 4.29Å; L305-Y316 HydrophobicContact CD2-CE1 4.12Å; L305-Y316 HydrophobicContact CD2-CE2 4.42Å; L305-Y316 HydrophobicContact CD2-CG 4.09Å; L305-Y316 HydrophobicContact CG-CD1 4.44Å; L305-R319 HydrophobicContact CD2-CB 4.4Å; L305-R319 HydrophobicContact CD2-CG 4.36Å
306	A	95.7	Very high	91.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	118.3	176.1	0	0	0	0	0	109.7	V295 F296 Y316 S317 Y318	V295-A306 CarbonylContact O-C 3.54Å; V295-A306 WeakPolarHBondContact O-CA 3.01Å; F296-A306 HydrophobicContact CD1-CB 3.76Å; F296-A306 HydrophobicContact CE1-CB 3.57Å; F296-A306 HydrophobicContact CZ-CB 4.32Å; A306-Y316 CarbonylContact O-C 3.47Å; A306-Y316 WeakPolarHBondContact O-CA 3.32Å; A306-Y316 WeakPolarHBondContact O-CB 3.06Å; A306-S317 PolarHBondContact O-N 3.44Å; A306-Y318 HydrophobicContact CB-CD1 3.96Å; A306-Y318 HydrophobicContact CB-CD2 3.93Å; A306-Y318 HydrophobicContact CB-CE1 3.62Å; A306-Y318 HydrophobicContact CB-CE2 3.6Å; A306-Y318 HydrophobicContact CB-CG 4.1Å; A306-Y318 VanDerWaalsContact CB-CZ 3.41Å; A306-Y318 PolarHBondContact N-O 2.86Å; A306-Y318 PolarHBondContact O-N 3.35Å
307	F	96	Very high	91.7	Very high	3 Å²	3	51 Å²	51	1%	0.013	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	114.3	179.2	-59.8	-92.1	0	0	0	109.5	L277 E294 V295 A297 L305 L309 G314	L277-F307 HydrophobicContact CB-CD1 3.97Å; L277-F307 HydrophobicContact CB-CE1 3.91Å; L277-F307 HydrophobicContact CB-CE2 4.48Å; L277-F307 HydrophobicContact CB-CG 4.29Å; L277-F307 HydrophobicContact CB-CZ 4.18Å; L277-F307 HydrophobicContact CD1-CB 3.84Å; L277-F307 HydrophobicContact CD1-CD1 4.25Å; L277-F307 HydrophobicContact CD1-CD2 4.16Å; L277-F307 HydrophobicContact CD1-CG 3.84Å; L277-F307 HydrophobicContact CD2-CB 4.45Å; L277-F307 HydrophobicContact CD2-CD1 4.1Å; L277-F307 HydrophobicContact CD2-CG 4.44Å; L277-F307 HydrophobicContact CG-CD1 4.33Å; L277-F307 HydrophobicContact CG-CG 4.42Å; E294-F307 CarbonylContact C-O 3.52Å; E294-F307 VanDerWaalsContact CA-O 3.25Å; E294-F307 WeakPolarHBondContact CA-O 3.2Å; V295-F307 HydrophobicContact CB-CB 4.37Å; V295-F307 PolarHBondContact N-O 3.24Å; V295-F307 PolarHBondContact O-N 3.48Å; A297-F307 HydrophobicContact CB-CE2 3.93Å; L305-F307 HydrophobicContact CB-CD2 4.48Å; L305-F307 HydrophobicContact CB-CE2 3.75Å; L305-F307 HydrophobicContact CB-CZ 4.07Å; L305-F307 HydrophobicContact CD1-CZ 4.12Å; F307-L309 PolarHBondContact O-N 2.68Å; F307-G314 WeakPolarHBondContact CD1-O 3.12Å; F307-G314 WeakPolarHBondContact CE1-O 2.77Å
308	D	94.3	Very high	91.6	Very high	20 Å²	20	52.3 Å²	52.3	11%	0.107	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	111.1	168.7	-172.9	-23.3	0	0	0	109.1	R310 Q311 S317	D308-R310 PolarHBondContact O-N 3.05Å; D308-R310 VanDerWaalsContact O-N 3.11Å; D308-R310 WeakPolarHBondContact OD1-CB 3.4Å; D308-R310 WeakPolarHBondContact OD1-CG 3.41Å; D308-R310 IonicContact OD1-CZ 3.57Å; D308-R310 PolarHBondContact OD1-N 2.75Å; D308-R310 IonicContact OD1-NE 2.71Å; D308-R310 PolarHBondContact OD1-NE 3.13Å; D308-R310 IonicContact OD1-NH2 3.64Å; D308-R310 IonicContact OD2-CZ 2.84Å; D308-R310 IonicContact OD2-NE 2.94Å; D308-R310 PolarHBondContact OD2-NE 2.92Å; D308-R310 IonicContact OD2-NH2 3.34Å; D308-R310 PolarHBondContact OD2-NH2 2.8Å; D308-Q311 HydrophobicContact CB-CB 4.4Å; D308-Q311 HydrophobicContact CB-CG 3.92Å; D308-Q311 WeakPolarHBondContact O-CB 3.38Å; D308-Q311 PolarHBondContact O-N 3.44Å; D308-S317 WeakPolarHBondContact CB-OG 3.49Å; D308-S317 PolarHBondContact N-OG 3.49Å
309	L	93.1	Very high	91.6	Very high	21 Å²	21	57 Å²	57	11%	0.11	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-10.2	-176.5	-59	176.7	0	0	0	113.4	M265 Y275 L277 Y288 G293 V295 F307	M265-L309 HydrophobicContact CE-CD1 3.84Å; M265-L309 HydrophobicContact SD-CD1 3.38Å; M265-L309 WeakPolarHBondContact SD-CD1 3.18Å; M265-L309 HydrophobicContact SD-CD2 3.84Å; M265-L309 HydrophobicContact SD-CG 4.25Å; Y275-L309 HydrophobicContact CD1-CD2 4.06Å; Y275-L309 HydrophobicContact CD2-CD2 4.18Å; Y275-L309 HydrophobicContact CE1-CB 4.25Å; Y275-L309 HydrophobicContact CE1-CD2 4.22Å; Y275-L309 HydrophobicContact CE2-CB 4.44Å; Y275-L309 HydrophobicContact CE2-CD1 4.33Å; Y275-L309 HydrophobicContact CE2-CD2 4.36Å; Y275-L309 HydrophobicContact CG-CD2 4.04Å; Y275-L309 PolarHBondContact OH-O 2.79Å; L277-L309 HydrophobicContact CD1-CD2 3.95Å; L277-L309 HydrophobicContact CD2-CD2 4.44Å; Y288-L309 HydrophobicContact CD2-CD1 4.33Å; Y288-L309 HydrophobicContact CE2-CD1 3.9Å; G293-L309 VanDerWaalsContact O-CB 3.31Å; G293-L309 WeakPolarHBondContact O-CB 3.1Å; G293-L309 VanDerWaalsContact O-CG 3.28Å; G293-L309 WeakPolarHBondContact O-CG 3.38Å; G293-L309 PolarHBondContact O-N 3.16Å; V295-L309 HydrophobicContact CG2-CD1 4.07Å; V295-L309 HydrophobicContact CG2-CD2 4.04Å; V295-L309 HydrophobicContact CG2-CG 4.24Å; F307-L309 PolarHBondContact O-N 2.68Å
310	R	90.9	Very high	91.7	Very high	172 Å²	172	57 Å²	57	65%	0.649	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-18.2	174.3	-52.4	168.1	-66.6	-166.4	1.2	111.5	G292 D308	G292-R310 PolarHBondContact O-NE 3.05Å; G292-R310 PolarHBondContact O-NH2 3.16Å; D308-R310 PolarHBondContact O-N 3.05Å; D308-R310 VanDerWaalsContact O-N 3.11Å; D308-R310 WeakPolarHBondContact OD1-CB 3.4Å; D308-R310 WeakPolarHBondContact OD1-CG 3.41Å; D308-R310 IonicContact OD1-CZ 3.57Å; D308-R310 PolarHBondContact OD1-N 2.75Å; D308-R310 IonicContact OD1-NE 2.71Å; D308-R310 PolarHBondContact OD1-NE 3.13Å; D308-R310 IonicContact OD1-NH2 3.64Å; D308-R310 IonicContact OD2-CZ 2.84Å; D308-R310 IonicContact OD2-NE 2.94Å; D308-R310 PolarHBondContact OD2-NE 2.92Å; D308-R310 IonicContact OD2-NH2 3.34Å; D308-R310 PolarHBondContact OD2-NH2 2.8Å
311	Q	88.9	Confident	91.8	Very high	99 Å²	99	63.6 Å²	63.6	46%	0.463	31%	0.314	S	S	.	.	S	Bend	trans	-85.8	128.2	178	-66.3	-177	2.5	0	0	110.3	D308 S317	D308-Q311 HydrophobicContact CB-CB 4.4Å; D308-Q311 HydrophobicContact CB-CG 3.92Å; D308-Q311 WeakPolarHBondContact O-CB 3.38Å; D308-Q311 PolarHBondContact O-N 3.44Å; Q311-S317 VanDerWaalsContact CD-OG 3.31Å; Q311-S317 PolarHBondContact OE1-OG 3.47Å
312	P	80.2	Confident	92	Very high	129 Å²	129	56.4 Å²	56.4	84%	0.838	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	154.3	175.7	29.9	-34.3	0	0	0	111.2
313	G	81	Confident	92	Very high	65 Å²	65	54.2 Å²	54.2	67%	0.67	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.3	0.8	168.6	0	0	0	0	0	116.2	N315	G313-N315 PolarHBondContact O-N 2.88Å
314	G	83.9	Confident	91.8	Very high	21 Å²	21	57.8 Å²	57.8	22%	0.216	30%	0.303	C	S	.	.	S	Bend	trans	67.1	0.8	170.2	0	0	0	0	0	115.6	P278 F307	P278-G314 WeakPolarHBondContact CD-O 3.4Å; F307-G314 WeakPolarHBondContact CD1-O 3.12Å; F307-G314 WeakPolarHBondContact CE1-O 2.77Å
315	N	90.4	Very high	91.6	Very high	122 Å²	122	57.9 Å²	57.9	65%	0.652	30%	0.303	S	S	*	.			trans	-71.7	146.5	174.2	-69	-42.2	0	0	0	110.3	G313	G313-N315 PolarHBondContact O-N 2.88Å
316	Y	93.9	Very high	91.1	Very high	103 Å²	103	57.8 Å²	57.8	40%	0.404	30%	0.303	S	S	.	.			trans	-69.2	141.4	170.8	67.1	-93.6	0	0	0	110	L305 A306 Y318 R319	L305-Y316 HydrophobicContact CB-CG 4.24Å; L305-Y316 HydrophobicContact CD1-CD1 4.1Å; L305-Y316 HydrophobicContact CD2-CD1 4Å; L305-Y316 HydrophobicContact CD2-CD2 4.29Å; L305-Y316 HydrophobicContact CD2-CE1 4.12Å; L305-Y316 HydrophobicContact CD2-CE2 4.42Å; L305-Y316 HydrophobicContact CD2-CG 4.09Å; L305-Y316 HydrophobicContact CG-CD1 4.44Å; A306-Y316 CarbonylContact O-C 3.47Å; A306-Y316 WeakPolarHBondContact O-CA 3.32Å; A306-Y316 WeakPolarHBondContact O-CB 3.06Å; Y316-Y318 WeakPolarHBondContact CD2-O 3.39Å; Y316-R319 HydrophobicContact CE2-CB 4.35Å
317	S	94	Very high	90.7	Very high	40 Å²	40	58.7 Å²	58.7	28%	0.28	31%	0.309	S	S	.	.	S	Bend	trans	-81.1	-35.2	-177.5	-50.8	0	0	0	0	112.2	A306 D308 Q311	A306-S317 PolarHBondContact O-N 3.44Å; D308-S317 WeakPolarHBondContact CB-OG 3.49Å; D308-S317 PolarHBondContact N-OG 3.49Å; Q311-S317 VanDerWaalsContact CD-OG 3.31Å; Q311-S317 PolarHBondContact OE1-OG 3.47Å
318	Y	94.1	Very high	90.4	Very high	27 Å²	27	58.9 Å²	58.9	11%	0.106	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	173.7	172.5	62.1	-83.3	0	0	0	111	E294 F296 A306 Y316 L320 R354	E294-Y318 VanDerWaalsContact OE1-CE1 3.27Å; E294-Y318 WeakPolarHBondContact OE1-CE1 3.01Å; E294-Y318 PolarHBondContact OE1-OH 3.15Å; F296-Y318 HydrophobicContact CE1-CE2 4.26Å; F296-Y318 WeakPolarHBondContact CE1-OH 3.35Å; F296-Y318 WeakPolarHBondContact CZ-OH 3.23Å; A306-Y318 HydrophobicContact CB-CD1 3.96Å; A306-Y318 HydrophobicContact CB-CD2 3.93Å; A306-Y318 HydrophobicContact CB-CE1 3.62Å; A306-Y318 HydrophobicContact CB-CE2 3.6Å; A306-Y318 HydrophobicContact CB-CG 4.1Å; A306-Y318 VanDerWaalsContact CB-CZ 3.41Å; A306-Y318 PolarHBondContact N-O 2.86Å; A306-Y318 PolarHBondContact O-N 3.35Å; Y316-Y318 WeakPolarHBondContact CD2-O 3.39Å; Y318-L320 HydrophobicContact CD2-CD2 4.25Å; Y318-L320 HydrophobicContact CE2-CD2 3.97Å; Y318-L320 HydrophobicContact CE2-CG 4.49Å; Y318-R354 HydrophobicContact CD2-CG 4.4Å
319	R	94.6	Very high	90.1	Very high	98 Å²	98	60.3 Å²	60.3	37%	0.37	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	144	179.8	170.6	-175.4	162.1	159.6	11.3	109.9	R301 R302 I304 L305 Y316	R301-R319 PolarHBondContact O-NH2 3.3Å; R302-R319 VanDerWaalsContact CA-CZ 3.43Å; R302-R319 VanDerWaalsContact CA-NH2 3.34Å; R302-R319 WeakPolarHBondContact O-CD 3.15Å; R302-R319 WeakPolarHBondContact O-CG 3.31Å; R302-R319 PolarHBondContact O-NE 3.29Å; R302-R319 PolarHBondContact O-NH1 3.36Å; R302-R319 PolarHBondContact O-NH2 2.86Å; I304-R319 CarbonylContact O-C 3.49Å; I304-R319 VanDerWaalsContact O-CA 3.29Å; I304-R319 WeakPolarHBondContact O-CA 3.25Å; L305-R319 HydrophobicContact CD2-CB 4.4Å; L305-R319 HydrophobicContact CD2-CG 4.36Å; Y316-R319 HydrophobicContact CE2-CB 4.35Å
320	L	95.3	Very high	89.8	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	136.8	165.1	-51.3	177.2	0	0	0	109.7	F296 I304 Y318 A322 M337 Y349 R354	F296-L320 HydrophobicContact CD1-CD1 4.44Å; F296-L320 HydrophobicContact CE1-CD1 4.41Å; I304-L320 HydrophobicContact CB-CB 4.17Å; I304-L320 HydrophobicContact CB-CD1 4.38Å; I304-L320 HydrophobicContact CD1-CD1 4.44Å; I304-L320 HydrophobicContact CG2-CD1 4.39Å; I304-L320 PolarHBondContact N-O 3.42Å; I304-L320 PolarHBondContact O-N 2.82Å; Y318-L320 HydrophobicContact CD2-CD2 4.25Å; Y318-L320 HydrophobicContact CE2-CD2 3.97Å; Y318-L320 HydrophobicContact CE2-CG 4.49Å; L320-A322 HydrophobicContact CB-CB 4.4Å; L320-A322 PolarHBondContact O-N 3.24Å; L320-M337 HydrophobicContact CD1-CE 3.75Å; L320-M337 HydrophobicContact CD1-SD 4.22Å; L320-Y349 HydrophobicContact CB-CD1 4.4Å; L320-Y349 HydrophobicContact CB-CE1 4.29Å; L320-Y349 HydrophobicContact CD1-CD1 4.27Å; L320-R354 HydrophobicContact CD2-CB 3.83Å; L320-R354 HydrophobicContact CD2-CG 4.15Å
321	E	92.9	Very high	89.7	Confident	156 Å²	156	53.1 Å²	53.1	73%	0.729	29%	0.29	S	S	*	.	S	Bend	trans	-73	80.9	174	-66.7	-172.7	169.8	0	0	110.1	Y349	E321-Y349 PolarHBondContact O-OH 3.25Å
322	A	93.2	Very high	89.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.307	C	S	.	.			trans	-138.2	52.2	-171.6	0	0	0	0	0	111.5	G303 I304 L320 C325 Y349	G303-A322 WeakPolarHBondContact CA-O 3.44Å; I304-A322 HydrophobicContact CB-CB 4.38Å; I304-A322 HydrophobicContact CD1-CB 3.51Å; I304-A322 HydrophobicContact CG1-CB 3.72Å; L320-A322 HydrophobicContact CB-CB 4.4Å; L320-A322 PolarHBondContact O-N 3.24Å; A322-C325 WeakPolarHBondContact O-CB 3.39Å; A322-C325 PolarHBondContact O-N 2.97Å; A322-Y349 WeakPolarHBondContact CA-OH 3.23Å; A322-Y349 HydrophobicContact CB-CE1 4.1Å; A322-Y349 HydrophobicContact CB-CE2 4.27Å; A322-Y349 VanDerWaalsContact CB-OH 3.28Å; A322-Y349 WeakPolarHBondContact CB-OH 3.36Å
323	P	91.4	Very high	89.3	Confident	61 Å²	61	56 Å²	56	40%	0.396	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	146.9	-173.8	28.8	-36	0	0	0	110.9	G300 C325 H341	G300-P323 WeakPolarHBondContact O-CA 2.99Å; P323-C325 PolarHBondContact O-N 2.9Å; P323-C325 VanDerWaalsContact O-N 3.11Å; P323-H341 PolarHBondContact O-ND1 3.45Å
324	H	90.8	Very high	89.3	Confident	76 Å²	76	54.8 Å²	54.8	35%	0.352	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	23.6	177.1	-54.6	-66.5	0	0	0	114.5	G300 R301 H341 F342	G300-H324 PolarHBondContact O-N 3.22Å; R301-H324 VanDerWaalsContact CG-CE1 3.4Å; R301-H324 WeakPolarHBondContact CG-CE1 3.49Å; H324-H341 CarbonylContact O-C 3.56Å; H324-H341 VanDerWaalsContact O-CA 3.27Å; H324-H341 WeakPolarHBondContact O-CA 3.31Å; H324-F342 HydrophobicContact CB-CB 4.17Å; H324-F342 HydrophobicContact CB-CD2 3.98Å; H324-F342 HydrophobicContact CB-CG 4.49Å; H324-F342 PolarHBondContact O-N 2.79Å
325	C	91.6	Very high	89.5	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.007	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	137.2	168.9	179.7	0	0	0	0	110.1	A298 I304 A322 P323 S327 S340 H341	A298-C325 HydrophobicContact CB-CB 3.82Å; A298-C325 WeakPolarHBondContact CB-O 3.24Å; I304-C325 HydrophobicContact CD1-CB 4.2Å; I304-C325 HydrophobicContact CG1-CB 4.09Å; A322-C325 WeakPolarHBondContact O-CB 3.39Å; A322-C325 PolarHBondContact O-N 2.97Å; P323-C325 PolarHBondContact O-N 2.9Å; P323-C325 VanDerWaalsContact O-N 3.11Å; C325-S327 PolarHBondContact SG-O 2.84Å; C325-S340 CarbonylContact C-O 3.52Å; C325-S340 WeakPolarHBondContact CA-O 2.89Å; C325-H341 PolarHBondContact N-ND1 3.05Å
326	C	87.5	Confident	89.5	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	-17	-173.1	70.3	0	0	0	0	115.3	Q284 S340 F342 T370	Q284-C326 HydrophobicContact CG-CB 4.33Å; C326-S340 PolarHBondContact N-O 2.94Å; C326-S340 PolarHBondContact SG-O 2.98Å; C326-S340 VanDerWaalsContact SG-O 3.33Å; C326-S340 PolarHBondContact SG-OG 3.49Å; C326-F342 HydrophobicContact CB-CD1 3.91Å; C326-F342 HydrophobicContact CB-CE1 3Å; C326-F342 HydrophobicContact CB-CE2 3.94Å; C326-F342 HydrophobicContact CB-CZ 3Å; C326-F342 VanDerWaalsContact SG-CE1 3.56Å; C326-T370 HydrophobicContact CB-CG2 4.33Å; C326-T370 WeakPolarHBondContact O-CG2 3.11Å
327	S	86.2	Confident	89.5	Confident	18 Å²	18	50.8 Å²	50.8	13%	0.126	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	147.8	170.6	-168.3	0	0	0	0	108.6	C325 T339 S340	C325-S327 PolarHBondContact SG-O 2.84Å; S327-T339 VanDerWaalsContact O-CA 3.31Å; S327-T339 WeakPolarHBondContact O-CA 3.26Å; S327-S340 WeakPolarHBondContact CB-OG 3.33Å; S327-S340 PolarHBondContact N-O 2.89Å; S327-S340 PolarHBondContact N-OG 2.83Å; S327-S340 PolarHBondContact O-N 2.81Å
328	M	89.2	Confident	89.5	Confident	7 Å²	7	49 Å²	49	3%	0.034	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	138.8	179.5	-63.4	-169.4	-76.6	0	0	109.6	A285 V287 F296 A298 I304 M337 V338 T339	A285-M328 VanDerWaalsContact C-CE 3.4Å; A285-M328 HydrophobicContact CB-CB 4.5Å; A285-M328 HydrophobicContact CB-CE 3.71Å; A285-M328 HydrophobicContact CB-CG 4.06Å; A285-M328 WeakPolarHBondContact O-CE 3.15Å; V287-M328 HydrophobicContact CG1-CB 3.83Å; V287-M328 HydrophobicContact CG2-CB 4.25Å; V287-M328 HydrophobicContact CG2-CE 4.14Å; V287-M328 HydrophobicContact CG2-SD 4.33Å; F296-M328 HydrophobicContact CB-CE 4.31Å; F296-M328 HydrophobicContact CB-SD 4.37Å; A298-M328 HydrophobicContact CB-CE 4.09Å; A298-M328 HydrophobicContact CB-SD 4.48Å; I304-M328 HydrophobicContact CD1-CG 4.5Å; I304-M328 HydrophobicContact CD1-SD 3.67Å; I304-M328 HydrophobicContact CG1-SD 3.94Å; I304-M328 HydrophobicContact CG2-SD 3.97Å; M328-M337 HydrophobicContact SD-SD 4.05Å; M328-V338 CarbonylContact C-O 3.55Å; M328-V338 WeakPolarHBondContact CA-O 3.38Å; M328-T339 HydrophobicContact CG-CG2 4.2Å
329	Q	88.8	Confident	89.5	Confident	51 Å²	51	47.7 Å²	47.7	24%	0.238	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	118.1	170.3	-66.7	-63.8	-53.7	0	0	108	M337 V338 V373 L375	Q329-M337 CarbonylContact O-C 3.09Å; Q329-M337 VanDerWaalsContact O-CA 3.26Å; Q329-M337 WeakPolarHBondContact O-CA 3.36Å; Q329-V338 HydrophobicContact CB-CB 4.49Å; Q329-V338 PolarHBondContact N-O 2.82Å; Q329-V338 PolarHBondContact O-N 3.09Å; Q329-V373 HydrophobicContact CG-CG1 4.3Å; Q329-L375 HydrophobicContact CB-CD1 4.06Å; Q329-L375 HydrophobicContact CB-CG 4.33Å
330	L	86.7	Confident	89.4	Confident	36 Å²	36	43 Å²	43	19%	0.188	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	142.2	172	-67	176.9	0	0	0	109.8	V287 Y288 K289 M337 F351	V287-L330 HydrophobicContact CB-CD1 3.68Å; V287-L330 HydrophobicContact CB-CG 3.77Å; V287-L330 HydrophobicContact CG1-CG 4.31Å; V287-L330 HydrophobicContact CG2-CD1 3.76Å; V287-L330 HydrophobicContact CG2-CD2 3.81Å; V287-L330 HydrophobicContact CG2-CG 3.62Å; Y288-L330 WeakPolarHBondContact O-CD1 3.09Å; K289-L330 HydrophobicContact CB-CD1 4Å; L330-M337 HydrophobicContact CD2-CB 3.95Å; L330-M337 HydrophobicContact CD2-CE 4.38Å; L330-F351 HydrophobicContact CD2-CE1 4.49Å; L330-F351 HydrophobicContact CD2-CE2 4.34Å; L330-F351 HydrophobicContact CD2-CZ 3.6Å
331	L	88	Confident	89.1	Confident	5 Å²	5	43.3 Å²	43.3	3%	0.026	20%	0.2	C	C	.	.			trans	-86.8	148.1	167.3	-78.3	80.9	0	0	0	110.2	N333 D334 H336 V338 L375 E379 F396	L331-N333 WeakPolarHBondContact CB-OD1 3.29Å; L331-N333 PolarHBondContact O-N 3.45Å; L331-D334 PolarHBondContact O-N 3Å; L331-H336 HydrophobicContact CB-CB 4.43Å; L331-H336 HydrophobicContact CD1-CB 3.95Å; L331-H336 HydrophobicContact CD2-CB 4.21Å; L331-H336 HydrophobicContact CG-CB 4.42Å; L331-H336 PolarHBondContact N-O 3.03Å; L331-H336 VanDerWaalsContact N-O 3.09Å; L331-V338 HydrophobicContact CD1-CG2 4.18Å; L331-L375 HydrophobicContact CD1-CD1 3.75Å; L331-L375 HydrophobicContact CD1-CD2 4.48Å; L331-L375 HydrophobicContact CG-CD1 3.78Å; L331-E379 WeakPolarHBondContact CA-OE1 3.28Å; L331-E379 HydrophobicContact CD2-CB 4.31Å; L331-F396 HydrophobicContact CD1-CE2 3.81Å; L331-F396 HydrophobicContact CD1-CZ 4.06Å; L331-F396 HydrophobicContact CD2-CD1 4.07Å; L331-F396 HydrophobicContact CD2-CD2 4.16Å; L331-F396 HydrophobicContact CD2-CE1 3.47Å; L331-F396 VanDerWaalsContact CD2-CE1 3.47Å; L331-F396 HydrophobicContact CD2-CE2 3.58Å; L331-F396 HydrophobicContact CD2-CG 4.41Å; L331-F396 HydrophobicContact CD2-CZ 3.21Å; L331-F396 HydrophobicContact CG-CE2 4.32Å; L331-F396 HydrophobicContact CG-CZ 4.29Å
332	R	81.4	Confident	88.9	Confident	213 Å²	213	37.7 Å²	37.7	80%	0.804	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-21.1	174.9	-74	168.8	-172.5	-95.1	1.1	113.1	D334 E379	R332-D334 PolarHBondContact O-N 2.81Å; R332-D334 VanDerWaalsContact O-N 3.16Å; R332-E379 WeakPolarHBondContact CB-OE1 3.46Å; R332-E379 WeakPolarHBondContact CG-OE1 3.02Å; R332-E379 PolarHBondContact N-OE1 2.76Å; R332-E379 PolarHBondContact N-OE2 3.27Å
333	N	81.2	Confident	88.3	Confident	76 Å²	76	40.6 Å²	40.6	41%	0.406	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-4.7	172.8	68.8	25.4	0	0	0	113.7	L331 R335 H336	L331-N333 WeakPolarHBondContact CB-OD1 3.29Å; L331-N333 PolarHBondContact O-N 3.45Å; N333-R335 PolarHBondContact O-N 3.12Å; N333-R335 PolarHBondContact OD1-N 3.24Å; N333-H336 PolarHBondContact ND2-ND1 2.88Å; N333-H336 VanDerWaalsContact ND2-ND1 3.19Å; N333-H336 PolarHBondContact OD1-N 3.11Å; N333-H336 VanDerWaalsContact OD1-N 3.12Å; N333-H336 PolarHBondContact OD1-ND1 2.94Å
334	D	79.8	Confident	88	Confident	39 Å²	39	38.4 Å²	38.4	21%	0.209	19%	0.191	C	C	.	.	S	Bend	trans	57	16.3	176.6	-151.2	60.3	0	0	0	114.4	K289 M291 L331 R332 F351	K289-D334 WeakPolarHBondContact CE-O 3.44Å; K289-D334 WeakPolarHBondContact CE-OD2 3.38Å; K289-D334 WeakPolarHBondContact CG-OD1 3.37Å; K289-D334 IonicContact NZ-OD1 3.62Å; K289-D334 IonicContact NZ-OD2 3.34Å; K289-D334 PolarHBondContact NZ-OD2 3.04Å; M291-D334 WeakPolarHBondContact CB-OD2 3.28Å; L331-D334 PolarHBondContact O-N 3Å; R332-D334 PolarHBondContact O-N 2.81Å; R332-D334 VanDerWaalsContact O-N 3.16Å; D334-F351 VanDerWaalsContact O-CD2 3.32Å; D334-F351 WeakPolarHBondContact O-CD2 3.27Å; D334-F351 WeakPolarHBondContact O-CE2 3.38Å
335	R	87.6	Confident	87.9	Confident	129 Å²	129	39.2 Å²	39.2	49%	0.487	20%	0.199	S	C	.	.	S	Bend	trans	-118.2	-28.9	-173.8	-179.3	174.1	171.7	177.1	-2.7	112.3	N333 D350 F351	N333-R335 PolarHBondContact O-N 3.12Å; N333-R335 PolarHBondContact OD1-N 3.24Å; R335-D350 IonicContact CZ-OD2 3.8Å; R335-D350 IonicContact NE-OD2 3.45Å; R335-D350 PolarHBondContact NE-OD2 3.34Å; R335-D350 IonicContact NH2-OD2 3.54Å; R335-D350 PolarHBondContact NH2-OD2 2.87Å; R335-D350 WeakPolarHBondContact O-CA 3.46Å; R335-F351 VanDerWaalsContact C-CD2 3.45Å; R335-F351 VanDerWaalsContact O-CD2 3.29Å; R335-F351 WeakPolarHBondContact O-CD2 3.46Å; R335-F351 WeakPolarHBondContact O-CG 3.45Å; R335-F351 PolarHBondContact O-N 3.02Å
336	H	92	Very high	88.1	Confident	34 Å²	34	39.3 Å²	39.3	16%	0.157	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	152.6	-174.8	-57.5	89.9	0	0	0	112.1	L331 N333 Y349 D350 F396	L331-H336 HydrophobicContact CB-CB 4.43Å; L331-H336 HydrophobicContact CD1-CB 3.95Å; L331-H336 HydrophobicContact CD2-CB 4.21Å; L331-H336 HydrophobicContact CG-CB 4.42Å; L331-H336 PolarHBondContact N-O 3.03Å; L331-H336 VanDerWaalsContact N-O 3.09Å; N333-H336 PolarHBondContact ND2-ND1 2.88Å; N333-H336 VanDerWaalsContact ND2-ND1 3.19Å; N333-H336 PolarHBondContact OD1-N 3.11Å; N333-H336 VanDerWaalsContact OD1-N 3.12Å; N333-H336 PolarHBondContact OD1-ND1 2.94Å; H336-Y349 CarbonylContact C-O 3.55Å; H336-Y349 WeakPolarHBondContact CA-O 3.25Å; H336-D350 IonicContact NE2-OD2 2.71Å; H336-F396 HydrophobicContact CB-CZ 4.1Å
337	M	93.6	Very high	88.5	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	149.6	163.6	70.8	170.1	72.3	0	0	110.5	F296 I304 L320 M328 Q329 L330 T339 A348 Y349 F351	F296-M337 HydrophobicContact CB-CE 4.2Å; F296-M337 HydrophobicContact CD1-CE 3.52Å; F296-M337 HydrophobicContact CD2-CE 4.25Å; F296-M337 HydrophobicContact CE1-CE 3.88Å; F296-M337 HydrophobicContact CG-CE 3.72Å; F296-M337 HydrophobicContact CZ-CE 4.41Å; I304-M337 HydrophobicContact CD1-SD 3.86Å; L320-M337 HydrophobicContact CD1-CE 3.75Å; L320-M337 HydrophobicContact CD1-SD 4.22Å; M328-M337 HydrophobicContact SD-SD 4.05Å; Q329-M337 CarbonylContact O-C 3.09Å; Q329-M337 VanDerWaalsContact O-CA 3.26Å; Q329-M337 WeakPolarHBondContact O-CA 3.36Å; L330-M337 HydrophobicContact CD2-CB 3.95Å; L330-M337 HydrophobicContact CD2-CE 4.38Å; M337-T339 HydrophobicContact CG-CG2 3.86Å; M337-T339 HydrophobicContact SD-CG2 3.51Å; M337-T339 VanDerWaalsContact SD-CG2 3.51Å; M337-A348 CarbonylContact O-C 3.18Å; M337-A348 WeakPolarHBondContact O-CA 3.45Å; M337-Y349 HydrophobicContact CG-CG 4.48Å; M337-Y349 PolarHBondContact N-O 3.17Å; M337-Y349 PolarHBondContact O-N 3.28Å; M337-F351 HydrophobicContact CB-CE1 3.79Å; M337-F351 HydrophobicContact CB-CZ 3.85Å; M337-F351 HydrophobicContact CE-CD1 4.06Å; M337-F351 HydrophobicContact CE-CE1 3.22Å; M337-F351 HydrophobicContact CE-CZ 3.92Å; M337-F351 HydrophobicContact CG-CE1 3.69Å; M337-F351 HydrophobicContact CG-CZ 4.27Å; M337-F351 HydrophobicContact SD-CE1 4.2Å
338	V	94.5	Very high	88.9	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	135.9	164.9	178.1	0	0	0	0	108.7	M328 Q329 L331 L346 L347 Y360 V373 L375 V382 F396	M328-V338 CarbonylContact C-O 3.55Å; M328-V338 WeakPolarHBondContact CA-O 3.38Å; Q329-V338 HydrophobicContact CB-CB 4.49Å; Q329-V338 PolarHBondContact N-O 2.82Å; Q329-V338 PolarHBondContact O-N 3.09Å; L331-V338 HydrophobicContact CD1-CG2 4.18Å; V338-L346 HydrophobicContact CG1-CD1 3.9Å; V338-L346 HydrophobicContact CG1-CG 4.35Å; V338-L347 CarbonylContact C-O 3.58Å; V338-L347 WeakPolarHBondContact CA-O 3.15Å; V338-Y360 HydrophobicContact CG1-CE2 4.15Å; V338-Y360 HydrophobicContact CG2-CE2 4.16Å; V338-V373 HydrophobicContact CG1-CG1 4.12Å; V338-L375 HydrophobicContact CG2-CD2 4.13Å; V338-V382 HydrophobicContact CG1-CG1 3.93Å; V338-V382 HydrophobicContact CG2-CG2 3.91Å; V338-F396 HydrophobicContact CG2-CD2 4.17Å; V338-F396 HydrophobicContact CG2-CE2 3.87Å
339	T	93.6	Very high	89.2	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	135.3	-175.7	53.4	0	0	0	0	109.7	I304 S327 M328 M337 H341 L346 L347 Y349	I304-T339 HydrophobicContact CD1-CG2 3.75Å; S327-T339 VanDerWaalsContact O-CA 3.31Å; S327-T339 WeakPolarHBondContact O-CA 3.26Å; M328-T339 HydrophobicContact CG-CG2 4.2Å; M337-T339 HydrophobicContact CG-CG2 3.86Å; M337-T339 HydrophobicContact SD-CG2 3.51Å; M337-T339 VanDerWaalsContact SD-CG2 3.51Å; T339-H341 PolarHBondContact OG1-NE2 2.71Å; T339-H341 VanDerWaalsContact OG1-NE2 3.1Å; T339-L346 CarbonylContact O-C 3.5Å; T339-L346 VanDerWaalsContact O-CA 3.31Å; T339-L346 WeakPolarHBondContact O-CA 3.31Å; T339-L347 PolarHBondContact N-O 3.44Å; T339-L347 PolarHBondContact O-N 2.7Å; T339-L347 PolarHBondContact OG1-O 2.91Å; T339-Y349 HydrophobicContact CG2-CD2 3.83Å; T339-Y349 HydrophobicContact CG2-CE2 4.11Å; T339-Y349 WeakPolarHBondContact OG1-CD2 2.97Å; T339-Y349 WeakPolarHBondContact OG1-CE2 3.37Å
340	S	91.8	Very high	89.3	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	149.7	165.5	64.4	0	0	0	0	110.3	C325 C326 S327 N345	C325-S340 CarbonylContact C-O 3.52Å; C325-S340 WeakPolarHBondContact CA-O 2.89Å; C326-S340 PolarHBondContact N-O 2.94Å; C326-S340 PolarHBondContact SG-O 2.98Å; C326-S340 VanDerWaalsContact SG-O 3.33Å; C326-S340 PolarHBondContact SG-OG 3.49Å; S327-S340 WeakPolarHBondContact CB-OG 3.33Å; S327-S340 PolarHBondContact N-O 2.89Å; S327-S340 PolarHBondContact N-OG 2.83Å; S327-S340 PolarHBondContact O-N 2.81Å; S340-N345 CarbonylContact C-O 3.51Å; S340-N345 WeakPolarHBondContact CA-O 3.3Å
341	H	90.3	Very high	89.4	Confident	6 Å²	6	36.1 Å²	36.1	3%	0.028	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	153.2	-175.9	-59.5	-109.8	0	0	0	111.7	P323 H324 C325 T339 G343 G344 N345 N365	P323-H341 PolarHBondContact O-ND1 3.45Å; H324-H341 CarbonylContact O-C 3.56Å; H324-H341 VanDerWaalsContact O-CA 3.27Å; H324-H341 WeakPolarHBondContact O-CA 3.31Å; C325-H341 PolarHBondContact N-ND1 3.05Å; T339-H341 PolarHBondContact OG1-NE2 2.71Å; T339-H341 VanDerWaalsContact OG1-NE2 3.1Å; H341-G343 PolarHBondContact O-N 2.88Å; H341-G344 PolarHBondContact O-N 3.47Å; H341-N345 HydrophobicContact CB-CB 4.15Å; H341-N345 PolarHBondContact CD2-O 3.29Å; H341-N345 PolarHBondContact N-O 2.93Å; H341-N365 PolarHBondContact O-ND2 3.31Å
342	F	87.1	Confident	89.5	Confident	38 Å²	38	46.4 Å²	46.4	17%	0.167	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	131.2	161.3	-49	-43.3	0	0	0	108.7	N90 Q284 H324 C326	N90-F342 HydrophobicContact CB-CE1 3.74Å; N90-F342 HydrophobicContact CB-CE2 4.25Å; N90-F342 HydrophobicContact CB-CZ 3.27Å; N90-F342 WeakPolarHBondContact ND2-CE1 3Å; N90-F342 WeakPolarHBondContact ND2-CE2 3.43Å; N90-F342 WeakPolarHBondContact ND2-CZ 3.32Å; N90-F342 WeakPolarHBondContact OD1-CE1 3.34Å; N90-F342 WeakPolarHBondContact OD1-CZ 2.74Å; Q284-F342 HydrophobicContact CG-CE2 4.16Å; Q284-F342 HydrophobicContact CG-CZ 3.92Å; H324-F342 HydrophobicContact CB-CB 4.17Å; H324-F342 HydrophobicContact CB-CD2 3.98Å; H324-F342 HydrophobicContact CB-CG 4.49Å; H324-F342 PolarHBondContact O-N 2.79Å; C326-F342 HydrophobicContact CB-CD1 3.91Å; C326-F342 HydrophobicContact CB-CE1 3Å; C326-F342 HydrophobicContact CB-CE2 3.94Å; C326-F342 HydrophobicContact CB-CZ 3Å; C326-F342 VanDerWaalsContact SG-CE1 3.56Å
343	G	82.2	Confident	90	Very high	62 Å²	62	40.3 Å²	40.3	64%	0.639	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	100.9	1.3	-172.8	0	0	0	0	0	114.6	H341 N365	H341-G343 PolarHBondContact O-N 2.88Å; G343-N365 CarbonylContact C-O 3.57Å; G343-N365 WeakPolarHBondContact CA-O 3.27Å; G343-N365 PolarHBondContact N-O 3.32Å
344	G	84	Confident	90.5	Very high	14 Å²	14	43 Å²	43	14%	0.144	21%	0.206	C	C	.	.	S	Bend	trans	97.3	-0.1	164.6	0	0	0	0	0	116.2	H341 L346 H363 N365	H341-G344 PolarHBondContact O-N 3.47Å; G344-L346 PolarHBondContact O-N 3.23Å; G344-H363 PolarHBondContact O-CD2 2.89Å; G344-N365 PolarHBondContact N-O 3.49Å
345	N	89.6	Confident	91	Very high	94 Å²	94	48.4 Å²	48.4	50%	0.503	22%	0.224	S	C	.	.			trans	-75	129.8	175.2	-66.4	-37.1	0	0	0	110.8	S340 H341 L347	S340-N345 CarbonylContact C-O 3.51Å; S340-N345 WeakPolarHBondContact CA-O 3.3Å; H341-N345 HydrophobicContact CB-CB 4.15Å; H341-N345 PolarHBondContact CD2-O 3.29Å; H341-N345 PolarHBondContact N-O 2.93Å; N345-L347 HydrophobicContact CB-CD1 4.18Å; N345-L347 HydrophobicContact CB-CD2 4.2Å; N345-L347 HydrophobicContact CB-CG 3.99Å
346	L	95.3	Very high	91.3	Very high	3 Å²	3	45 Å²	45	2%	0.016	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	108.8	166.6	-175	67.9	0	0	0	106.4	V338 T339 G344 Y360 H363 V373 V382 A384 W394	V338-L346 HydrophobicContact CG1-CD1 3.9Å; V338-L346 HydrophobicContact CG1-CG 4.35Å; T339-L346 CarbonylContact O-C 3.5Å; T339-L346 VanDerWaalsContact O-CA 3.31Å; T339-L346 WeakPolarHBondContact O-CA 3.31Å; G344-L346 PolarHBondContact O-N 3.23Å; L346-Y360 HydrophobicContact CB-CD2 4.42Å; L346-Y360 HydrophobicContact CD2-CD2 4.19Å; L346-Y360 HydrophobicContact CD2-CG 4.26Å; L346-Y360 HydrophobicContact CG-CD2 3.82Å; L346-Y360 HydrophobicContact CG-CG 4.32Å; L346-Y360 WeakPolarHBondContact O-CD2 3.47Å; L346-Y360 PolarHBondContact O-N 3.37Å; L346-H363 HydrophobicContact CB-CB 3.93Å; L346-H363 HydrophobicContact CD2-CB 4.37Å; L346-V373 HydrophobicContact CD1-CG1 4Å; L346-V373 HydrophobicContact CD1-CG2 3.97Å; L346-V382 HydrophobicContact CD2-CG1 4.03Å; L346-A384 HydrophobicContact CD2-CB 3.82Å; L346-W394 HydrophobicContact CD2-CE3 4.08Å; L346-W394 HydrophobicContact CD2-CH2 3.8Å; L346-W394 HydrophobicContact CD2-CZ3 3.59Å
347	L	95.7	Very high	91.5	Very high	22 Å²	22	45.6 Å²	45.6	12%	0.115	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	143.8	-166.1	-55.4	177.5	0	0	0	111.3	V338 T339 N345 Y349 P356 D358 A359	V338-L347 CarbonylContact C-O 3.58Å; V338-L347 WeakPolarHBondContact CA-O 3.15Å; T339-L347 PolarHBondContact N-O 3.44Å; T339-L347 PolarHBondContact O-N 2.7Å; T339-L347 PolarHBondContact OG1-O 2.91Å; N345-L347 HydrophobicContact CB-CD1 4.18Å; N345-L347 HydrophobicContact CB-CD2 4.2Å; N345-L347 HydrophobicContact CB-CG 3.99Å; L347-Y349 HydrophobicContact CB-CD2 4.17Å; L347-Y349 HydrophobicContact CB-CE2 3.77Å; L347-Y349 HydrophobicContact CD1-CE2 4.01Å; L347-P356 HydrophobicContact CB-CB 4.26Å; L347-P356 HydrophobicContact CD1-CB 4.09Å; L347-P356 HydrophobicContact CD1-CG 4.47Å; L347-D358 WeakPolarHBondContact CA-O 2.82Å; L347-A359 HydrophobicContact CD2-CB 3.52Å
348	A	95.5	Very high	91.6	Very high	2 Å²	2	49 Å²	49	2%	0.017	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	133.6	164.5	0	0	0	0	0	109.4	M337 P356 V357 D358 Y360 F396	M337-A348 CarbonylContact O-C 3.18Å; M337-A348 WeakPolarHBondContact O-CA 3.45Å; A348-P356 CarbonylContact O-C 3.57Å; A348-P356 VanDerWaalsContact O-CA 3.28Å; A348-P356 WeakPolarHBondContact O-CA 3.41Å; A348-V357 HydrophobicContact CB-CG2 4.12Å; A348-V357 WeakPolarHBondContact O-CG2 2.91Å; A348-V357 PolarHBondContact O-N 3.24Å; A348-D358 HydrophobicContact CB-CB 4.08Å; A348-D358 PolarHBondContact N-O 2.94Å; A348-D358 PolarHBondContact O-N 3.21Å; A348-Y360 HydrophobicContact CB-CE2 4.03Å; A348-F396 HydrophobicContact CB-CE2 4.46Å
349	Y	94.3	Very high	91.6	Very high	4 Å²	4	51 Å²	51	2%	0.016	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	142.5	175.8	-81.4	-102.3	0	0	0	109.9	L320 E321 A322 H336 M337 T339 L347 R355 P356	L320-Y349 HydrophobicContact CB-CD1 4.4Å; L320-Y349 HydrophobicContact CB-CE1 4.29Å; L320-Y349 HydrophobicContact CD1-CD1 4.27Å; E321-Y349 PolarHBondContact O-OH 3.25Å; A322-Y349 WeakPolarHBondContact CA-OH 3.23Å; A322-Y349 HydrophobicContact CB-CE1 4.1Å; A322-Y349 HydrophobicContact CB-CE2 4.27Å; A322-Y349 VanDerWaalsContact CB-OH 3.28Å; A322-Y349 WeakPolarHBondContact CB-OH 3.36Å; H336-Y349 CarbonylContact C-O 3.55Å; H336-Y349 WeakPolarHBondContact CA-O 3.25Å; M337-Y349 HydrophobicContact CG-CG 4.48Å; M337-Y349 PolarHBondContact N-O 3.17Å; M337-Y349 PolarHBondContact O-N 3.28Å; T339-Y349 HydrophobicContact CG2-CD2 3.83Å; T339-Y349 HydrophobicContact CG2-CE2 4.11Å; T339-Y349 WeakPolarHBondContact OG1-CD2 2.97Å; T339-Y349 WeakPolarHBondContact OG1-CE2 3.37Å; L347-Y349 HydrophobicContact CB-CD2 4.17Å; L347-Y349 HydrophobicContact CB-CE2 3.77Å; L347-Y349 HydrophobicContact CD1-CE2 4.01Å; Y349-R355 VanDerWaalsContact CD1-C 3.48Å; Y349-P356 HydrophobicContact CD2-CB 4.47Å; Y349-P356 HydrophobicContact CE1-CB 4.23Å; Y349-P356 VanDerWaalsContact CE1-CD 3.5Å; Y349-P356 HydrophobicContact CE1-CG 4.36Å; Y349-P356 HydrophobicContact CE2-CB 4.13Å
350	D	91.4	Very high	91.7	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	126.8	166.5	174.3	-54.1	0	0	0	108.5	R335 H336 R352 M353 R354 V357	R335-D350 IonicContact CZ-OD2 3.8Å; R335-D350 IonicContact NE-OD2 3.45Å; R335-D350 PolarHBondContact NE-OD2 3.34Å; R335-D350 IonicContact NH2-OD2 3.54Å; R335-D350 PolarHBondContact NH2-OD2 2.87Å; R335-D350 WeakPolarHBondContact O-CA 3.46Å; H336-D350 IonicContact NE2-OD2 2.71Å; D350-R352 VanDerWaalsContact C-N 3.32Å; D350-R352 PolarHBondContact O-N 3.04Å; D350-R352 VanDerWaalsContact OD1-CA 3.31Å; D350-R352 WeakPolarHBondContact OD1-CA 3.44Å; D350-R352 VanDerWaalsContact OD1-CB 3.22Å; D350-R352 WeakPolarHBondContact OD1-CB 3.23Å; D350-R352 PolarHBondContact OD1-N 3.27Å; D350-M353 HydrophobicContact CB-CB 4.27Å; D350-M353 HydrophobicContact CB-CE 3.76Å; D350-M353 HydrophobicContact CB-CG 4.48Å; D350-M353 PolarHBondContact O-N 3.27Å; D350-M353 PolarHBondContact OD1-N 3.41Å; D350-R354 PolarHBondContact O-N 2.85Å; D350-V357 HydrophobicContact CB-CG1 3.61Å; D350-V357 HydrophobicContact CB-CG2 4.41Å
351	F	89	Confident	91.8	Very high	17 Å²	17	59 Å²	59	8%	0.075	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-29.1	-175.3	-54.2	-35.6	0	0	0	113.9	K289 F296 L330 D334 R335 M337 R354	K289-F351 HydrophobicContact CD-CD2 3.97Å; K289-F351 HydrophobicContact CD-CE2 3.74Å; K289-F351 VanDerWaalsContact CE-CD2 3.48Å; F296-F351 HydrophobicContact CE1-CD1 4.41Å; F296-F351 HydrophobicContact CZ-CD1 4.3Å; F296-F351 HydrophobicContact CZ-CE1 4.38Å; L330-F351 HydrophobicContact CD2-CE1 4.49Å; L330-F351 HydrophobicContact CD2-CE2 4.34Å; L330-F351 HydrophobicContact CD2-CZ 3.6Å; D334-F351 VanDerWaalsContact O-CD2 3.32Å; D334-F351 WeakPolarHBondContact O-CD2 3.27Å; D334-F351 WeakPolarHBondContact O-CE2 3.38Å; R335-F351 VanDerWaalsContact C-CD2 3.45Å; R335-F351 VanDerWaalsContact O-CD2 3.29Å; R335-F351 WeakPolarHBondContact O-CD2 3.46Å; R335-F351 WeakPolarHBondContact O-CG 3.45Å; R335-F351 PolarHBondContact O-N 3.02Å; M337-F351 HydrophobicContact CB-CE1 3.79Å; M337-F351 HydrophobicContact CB-CZ 3.85Å; M337-F351 HydrophobicContact CE-CD1 4.06Å; M337-F351 HydrophobicContact CE-CE1 3.22Å; M337-F351 HydrophobicContact CE-CZ 3.92Å; M337-F351 HydrophobicContact CG-CE1 3.69Å; M337-F351 HydrophobicContact CG-CZ 4.27Å; M337-F351 HydrophobicContact SD-CE1 4.2Å; F351-R354 WeakPolarHBondContact O-CG 3.27Å
352	R	89.5	Confident	92	Very high	220 Å²	220	64.9 Å²	64.9	83%	0.83	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-40.9	176.4	-178.8	179.3	177.1	149.3	0.4	110.4	D350	D350-R352 VanDerWaalsContact C-N 3.32Å; D350-R352 PolarHBondContact O-N 3.04Å; D350-R352 VanDerWaalsContact OD1-CA 3.31Å; D350-R352 WeakPolarHBondContact OD1-CA 3.44Å; D350-R352 VanDerWaalsContact OD1-CB 3.22Å; D350-R352 WeakPolarHBondContact OD1-CB 3.23Å; D350-R352 PolarHBondContact OD1-N 3.27Å
353	M	91.2	Very high	92.3	Very high	85 Å²	85	63.7 Å²	63.7	42%	0.419	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-19.3	178.2	-66.3	-168	-100.5	0	0	113.5	D350 R355 V357	D350-M353 HydrophobicContact CB-CB 4.27Å; D350-M353 HydrophobicContact CB-CE 3.76Å; D350-M353 HydrophobicContact CB-CG 4.48Å; D350-M353 PolarHBondContact O-N 3.27Å; D350-M353 PolarHBondContact OD1-N 3.41Å; M353-R355 HydrophobicContact CB-CG 4.02Å; M353-R355 PolarHBondContact O-N 2.94Å; M353-R355 VanDerWaalsContact O-N 3.12Å; M353-V357 HydrophobicContact CE-CB 4.43Å; M353-V357 HydrophobicContact CE-CG1 3.32Å; M353-V357 HydrophobicContact SD-CG1 4.04Å
354	R	91.8	Very high	92.7	Very high	132 Å²	132	62.6 Å²	62.6	50%	0.498	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	24.3	179.4	-59.2	-177.7	177.5	-178.8	-2	114.8	Y318 L320 D350 F351	Y318-R354 HydrophobicContact CD2-CG 4.4Å; L320-R354 HydrophobicContact CD2-CB 3.83Å; L320-R354 HydrophobicContact CD2-CG 4.15Å; D350-R354 PolarHBondContact O-N 2.85Å; F351-R354 WeakPolarHBondContact O-CG 3.27Å
355	R	91.3	Very high	92.8	Very high	154 Å²	154	62 Å²	62	58%	0.581	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.1	159.9	-178.3	69.6	-178.1	-179.8	-178.7	-0.1	109.7	Y349 M353 V357	Y349-R355 VanDerWaalsContact CD1-C 3.48Å; M353-R355 HydrophobicContact CB-CG 4.02Å; M353-R355 PolarHBondContact O-N 2.94Å; M353-R355 VanDerWaalsContact O-N 3.12Å; R355-V357 PolarHBondContact O-N 2.73Å
356	P	94.3	Very high	92.4	Very high	57 Å²	57	63.1 Å²	63.1	37%	0.37	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	137.9	171.6	27.3	-33.6	0	0	0	109.8	L347 A348 Y349	L347-P356 HydrophobicContact CB-CB 4.26Å; L347-P356 HydrophobicContact CD1-CB 4.09Å; L347-P356 HydrophobicContact CD1-CG 4.47Å; A348-P356 CarbonylContact O-C 3.57Å; A348-P356 VanDerWaalsContact O-CA 3.28Å; A348-P356 WeakPolarHBondContact O-CA 3.41Å; Y349-P356 HydrophobicContact CD2-CB 4.47Å; Y349-P356 HydrophobicContact CE1-CB 4.23Å; Y349-P356 VanDerWaalsContact CE1-CD 3.5Å; Y349-P356 HydrophobicContact CE1-CG 4.36Å; Y349-P356 HydrophobicContact CE2-CB 4.13Å
357	V	95.1	Very high	91.8	Very high	47 Å²	47	64.5 Å²	64.5	29%	0.285	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-27.9	178.9	-64.5	0	0	0	0	112.1	A348 D350 M353 R355	A348-V357 HydrophobicContact CB-CG2 4.12Å; A348-V357 WeakPolarHBondContact O-CG2 2.91Å; A348-V357 PolarHBondContact O-N 3.24Å; D350-V357 HydrophobicContact CB-CG1 3.61Å; D350-V357 HydrophobicContact CB-CG2 4.41Å; M353-V357 HydrophobicContact CE-CB 4.43Å; M353-V357 HydrophobicContact CE-CG1 3.32Å; M353-V357 HydrophobicContact SD-CG1 4.04Å; R355-V357 PolarHBondContact O-N 2.73Å
358	D	95.7	Very high	91	Very high	70 Å²	70	67.7 Å²	67.7	37%	0.374	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	160.6	176.8	-81.1	-56.7	0	0	0	111.6	L347 A348 A399	L347-D358 WeakPolarHBondContact CA-O 2.82Å; A348-D358 HydrophobicContact CB-CB 4.08Å; A348-D358 PolarHBondContact N-O 2.94Å; A348-D358 PolarHBondContact O-N 3.21Å; D358-A399 HydrophobicContact CB-CB 4.49Å
359	A	95.9	Very high	90.4	Very high	43 Å²	43	69.5 Å²	69.5	36%	0.355	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	125.4	177.1	0	0	0	0	0	111	L347 K361	L347-A359 HydrophobicContact CD2-CB 3.52Å; A359-K361 PolarHBondContact O-N 2.94Å; A359-K361 VanDerWaalsContact O-N 3.14Å
360	Y	95.7	Very high	89.4	Confident	4 Å²	4	69.4 Å²	69.4	2%	0.016	33%	0.333	C	S	.	.			trans	-84.6	88.3	178.9	-57	-74.1	0	0	0	109.8	V338 L346 A348 V382 W394 F396 A399	V338-Y360 HydrophobicContact CG1-CE2 4.15Å; V338-Y360 HydrophobicContact CG2-CE2 4.16Å; L346-Y360 HydrophobicContact CB-CD2 4.42Å; L346-Y360 HydrophobicContact CD2-CD2 4.19Å; L346-Y360 HydrophobicContact CD2-CG 4.26Å; L346-Y360 HydrophobicContact CG-CD2 3.82Å; L346-Y360 HydrophobicContact CG-CG 4.32Å; L346-Y360 WeakPolarHBondContact O-CD2 3.47Å; L346-Y360 PolarHBondContact O-N 3.37Å; A348-Y360 HydrophobicContact CB-CE2 4.03Å; Y360-V382 HydrophobicContact CE1-CB 4.39Å; Y360-V382 HydrophobicContact CE1-CG2 3.87Å; Y360-V382 HydrophobicContact CE2-CG2 3.93Å; Y360-W394 HydrophobicContact CD1-CB 3.63Å; Y360-W394 AromaticContact CD1-CG 3.9Å; Y360-W394 HydrophobicContact CD1-CG 3.9Å; Y360-W394 HydrophobicContact CE1-CB 4.28Å; Y360-W394 HydrophobicContact CG-CB 4.48Å; Y360-W394 HydrophobicContact CG-CG 4.36Å; Y360-F396 WeakPolarHBondContact OH-CD2 3.17Å; Y360-F396 VanDerWaalsContact OH-CE2 3.29Å; Y360-F396 WeakPolarHBondContact OH-CE2 3.46Å; Y360-F396 PolarHBondContact OH-O 3.26Å; Y360-F396 VanDerWaalsContact OH-O 3.09Å; Y360-A399 HydrophobicContact CD1-CB 3.88Å; Y360-A399 HydrophobicContact CE1-CB 4.01Å
361	K	94	Very high	89.1	Confident	166 Å²	166	69.5 Å²	69.5	72%	0.722	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	159.2	-174.5	-63.5	-178.7	-177.6	176.1	0	112.3	A359 H363 W394	A359-K361 PolarHBondContact O-N 2.94Å; A359-K361 VanDerWaalsContact O-N 3.14Å; K361-H363 PolarHBondContact O-N 2.78Å; K361-W394 PolarHBondContact O-NE1 3.33Å
362	Q	93.2	Very high	88.9	Confident	128 Å²	128	69.8 Å²	69.8	60%	0.598	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	-0.7	-178	-45.6	179.9	22.5	0	0	115.4	V364 R392	Q362-V364 PolarHBondContact O-N 3.39Å; Q362-R392 WeakPolarHBondContact O-CD 3.31Å; Q362-R392 PolarHBondContact O-NE 2.86Å; Q362-R392 PolarHBondContact O-NH2 3.37Å
363	H	93	Very high	88.9	Confident	14 Å²	14	59.7 Å²	59.7	7%	0.065	30%	0.3	C	S	.	.			trans	-60.5	136.8	166	-176.2	69.4	0	0	0	109.7	G344 L346 K361 A385 W394	G344-H363 PolarHBondContact O-CD2 2.89Å; L346-H363 HydrophobicContact CB-CB 3.93Å; L346-H363 HydrophobicContact CD2-CB 4.37Å; K361-H363 PolarHBondContact O-N 2.78Å; H363-A385 PolarHBondContact CE1-O 2.72Å; H363-A385 VanDerWaalsContact CE1-O 3.25Å; H363-W394 HydrophobicContact CB-CH2 3.89Å; H363-W394 HydrophobicContact CB-CZ2 3.94Å; H363-W394 AromaticContact ND1-CH2 3.93Å
364	V	90.6	Very high	88.7	Confident	38 Å²	38	56.6 Å²	56.6	23%	0.23	29%	0.286	C	S	.	.			trans	-119.4	112.2	-177	-177.8	0	0	0	0	108.5	Q362 T366 G386 S387 D388	Q362-V364 PolarHBondContact O-N 3.39Å; V364-T366 HydrophobicContact CG1-CG2 4.05Å; V364-G386 CarbonylContact O-C 3.52Å; V364-G386 WeakPolarHBondContact O-CA 3.18Å; V364-S387 PolarHBondContact O-N 2.77Å; V364-S387 PolarHBondContact O-OG 3.38Å; V364-D388 HydrophobicContact CB-CB 4.4Å; V364-D388 HydrophobicContact CG1-CB 4.2Å
365	N	86.8	Confident	88.4	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	27%	0.268	C	S	.	.			trans	-136.5	74.2	168.1	-165.9	8.7	0	0	0	109.8	H341 G343 G344 T367 W369 L371	H341-N365 PolarHBondContact O-ND2 3.31Å; G343-N365 CarbonylContact C-O 3.57Å; G343-N365 WeakPolarHBondContact CA-O 3.27Å; G343-N365 PolarHBondContact N-O 3.32Å; G344-N365 PolarHBondContact N-O 3.49Å; N365-T367 PolarHBondContact O-N 2.82Å; N365-T367 PolarHBondContact OD1-O 2.86Å; N365-T367 PolarHBondContact OD1-OG1 3.23Å; N365-W369 PolarHBondContact ND2-O 2.84Å; N365-W369 VanDerWaalsContact ND2-O 3.13Å; N365-W369 PolarHBondContact OD1-O 3.14Å; N365-L371 HydrophobicContact CB-CD1 3.61Å; N365-L371 WeakPolarHBondContact OD1-CD1 3.4Å
366	T	81.8	Confident	88	Confident	119 Å²	119	44.3 Å²	44.3	73%	0.73	24%	0.241	S	C	*	.			trans	-78.8	-6.3	177.6	51.7	0	0	0	0	113	V364 S387	V364-T366 HydrophobicContact CG1-CG2 4.05Å; T366-S387 PolarHBondContact N-OG 3.5Å; T366-S387 PolarHBondContact OG1-OG 3.13Å
367	T	81.2	Confident	87.1	Confident	32 Å²	32	43.5 Å²	43.5	20%	0.196	23%	0.234	C	C	.	.	S	Bend	trans	-106.9	165.3	-177.5	51.5	0	0	0	0	110.8	N365 W369 S387	N365-T367 PolarHBondContact O-N 2.82Å; N365-T367 PolarHBondContact OD1-O 2.86Å; N365-T367 PolarHBondContact OD1-OG1 3.23Å; T367-W369 HydrophobicContact CG2-CD2 4.02Å; T367-W369 HydrophobicContact CG2-CE3 3.93Å; T367-W369 HydrophobicContact CG2-CH2 4.16Å; T367-W369 HydrophobicContact CG2-CZ2 4.27Å; T367-W369 HydrophobicContact CG2-CZ3 3.99Å; T367-W369 PolarHBondContact O-N 3.03Å; T367-S387 WeakPolarHBondContact OG1-CB 3.37Å
368	N	79.9	Confident	86.4	Confident	89 Å²	89	45.2 Å²	45.2	48%	0.476	24%	0.235	S	C	.	.	S	Bend	trans	-88.5	44.5	165.7	-66.9	-19.4	0	0	0	110.3	I88 N90	I88-N368 HydrophobicContact CG2-CB 4.34Å; N90-N368 VanDerWaalsContact ND2-C 3.33Å; N90-N368 PolarHBondContact ND2-O 2.84Å; N90-N368 VanDerWaalsContact OD1-C 3.24Å; N90-N368 PolarHBondContact OD1-O 3.1Å
369	W	82.2	Confident	85.8	Confident	39 Å²	39	43.4 Å²	43.4	15%	0.148	22%	0.224	C	C	.	.			trans	-103.8	151.2	173.5	-59.9	-25.3	0	0	0	109.5	N90 N365 T367 L371 V411 R412 E414 V417	N90-W369 WeakPolarHBondContact OD1-CA 3.46Å; N90-W369 PolarHBondContact OD1-N 3.21Å; N90-W369 PolarHBondContact OD1-O 2.85Å; N365-W369 PolarHBondContact ND2-O 2.84Å; N365-W369 VanDerWaalsContact ND2-O 3.13Å; N365-W369 PolarHBondContact OD1-O 3.14Å; T367-W369 HydrophobicContact CG2-CD2 4.02Å; T367-W369 HydrophobicContact CG2-CE3 3.93Å; T367-W369 HydrophobicContact CG2-CH2 4.16Å; T367-W369 HydrophobicContact CG2-CZ2 4.27Å; T367-W369 HydrophobicContact CG2-CZ3 3.99Å; T367-W369 PolarHBondContact O-N 3.03Å; W369-L371 HydrophobicContact CB-CD2 4.2Å; W369-V411 HydrophobicContact CE3-CG1 4.49Å; W369-V411 HydrophobicContact CH2-CG1 4.02Å; W369-V411 HydrophobicContact CZ3-CG1 3.5Å; W369-R412 WeakPolarHBondContact CH2-O 3.43Å; W369-E414 HydrophobicContact CB-CG 4.07Å; W369-E414 HydrophobicContact CD2-CB 3.91Å; W369-E414 HydrophobicContact CD2-CG 4.32Å; W369-E414 HydrophobicContact CG-CB 3.9Å; W369-E414 HydrophobicContact CG-CG 3.94Å; W369-V417 HydrophobicContact CE3-CG2 3.84Å; W369-V417 HydrophobicContact CZ3-CG2 4.17Å
370	T	73.3	Confident	85.3	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.018	22%	0.215	C	C	.	.			trans	-97.8	128.3	175.2	-59.1	0	0	0	0	107.7	N90 L91 C326 E414	N90-T370 VanDerWaalsContact C-OG1 3.31Å; N90-T370 VanDerWaalsContact CA-OG1 3.23Å; N90-T370 WeakPolarHBondContact CA-OG1 3.28Å; N90-T370 WeakPolarHBondContact CB-OG1 3.4Å; N90-T370 WeakPolarHBondContact OD1-CA 3.32Å; N90-T370 PolarHBondContact OD1-N 2.82Å; N90-T370 PolarHBondContact OD1-OG1 2.86Å; L91-T370 VanDerWaalsContact CB-CB 3.41Å; L91-T370 HydrophobicContact CB-CG2 3.52Å; L91-T370 HydrophobicContact CD1-CG2 4.23Å; L91-T370 VanDerWaalsContact CD1-O 3.23Å; L91-T370 WeakPolarHBondContact CD1-O 2.89Å; L91-T370 HydrophobicContact CG-CG2 4.29Å; L91-T370 PolarHBondContact N-OG1 3.01Å; L91-T370 WeakPolarHBondContact O-CG2 3.4Å; L91-T370 PolarHBondContact O-OG1 2.8Å; C326-T370 HydrophobicContact CB-CG2 4.33Å; C326-T370 WeakPolarHBondContact O-CG2 3.11Å; T370-E414 PolarHBondContact N-OE1 3.18Å
371	L	85.6	Confident	85	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	21%	0.214	C	C	.	.			trans	-105.8	140.2	-171.3	-53.8	175.3	0	0	0	108.1	N365 W369 V373 A385 V417	N365-L371 HydrophobicContact CB-CD1 3.61Å; N365-L371 WeakPolarHBondContact OD1-CD1 3.4Å; W369-L371 HydrophobicContact CB-CD2 4.2Å; L371-V373 PolarHBondContact O-N 3.46Å; L371-A385 VanDerWaalsContact CB-O 3.22Å; L371-A385 WeakPolarHBondContact CB-O 3.5Å; L371-A385 WeakPolarHBondContact CD1-O 3.49Å; L371-V417 HydrophobicContact CD2-CB 4.48Å; L371-V417 HydrophobicContact CD2-CG1 3.77Å; L371-V417 HydrophobicContact CD2-CG2 3.92Å
372	P	84.8	Confident	84.9	Confident	24 Å²	24	35.2 Å²	35.2	16%	0.156	18%	0.18	C	C	.	.			trans	-60.7	131	175.6	23.1	-32.2	0	0	0	110.2	A384 A385 P418 F420	P372-A384 VanDerWaalsContact O-CA 3.28Å; P372-A384 WeakPolarHBondContact O-CA 3.18Å; P372-A385 HydrophobicContact CG-CB 3.67Å; P372-A385 PolarHBondContact O-N 2.93Å; P372-P418 WeakPolarHBondContact CG-O 3.27Å; P372-F420 HydrophobicContact CB-CD1 4.49Å; P372-F420 HydrophobicContact CB-CE1 3.98Å; P372-F420 HydrophobicContact CG-CD1 4.18Å; P372-F420 HydrophobicContact CG-CE1 3.8Å
373	V	89.6	Confident	84.9	Confident	8 Å²	8	29.1 Å²	29.1	5%	0.048	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	133	172.6	-176.8	0	0	0	0	107.6	Q329 V338 L346 L371 V382 A383 A384	Q329-V373 HydrophobicContact CG-CG1 4.3Å; V338-V373 HydrophobicContact CG1-CG1 4.12Å; L346-V373 HydrophobicContact CD1-CG1 4Å; L346-V373 HydrophobicContact CD1-CG2 3.97Å; L371-V373 PolarHBondContact O-N 3.46Å; V373-V382 HydrophobicContact CG1-CG1 4.22Å; V373-A383 CarbonylContact C-O 3.51Å; V373-A383 WeakPolarHBondContact CA-O 3.33Å; V373-A384 HydrophobicContact CG2-CB 4Å
374	T	86.3	Confident	85	Confident	20 Å²	20	28.5 Å²	28.5	12%	0.123	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	143.6	179.4	65.6	0	0	0	0	110.5	A383 F420	T374-A383 PolarHBondContact N-O 3.2Å; T374-A383 PolarHBondContact O-N 3.45Å; T374-F420 HydrophobicContact CG2-CE2 4.28Å; T374-F420 WeakPolarHBondContact OG1-CE2 3.44Å
375	L	85	Confident	85.1	Confident	24 Å²	24	26.7 Å²	26.7	13%	0.126	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	150.4	160.6	-66	163.3	0	0	0	108.9	Q329 L331 V338 T381 V382 F396	Q329-L375 HydrophobicContact CB-CD1 4.06Å; Q329-L375 HydrophobicContact CB-CG 4.33Å; L331-L375 HydrophobicContact CD1-CD1 3.75Å; L331-L375 HydrophobicContact CD1-CD2 4.48Å; L331-L375 HydrophobicContact CG-CD1 3.78Å; V338-L375 HydrophobicContact CG2-CD2 4.13Å; L375-T381 WeakPolarHBondContact CA-O 3.31Å; L375-V382 HydrophobicContact CD2-CG2 3.83Å; L375-F396 HydrophobicContact CD2-CD2 4.29Å
376	D	83.8	Confident	85.4	Confident	4 Å²	4	26.6 Å²	26.6	2%	0.021	14%	0.137	C	C	.	.			trans	-69.5	169.8	164.2	74.3	-69	0	0	0	111.1	R378 E379 R380 T381 D424	D376-R378 PolarHBondContact O-N 2.99Å; D376-R378 WeakPolarHBondContact OD2-CA 3.39Å; D376-R378 WeakPolarHBondContact OD2-CB 3.31Å; D376-R378 PolarHBondContact OD2-N 2.83Å; D376-E379 PolarHBondContact O-N 3.11Å; D376-E379 WeakPolarHBondContact OD1-CA 3.41Å; D376-E379 PolarHBondContact OD1-N 2.95Å; D376-E379 PolarHBondContact OD2-N 2.79Å; D376-R380 PolarHBondContact OD1-N 2.75Å; D376-T381 VanDerWaalsContact CB-OG1 3.28Å; D376-T381 WeakPolarHBondContact CB-OG1 3.41Å; D376-T381 VanDerWaalsContact CG-OG1 3.28Å; D376-T381 PolarHBondContact N-O 2.8Å; D376-T381 PolarHBondContact OD1-N 3.34Å; D376-T381 PolarHBondContact OD1-OG1 2.94Å; D376-D424 HydrophobicContact CB-CB 4.28Å; D376-D424 WeakPolarHBondContact OD2-CB 3.11Å
377	N	75.5	Confident	85.9	Confident	40 Å²	40	21.4 Å²	21.4	21%	0.214	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.7	-176.6	61.2	-61.6	0	0	0	114.8	Y151 D424	Y151-N377 HydrophobicContact CD1-CB 4.37Å; Y151-N377 HydrophobicContact CD2-CB 4.1Å; Y151-N377 HydrophobicContact CE1-CB 4.04Å; Y151-N377 HydrophobicContact CE2-CB 3.76Å; Y151-N377 HydrophobicContact CG-CB 4.39Å; N377-D424 PolarHBondContact OD1-N 2.85Å
378	R	80.1	Confident	86.5	Confident	82 Å²	82	22.7 Å²	22.7	31%	0.309	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	1.8	173.8	-67.3	177.6	166.1	170.1	-10.4	112.8	D376 R380 D424 N425	D376-R378 PolarHBondContact O-N 2.99Å; D376-R378 WeakPolarHBondContact OD2-CA 3.39Å; D376-R378 WeakPolarHBondContact OD2-CB 3.31Å; D376-R378 PolarHBondContact OD2-N 2.83Å; R378-R380 HydrophobicContact CB-CG 3.99Å; R378-R380 PolarHBondContact O-N 2.99Å; R378-D424 IonicContact NH1-OD2 3.7Å; R378-D424 PolarHBondContact NH1-OD2 2.98Å; R378-N425 PolarHBondContact NH2-ND2 3.28Å; R378-N425 VanDerWaalsContact NH2-ND2 3.18Å
379	E	83.3	Confident	87.1	Confident	32 Å²	32	18.4 Å²	18.4	15%	0.15	9%	0.089	C	C	.	.	S	Bend	trans	57.1	31.7	178.3	-51.3	-177.2	156.9	0	0	114.1	L331 R332 D376	L331-E379 WeakPolarHBondContact CA-OE1 3.28Å; L331-E379 HydrophobicContact CD2-CB 4.31Å; R332-E379 WeakPolarHBondContact CB-OE1 3.46Å; R332-E379 WeakPolarHBondContact CG-OE1 3.02Å; R332-E379 PolarHBondContact N-OE1 2.76Å; R332-E379 PolarHBondContact N-OE2 3.27Å; D376-E379 PolarHBondContact O-N 3.11Å; D376-E379 WeakPolarHBondContact OD1-CA 3.41Å; D376-E379 PolarHBondContact OD1-N 2.95Å; D376-E379 PolarHBondContact OD2-N 2.79Å
380	R	84.9	Confident	87.7	Confident	41 Å²	41	17.4 Å²	17.4	16%	0.155	9%	0.086	C	C	.	.	S	Bend	trans	-95.3	-14.9	178	-57.9	-177.3	174.4	-178.5	-3.6	112.9	D376 R378 F396 Y453 D459	D376-R380 PolarHBondContact OD1-N 2.75Å; R378-R380 HydrophobicContact CB-CG 3.99Å; R378-R380 PolarHBondContact O-N 2.99Å; R380-F396 WeakPolarHBondContact O-CB 3.5Å; R380-F396 PolarHBondContact O-N 3.4Å; R380-Y453 HydrophobicContact CB-CE1 3.95Å; R380-Y453 HydrophobicContact CB-CE2 4.14Å; R380-Y453 VanDerWaalsContact CB-CZ 3.44Å; R380-Y453 WeakPolarHBondContact CB-OH 3.14Å; R380-Y453 PolarHBondContact O-OH 3.45Å; R380-D459 IonicContact CZ-OD1 3.59Å; R380-D459 IonicContact CZ-OD2 2.71Å; R380-D459 VanDerWaalsContact CZ-OD2 3.26Å; R380-D459 IonicContact NH1-OD2 3.74Å; R380-D459 PolarHBondContact NH1-OD2 2.84Å; R380-D459 IonicContact NH2-OD1 3.64Å; R380-D459 PolarHBondContact NH2-OD1 3.49Å; R380-D459 IonicContact NH2-OD2 4Å; R380-D459 PolarHBondContact NH2-OD2 2.71Å
381	T	90.3	Very high	88.7	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	149.4	178.6	58.5	0	0	0	0	111.8	L375 D376 I393 W394 L402 H422 Y453	L375-T381 WeakPolarHBondContact CA-O 3.31Å; D376-T381 VanDerWaalsContact CB-OG1 3.28Å; D376-T381 WeakPolarHBondContact CB-OG1 3.41Å; D376-T381 VanDerWaalsContact CG-OG1 3.28Å; D376-T381 PolarHBondContact N-O 2.8Å; D376-T381 PolarHBondContact OD1-N 3.34Å; D376-T381 PolarHBondContact OD1-OG1 2.94Å; T381-I393 HydrophobicContact CG2-CG2 4.07Å; T381-W394 CarbonylContact C-O 3.58Å; T381-W394 WeakPolarHBondContact CA-O 3.46Å; T381-W394 WeakPolarHBondContact CB-O 3.34Å; T381-L402 HydrophobicContact CG2-CD1 4.12Å; T381-H422 PolarHBondContact OG1-CE1 2.84Å; T381-H422 PolarHBondContact OG1-ND1 2.8Å; T381-Y453 WeakPolarHBondContact CG2-OH 3.15Å
382	V	92.6	Very high	89.1	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.9	166	-177.5	0	0	0	0	107.5	V338 L346 Y360 V373 L375 I393 W394 F396	V338-V382 HydrophobicContact CG1-CG1 3.93Å; V338-V382 HydrophobicContact CG2-CG2 3.91Å; L346-V382 HydrophobicContact CD2-CG1 4.03Å; Y360-V382 HydrophobicContact CE1-CB 4.39Å; Y360-V382 HydrophobicContact CE1-CG2 3.87Å; Y360-V382 HydrophobicContact CE2-CG2 3.93Å; V373-V382 HydrophobicContact CG1-CG1 4.22Å; L375-V382 HydrophobicContact CD2-CG2 3.83Å; V382-I393 CarbonylContact O-C 3.5Å; V382-I393 VanDerWaalsContact O-CA 3.32Å; V382-I393 WeakPolarHBondContact O-CA 3.43Å; V382-W394 PolarHBondContact N-O 2.95Å; V382-W394 PolarHBondContact O-N 3.18Å; V382-F396 HydrophobicContact CG2-CB 4.32Å; V382-F396 HydrophobicContact CG2-CD2 3.8Å
383	A	92.9	Very high	89.5	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.008	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	136.6	171.6	0	0	0	0	0	110.3	V373 T374 R392 I393 F420 H422	V373-A383 CarbonylContact C-O 3.51Å; V373-A383 WeakPolarHBondContact CA-O 3.33Å; T374-A383 PolarHBondContact N-O 3.2Å; T374-A383 PolarHBondContact O-N 3.45Å; A383-R392 CarbonylContact C-O 3.6Å; A383-R392 VanDerWaalsContact CA-O 3.23Å; A383-R392 WeakPolarHBondContact CA-O 3.29Å; A383-I393 HydrophobicContact CB-CG1 4.03Å; A383-F420 HydrophobicContact CB-CE2 3.56Å; A383-F420 HydrophobicContact CB-CZ 4.05Å; A383-H422 HydrophobicContact CB-CB 4.12Å
384	A	94.3	Very high	89.7	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	142.1	178.5	0	0	0	0	0	111.7	L346 P372 V373 I391 R392 W394	L346-A384 HydrophobicContact CD2-CB 3.82Å; P372-A384 VanDerWaalsContact O-CA 3.28Å; P372-A384 WeakPolarHBondContact O-CA 3.18Å; V373-A384 HydrophobicContact CG2-CB 4Å; A384-I391 WeakPolarHBondContact O-CA 3.27Å; A384-R392 PolarHBondContact N-O 3.24Å; A384-R392 PolarHBondContact O-N 2.89Å; A384-W394 HydrophobicContact CB-CH2 4.26Å; A384-W394 HydrophobicContact CB-CZ3 3.83Å
385	A	93.5	Very high	89.9	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	142.5	166.9	0	0	0	0	0	109.7	H363 L371 P372 I391 V417 P418 F420	H363-A385 PolarHBondContact CE1-O 2.72Å; H363-A385 VanDerWaalsContact CE1-O 3.25Å; L371-A385 VanDerWaalsContact CB-O 3.22Å; L371-A385 WeakPolarHBondContact CB-O 3.5Å; L371-A385 WeakPolarHBondContact CD1-O 3.49Å; P372-A385 HydrophobicContact CG-CB 3.67Å; P372-A385 PolarHBondContact O-N 2.93Å; A385-I391 HydrophobicContact CB-CG1 4.29Å; A385-V417 HydrophobicContact CB-CG1 3.89Å; A385-P418 HydrophobicContact CB-CG 3.99Å; A385-F420 HydrophobicContact CB-CD1 4.44Å; A385-F420 HydrophobicContact CB-CE1 3.94Å
386	G	93.2	Very high	90.2	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.075	C	C	.	.			trans	-93.3	160.7	168.9	0	0	0	0	0	112.4	V364 D388 G389 V390	V364-G386 CarbonylContact O-C 3.52Å; V364-G386 WeakPolarHBondContact O-CA 3.18Å; G386-D388 VanDerWaalsContact CA-OD1 3.31Å; G386-D388 WeakPolarHBondContact CA-OD1 3.14Å; G386-D388 PolarHBondContact O-N 3.45Å; G386-G389 PolarHBondContact O-N 3.21Å; G386-V390 PolarHBondContact N-O 3.15Å
387	S	91.8	Very high	90.6	Very high	9 Å²	9	20.2 Å²	20.2	6%	0.063	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.9	168.6	62.7	0	0	0	0	112.2	V364 T366 T367 G389	V364-S387 PolarHBondContact O-N 2.77Å; V364-S387 PolarHBondContact O-OG 3.38Å; T366-S387 PolarHBondContact N-OG 3.5Å; T366-S387 PolarHBondContact OG1-OG 3.13Å; T367-S387 WeakPolarHBondContact OG1-CB 3.37Å; S387-G389 VanDerWaalsContact C-N 3.27Å
388	D	93.5	Very high	91.4	Very high	59 Å²	59	22.3 Å²	22.3	32%	0.316	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-1.3	171.5	66.4	-14.2	0	0	0	114.1	V364 G386 V390 R392	V364-D388 HydrophobicContact CB-CB 4.4Å; V364-D388 HydrophobicContact CG1-CB 4.2Å; G386-D388 VanDerWaalsContact CA-OD1 3.31Å; G386-D388 WeakPolarHBondContact CA-OD1 3.14Å; G386-D388 PolarHBondContact O-N 3.45Å; D388-V390 VanDerWaalsContact C-N 3.32Å; D388-V390 PolarHBondContact OD1-N 3.28Å; D388-V390 VanDerWaalsContact OD1-N 3.16Å; D388-R392 IonicContact OD1-NH1 2.75Å; D388-R392 PolarHBondContact OD1-NH1 3.17Å; D388-R392 VanDerWaalsContact OD1-NH1 3.08Å; D388-R392 IonicContact OD2-CZ 3Å; D388-R392 IonicContact OD2-NH1 2.77Å; D388-R392 PolarHBondContact OD2-NH1 3.11Å; D388-R392 VanDerWaalsContact OD2-NH1 3.13Å; D388-R392 IonicContact OD2-NH2 2.73Å; D388-R392 PolarHBondContact OD2-NH2 3.47Å
389	G	93.4	Very high	92.1	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.104	C	C	.	.	S	Bend	trans	81.2	7.1	-179.2	0	0	0	0	0	114.7	G386 S387 S407 V411	G386-G389 PolarHBondContact O-N 3.21Å; S387-G389 VanDerWaalsContact C-N 3.27Å; G389-S407 WeakPolarHBondContact O-CB 3.42Å; G389-S407 PolarHBondContact O-N 2.91Å; G389-S407 PolarHBondContact O-OG 3.48Å; G389-V411 VanDerWaalsContact CA-CG2 3.42Å
390	V	94.7	Very high	92.6	Very high	17 Å²	17	23.6 Å²	23.6	10%	0.103	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	123.7	179.9	-176.6	0	0	0	0	110	G386 D388 R392 L405 K406	G386-V390 PolarHBondContact N-O 3.15Å; D388-V390 VanDerWaalsContact C-N 3.32Å; D388-V390 PolarHBondContact OD1-N 3.28Å; D388-V390 VanDerWaalsContact OD1-N 3.16Å; V390-R392 HydrophobicContact CG1-CG 4.07Å; V390-R392 PolarHBondContact O-NH1 3.27Å; V390-L405 WeakPolarHBondContact CA-O 3.45Å; V390-K406 HydrophobicContact CG1-CG 4.45Å; V390-K406 HydrophobicContact CG2-CG 4.11Å
391	I	94	Very high	93	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	128.2	167.2	-59.3	167.9	0	0	0	107.7	A384 A385 S404 L405 P418 F420 T437 W439	A384-I391 WeakPolarHBondContact O-CA 3.27Å; A385-I391 HydrophobicContact CB-CG1 4.29Å; I391-S404 CarbonylContact O-C 3.56Å; I391-S404 VanDerWaalsContact O-CA 3.28Å; I391-S404 WeakPolarHBondContact O-CA 3.32Å; I391-L405 HydrophobicContact CB-CB 4.32Å; I391-L405 HydrophobicContact CB-CD1 4.16Å; I391-L405 HydrophobicContact CG2-CD1 4.09Å; I391-L405 PolarHBondContact N-O 2.74Å; I391-L405 PolarHBondContact O-N 3.5Å; I391-P418 HydrophobicContact CD1-CB 4.07Å; I391-P418 HydrophobicContact CD1-CG 4.14Å; I391-P418 HydrophobicContact CG1-CB 4.28Å; I391-P418 HydrophobicContact CG1-CG 3.78Å; I391-F420 HydrophobicContact CD1-CB 3.78Å; I391-F420 HydrophobicContact CD1-CD1 3.65Å; I391-F420 HydrophobicContact CD1-CE1 4.46Å; I391-F420 HydrophobicContact CD1-CG 3.78Å; I391-F420 HydrophobicContact CG1-CD1 3.87Å; I391-F420 HydrophobicContact CG1-CE1 4.22Å; I391-F420 HydrophobicContact CG1-CG 4.4Å; I391-F420 HydrophobicContact CG2-CD1 4.19Å; I391-F420 HydrophobicContact CG2-CD2 4.29Å; I391-F420 HydrophobicContact CG2-CE1 4.09Å; I391-F420 HydrophobicContact CG2-CE2 4.21Å; I391-F420 HydrophobicContact CG2-CG 4.3Å; I391-F420 HydrophobicContact CG2-CZ 4.12Å; I391-T437 HydrophobicContact CD1-CG2 3.48Å; I391-T437 VanDerWaalsContact CD1-CG2 3.48Å; I391-W439 HydrophobicContact CD1-CH2 3.61Å; I391-W439 HydrophobicContact CD1-CZ2 4.08Å; I391-W439 HydrophobicContact CD1-CZ3 4.28Å; I391-W439 HydrophobicContact CG1-CH2 4.05Å
392	R	93.9	Very high	92.9	Very high	24 Å²	24	26.2 Å²	26.2	9%	0.091	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	146	178.6	-71.1	177.5	-177.7	82	-5.6	109.7	Q362 A383 A384 D388 V390 W394 L401 A403	Q362-R392 WeakPolarHBondContact O-CD 3.31Å; Q362-R392 PolarHBondContact O-NE 2.86Å; Q362-R392 PolarHBondContact O-NH2 3.37Å; A383-R392 CarbonylContact C-O 3.6Å; A383-R392 VanDerWaalsContact CA-O 3.23Å; A383-R392 WeakPolarHBondContact CA-O 3.29Å; A384-R392 PolarHBondContact N-O 3.24Å; A384-R392 PolarHBondContact O-N 2.89Å; D388-R392 IonicContact OD1-NH1 2.75Å; D388-R392 PolarHBondContact OD1-NH1 3.17Å; D388-R392 VanDerWaalsContact OD1-NH1 3.08Å; D388-R392 IonicContact OD2-CZ 3Å; D388-R392 IonicContact OD2-NH1 2.77Å; D388-R392 PolarHBondContact OD2-NH1 3.11Å; D388-R392 VanDerWaalsContact OD2-NH1 3.13Å; D388-R392 IonicContact OD2-NH2 2.73Å; D388-R392 PolarHBondContact OD2-NH2 3.47Å; V390-R392 HydrophobicContact CG1-CG 4.07Å; V390-R392 PolarHBondContact O-NH1 3.27Å; R392-W394 HydrophobicContact CB-CD2 4.43Å; R392-W394 HydrophobicContact CB-CE3 4.12Å; R392-W394 HydrophobicContact CB-CH2 3.16Å; R392-W394 HydrophobicContact CB-CZ2 3.49Å; R392-W394 VanDerWaalsContact CB-CZ2 3.49Å; R392-W394 HydrophobicContact CB-CZ3 3.49Å; R392-W394 VanDerWaalsContact CB-CZ3 3.49Å; R392-W394 HydrophobicContact CG-CH2 4.11Å; R392-W394 HydrophobicContact CG-CZ2 4.18Å; R392-W394 VanDerWaalsContact O-CZ3 3.27Å; R392-W394 WeakPolarHBondContact O-CZ3 3.22Å; R392-L401 HydrophobicContact CB-CD1 3.78Å; R392-L401 HydrophobicContact CG-CD1 4.09Å; R392-A403 WeakPolarHBondContact CA-O 3.31Å
393	I	93.4	Very high	92.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	126.3	-179.6	-52.8	176.1	0	0	0	107.6	T381 V382 A383 L402 A403 L405 V435 M448	T381-I393 HydrophobicContact CG2-CG2 4.07Å; V382-I393 CarbonylContact O-C 3.5Å; V382-I393 VanDerWaalsContact O-CA 3.32Å; V382-I393 WeakPolarHBondContact O-CA 3.43Å; A383-I393 HydrophobicContact CB-CG1 4.03Å; I393-L402 PolarHBondContact O-N 2.91Å; I393-A403 HydrophobicContact CB-CB 4.32Å; I393-A403 HydrophobicContact CD1-CB 4.38Å; I393-A403 PolarHBondContact N-O 2.95Å; I393-A403 PolarHBondContact O-N 2.89Å; I393-A403 VanDerWaalsContact O-N 3.15Å; I393-L405 HydrophobicContact CD1-CD1 4.03Å; I393-L405 HydrophobicContact CG1-CD1 4.47Å; I393-V435 HydrophobicContact CD1-CG2 3.7Å; I393-M448 HydrophobicContact CD1-CE 4.2Å; I393-M448 HydrophobicContact CD1-SD 3.78Å
394	W	93.4	Very high	92.7	Very high	1 Å²	1	29.9 Å²	29.9	0%	0.004	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	154	179.1	-60	-101.2	0	0	0	111	L346 Y360 K361 H363 T381 V382 A384 R392 F396 E400 L401	L346-W394 HydrophobicContact CD2-CE3 4.08Å; L346-W394 HydrophobicContact CD2-CH2 3.8Å; L346-W394 HydrophobicContact CD2-CZ3 3.59Å; Y360-W394 HydrophobicContact CD1-CB 3.63Å; Y360-W394 AromaticContact CD1-CG 3.9Å; Y360-W394 HydrophobicContact CD1-CG 3.9Å; Y360-W394 HydrophobicContact CE1-CB 4.28Å; Y360-W394 HydrophobicContact CG-CB 4.48Å; Y360-W394 HydrophobicContact CG-CG 4.36Å; K361-W394 PolarHBondContact O-NE1 3.33Å; H363-W394 HydrophobicContact CB-CH2 3.89Å; H363-W394 HydrophobicContact CB-CZ2 3.94Å; H363-W394 AromaticContact ND1-CH2 3.93Å; T381-W394 CarbonylContact C-O 3.58Å; T381-W394 WeakPolarHBondContact CA-O 3.46Å; T381-W394 WeakPolarHBondContact CB-O 3.34Å; V382-W394 PolarHBondContact N-O 2.95Å; V382-W394 PolarHBondContact O-N 3.18Å; A384-W394 HydrophobicContact CB-CH2 4.26Å; A384-W394 HydrophobicContact CB-CZ3 3.83Å; R392-W394 HydrophobicContact CB-CD2 4.43Å; R392-W394 HydrophobicContact CB-CE3 4.12Å; R392-W394 HydrophobicContact CB-CH2 3.16Å; R392-W394 HydrophobicContact CB-CZ2 3.49Å; R392-W394 VanDerWaalsContact CB-CZ2 3.49Å; R392-W394 HydrophobicContact CB-CZ3 3.49Å; R392-W394 VanDerWaalsContact CB-CZ3 3.49Å; R392-W394 HydrophobicContact CG-CH2 4.11Å; R392-W394 HydrophobicContact CG-CZ2 4.18Å; R392-W394 VanDerWaalsContact O-CZ3 3.27Å; R392-W394 WeakPolarHBondContact O-CZ3 3.22Å; W394-F396 PolarHBondContact O-N 2.76Å; W394-E400 CarbonylContact C-O 3.52Å; W394-E400 WeakPolarHBondContact CA-O 3.19Å; W394-E400 WeakPolarHBondContact CB-O 3.37Å; W394-L401 HydrophobicContact CD2-CD1 4.05Å; W394-L401 HydrophobicContact CG-CD1 4.2Å; W394-L401 HydrophobicContact CZ2-CD1 4.17Å
395	C	91.3	Very high	92.6	Very high	8 Å²	8	30.5 Å²	30.5	5%	0.054	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	129.1	162.8	-179.2	0	0	0	0	108.5	T398 A399 E400 L402	C395-T398 WeakPolarHBondContact CB-OG1 3.49Å; C395-T398 PolarHBondContact SG-OG1 3.31Å; C395-A399 VanDerWaalsContact O-CA 3.27Å; C395-A399 WeakPolarHBondContact O-CA 3.37Å; C395-A399 PolarHBondContact O-N 2.96Å; C395-E400 PolarHBondContact N-O 2.86Å; C395-L402 HydrophobicContact CB-CD1 3.83Å; C395-L402 HydrophobicContact CB-CD2 4.21Å; C395-L402 HydrophobicContact CB-CG 4.19Å; C395-L402 VanDerWaalsContact N-CD1 3.27Å
396	F	90.9	Very high	92.6	Very high	20 Å²	20	38.6 Å²	38.6	9%	0.088	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-46.9	178.6	174.2	-101.2	0	0	0	111.1	L331 H336 V338 A348 Y360 L375 R380 V382 W394	L331-F396 HydrophobicContact CD1-CE2 3.81Å; L331-F396 HydrophobicContact CD1-CZ 4.06Å; L331-F396 HydrophobicContact CD2-CD1 4.07Å; L331-F396 HydrophobicContact CD2-CD2 4.16Å; L331-F396 HydrophobicContact CD2-CE1 3.47Å; L331-F396 VanDerWaalsContact CD2-CE1 3.47Å; L331-F396 HydrophobicContact CD2-CE2 3.58Å; L331-F396 HydrophobicContact CD2-CG 4.41Å; L331-F396 HydrophobicContact CD2-CZ 3.21Å; L331-F396 HydrophobicContact CG-CE2 4.32Å; L331-F396 HydrophobicContact CG-CZ 4.29Å; H336-F396 HydrophobicContact CB-CZ 4.1Å; V338-F396 HydrophobicContact CG2-CD2 4.17Å; V338-F396 HydrophobicContact CG2-CE2 3.87Å; A348-F396 HydrophobicContact CB-CE2 4.46Å; Y360-F396 WeakPolarHBondContact OH-CD2 3.17Å; Y360-F396 VanDerWaalsContact OH-CE2 3.29Å; Y360-F396 WeakPolarHBondContact OH-CE2 3.46Å; Y360-F396 PolarHBondContact OH-O 3.26Å; Y360-F396 VanDerWaalsContact OH-O 3.09Å; L375-F396 HydrophobicContact CD2-CD2 4.29Å; R380-F396 WeakPolarHBondContact O-CB 3.5Å; R380-F396 PolarHBondContact O-N 3.4Å; V382-F396 HydrophobicContact CG2-CB 4.32Å; V382-F396 HydrophobicContact CG2-CD2 3.8Å; W394-F396 PolarHBondContact O-N 2.76Å
397	N	91.2	Very high	92.5	Very high	90 Å²	90	39.5 Å²	39.5	48%	0.481	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-32.7	-172.2	-64.6	58.7	0	0	0	114.6	F456	N397-F456 HydrophobicContact CB-CZ 4.47Å
398	T	92.8	Very high	92.4	Very high	84 Å²	84	43.4 Å²	43.4	52%	0.515	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-7.7	-176.1	65.3	0	0	0	0	113	C395 E400	C395-T398 WeakPolarHBondContact CB-OG1 3.49Å; C395-T398 PolarHBondContact SG-OG1 3.31Å; T398-E400 PolarHBondContact O-N 2.84Å; T398-E400 WeakPolarHBondContact OG1-CB 3.33Å; T398-E400 PolarHBondContact OG1-N 3.18Å
399	A	94.5	Very high	92.3	Very high	19 Å²	19	43.3 Å²	43.3	16%	0.157	23%	0.233	C	C	.	.			trans	54.4	14.3	-171.1	0	0	0	0	0	114.7	D358 Y360 C395	D358-A399 HydrophobicContact CB-CB 4.49Å; Y360-A399 HydrophobicContact CD1-CB 3.88Å; Y360-A399 HydrophobicContact CE1-CB 4.01Å; C395-A399 VanDerWaalsContact O-CA 3.27Å; C395-A399 WeakPolarHBondContact O-CA 3.37Å; C395-A399 PolarHBondContact O-N 2.96Å
400	E	93.7	Very high	92.2	Very high	123 Å²	123	52.3 Å²	52.3	58%	0.575	27%	0.267	S	S	*	.			trans	-71.1	134.9	177.9	-175.1	178.8	176.4	0	0	110.5	W394 C395 T398 L402	W394-E400 CarbonylContact C-O 3.52Å; W394-E400 WeakPolarHBondContact CA-O 3.19Å; W394-E400 WeakPolarHBondContact CB-O 3.37Å; C395-E400 PolarHBondContact N-O 2.86Å; T398-E400 PolarHBondContact O-N 2.84Å; T398-E400 WeakPolarHBondContact OG1-CB 3.33Å; T398-E400 PolarHBondContact OG1-N 3.18Å; E400-L402 HydrophobicContact CB-CD2 4.49Å; E400-L402 HydrophobicContact CG-CD2 4.39Å; E400-L402 PolarHBondContact O-N 2.79Å
401	L	93.2	Very high	92	Very high	45 Å²	45	52.2 Å²	52.2	24%	0.236	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	116	173.7	-179.6	72	0	0	0	109.7	R392 W394 A403	R392-L401 HydrophobicContact CB-CD1 3.78Å; R392-L401 HydrophobicContact CG-CD1 4.09Å; W394-L401 HydrophobicContact CD2-CD1 4.05Å; W394-L401 HydrophobicContact CG-CD1 4.2Å; W394-L401 HydrophobicContact CZ2-CD1 4.17Å; L401-A403 WeakPolarHBondContact CD1-O 3.46Å
402	L	89.5	Confident	91.8	Very high	50 Å²	50	61.5 Å²	61.5	26%	0.262	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-34.4	-175.6	-54.6	175.3	0	0	0	112.4	T381 I393 C395 E400 Q452	T381-L402 HydrophobicContact CG2-CD1 4.12Å; I393-L402 PolarHBondContact O-N 2.91Å; C395-L402 HydrophobicContact CB-CD1 3.83Å; C395-L402 HydrophobicContact CB-CD2 4.21Å; C395-L402 HydrophobicContact CB-CG 4.19Å; C395-L402 VanDerWaalsContact N-CD1 3.27Å; E400-L402 HydrophobicContact CB-CD2 4.49Å; E400-L402 HydrophobicContact CG-CD2 4.39Å; E400-L402 PolarHBondContact O-N 2.79Å; L402-Q452 VanDerWaalsContact CB-CD 3.47Å; L402-Q452 HydrophobicContact CB-CG 4.44Å; L402-Q452 VanDerWaalsContact CB-NE2 3.3Å; L402-Q452 HydrophobicContact CD1-CB 3.98Å; L402-Q452 HydrophobicContact CD1-CG 4.31Å
403	A	89.6	Confident	91.5	Very high	19 Å²	19	64.9 Å²	64.9	16%	0.157	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	161	-179.7	0	0	0	0	0	114	R392 I393 L401 M448	R392-A403 WeakPolarHBondContact CA-O 3.31Å; I393-A403 HydrophobicContact CB-CB 4.32Å; I393-A403 HydrophobicContact CD1-CB 4.38Å; I393-A403 PolarHBondContact N-O 2.95Å; I393-A403 PolarHBondContact O-N 2.89Å; I393-A403 VanDerWaalsContact O-N 3.15Å; L401-A403 WeakPolarHBondContact CD1-O 3.46Å; A403-M448 HydrophobicContact CB-CE 3.3Å
404	S	91.6	Very high	91	Very high	60 Å²	60	66.5 Å²	66.5	42%	0.42	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	127.8	173.4	-66.9	0	0	0	0	111.2	I391	I391-S404 CarbonylContact O-C 3.56Å; I391-S404 VanDerWaalsContact O-CA 3.28Å; I391-S404 WeakPolarHBondContact O-CA 3.32Å
405	L	91.8	Very high	90.5	Very high	12 Å²	12	69 Å²	69	6%	0.063	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	112.8	175.3	-53.1	100.8	0	0	0	109.3	V390 I391 I393 V435 W439	V390-L405 WeakPolarHBondContact CA-O 3.45Å; I391-L405 HydrophobicContact CB-CB 4.32Å; I391-L405 HydrophobicContact CB-CD1 4.16Å; I391-L405 HydrophobicContact CG2-CD1 4.09Å; I391-L405 PolarHBondContact N-O 2.74Å; I391-L405 PolarHBondContact O-N 3.5Å; I393-L405 HydrophobicContact CD1-CD1 4.03Å; I393-L405 HydrophobicContact CG1-CD1 4.47Å; L405-V435 HydrophobicContact CD1-CG2 4.24Å; L405-W439 HydrophobicContact CB-CH2 4.28Å; L405-W439 HydrophobicContact CB-CZ2 4.28Å
406	K	92.2	Very high	90.4	Very high	170 Å²	170	70.1 Å²	70.1	74%	0.739	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	135.5	179.6	-61.7	-173.4	176.9	-177.4	0	110.8	V390	V390-K406 HydrophobicContact CG1-CG 4.45Å; V390-K406 HydrophobicContact CG2-CG 4.11Å
407	S	91	Very high	90.4	Very high	19 Å²	19	69.2 Å²	69.2	13%	0.133	34%	0.336	C	S	.	.			trans	-61	150.6	167.7	52.3	0	0	0	0	111.5	G389 Y409	G389-S407 WeakPolarHBondContact O-CB 3.42Å; G389-S407 PolarHBondContact O-N 2.91Å; G389-S407 PolarHBondContact O-OG 3.48Å; S407-Y409 WeakPolarHBondContact CB-O 3.29Å; S407-Y409 PolarHBondContact O-N 3.12Å; S407-Y409 PolarHBondContact OG-O 2.86Å
408	P	89.8	Confident	90.5	Very high	92 Å²	92	65 Å²	65	60%	0.597	31%	0.314	S	S	*	.	S	Bend	trans	-75.9	-2.9	173.6	30.7	-32.6	0	0	0	113.2	W439	P408-W439 HydrophobicContact CG-CB 4.17Å; P408-W439 HydrophobicContact CG-CG 4.45Å
409	Y	91.4	Very high	90.3	Very high	56 Å²	56	62 Å²	62	22%	0.22	29%	0.293	C	S	.	.	S	Bend	trans	-135.9	161.6	-178.1	53.8	-103.1	0	0	0	110.5	S407 V411 Q416 W439 M440	S407-Y409 WeakPolarHBondContact CB-O 3.29Å; S407-Y409 PolarHBondContact O-N 3.12Å; S407-Y409 PolarHBondContact OG-O 2.86Å; Y409-V411 HydrophobicContact CD2-CG2 4.49Å; Y409-V411 HydrophobicContact CE2-CG2 4.09Å; Y409-Q416 HydrophobicContact CE2-CB 4.03Å; Y409-Q416 WeakPolarHBondContact CE2-O 3.28Å; Y409-Q416 PolarHBondContact OH-O 2.84Å; Y409-W439 HydrophobicContact CE1-CB 3.85Å; Y409-M440 HydrophobicContact CD1-CG 4.2Å; Y409-M440 HydrophobicContact CE1-CB 4.1Å; Y409-M440 HydrophobicContact CE1-CG 3.54Å; Y409-M440 HydrophobicContact CE2-CG 4.28Å; Y409-M440 PolarHBondContact OH-N 2.88Å
410	R	91.5	Very high	90.1	Very high	189 Å²	189	61.2 Å²	61.2	71%	0.713	29%	0.286	S	S	*	.			trans	-84.2	130.5	171.3	-174.7	172.6	-179.9	-179.7	-0.3	109.9
411	V	90.8	Very high	89.6	Confident	15 Å²	15	55.6 Å²	55.6	9%	0.091	26%	0.26	C	S	.	.			trans	-74.7	128.4	173.7	178.8	0	0	0	0	109.3	W369 G389 Y409 Q416 V417	W369-V411 HydrophobicContact CE3-CG1 4.49Å; W369-V411 HydrophobicContact CH2-CG1 4.02Å; W369-V411 HydrophobicContact CZ3-CG1 3.5Å; G389-V411 VanDerWaalsContact CA-CG2 3.42Å; Y409-V411 HydrophobicContact CD2-CG2 4.49Å; Y409-V411 HydrophobicContact CE2-CG2 4.09Å; V411-Q416 HydrophobicContact CG1-CB 4.22Å; V411-Q416 HydrophobicContact CG2-CB 4.42Å; V411-V417 HydrophobicContact CG1-CG2 3.9Å
412	R	89.9	Confident	89.2	Confident	195 Å²	195	53.7 Å²	53.7	74%	0.736	25%	0.25	S	S	*	.			trans	-122.9	-26.3	175	-61.4	-178.5	177.9	173.3	-1.8	111.8	W369	W369-R412 WeakPolarHBondContact CH2-O 3.43Å
413	E	88.1	Confident	88.9	Confident	96 Å²	96	51.3 Å²	51.3	45%	0.449	24%	0.238	S	C	.	.	S	Bend	trans	-132.4	152.4	-177.5	-59.2	-179.5	-107.2	0	0	110.5	Y415 Q416	E413-Y415 VanDerWaalsContact C-N 3.3Å; E413-Y415 HydrophobicContact CB-CD1 3.91Å; E413-Y415 HydrophobicContact CB-CE1 3.62Å; E413-Y415 HydrophobicContact CG-CE1 4.13Å; E413-Y415 PolarHBondContact O-N 3.31Å; E413-Y415 PolarHBondContact OE1-OH 2.96Å; E413-Y415 WeakPolarHBondContact OE2-CE1 3.38Å; E413-Q416 HydrophobicContact CB-CG 4.4Å; E413-Q416 VanDerWaalsContact N-OE1 3.09Å; E413-Q416 WeakPolarHBondContact O-CB 3.22Å; E413-Q416 PolarHBondContact O-N 3.4Å
414	E	82.5	Confident	88.3	Confident	34 Å²	34	50.5 Å²	50.5	16%	0.159	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-57.8	-38.6	-174.4	-175.2	177.7	-155.8	0	0	113.1	W369 T370 Q416 V417	W369-E414 HydrophobicContact CB-CG 4.07Å; W369-E414 HydrophobicContact CD2-CB 3.91Å; W369-E414 HydrophobicContact CD2-CG 4.32Å; W369-E414 HydrophobicContact CG-CB 3.9Å; W369-E414 HydrophobicContact CG-CG 3.94Å; T370-E414 PolarHBondContact N-OE1 3.18Å; E414-Q416 PolarHBondContact O-N 2.79Å; E414-Q416 VanDerWaalsContact O-N 3.11Å; E414-V417 VanDerWaalsContact O-CB 3.26Å; E414-V417 WeakPolarHBondContact O-CB 3.42Å; E414-V417 WeakPolarHBondContact O-CG2 3.22Å; E414-V417 PolarHBondContact O-N 3.06Å
415	Y	82.6	Confident	87.6	Confident	54 Å²	54	47.7 Å²	47.7	21%	0.212	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-65.1	-16.3	179.6	70.4	-103.6	0	0	0	113.2	Y143 E413 M440	Y143-Y415 HydrophobicContact CD1-CD2 4.09Å; Y143-Y415 HydrophobicContact CE1-CD2 4.08Å; Y143-Y415 HydrophobicContact CE1-CG 4.26Å; E413-Y415 VanDerWaalsContact C-N 3.3Å; E413-Y415 HydrophobicContact CB-CD1 3.91Å; E413-Y415 HydrophobicContact CB-CE1 3.62Å; E413-Y415 HydrophobicContact CG-CE1 4.13Å; E413-Y415 PolarHBondContact O-N 3.31Å; E413-Y415 PolarHBondContact OE1-OH 2.96Å; E413-Y415 WeakPolarHBondContact OE2-CE1 3.38Å; Y415-M440 HydrophobicContact CD2-CE 3.91Å; Y415-M440 HydrophobicContact CD2-SD 3.97Å; Y415-M440 HydrophobicContact CE2-CE 3.62Å; Y415-M440 HydrophobicContact CE2-SD 4.08Å
416	Q	89.7	Confident	86.8	Confident	30 Å²	30	47.2 Å²	47.2	14%	0.14	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-84.5	-15.2	176.5	-56.8	177.5	-42.3	0	0	112.3	Y409 V411 E413 E414 M440	Y409-Q416 HydrophobicContact CE2-CB 4.03Å; Y409-Q416 WeakPolarHBondContact CE2-O 3.28Å; Y409-Q416 PolarHBondContact OH-O 2.84Å; V411-Q416 HydrophobicContact CG1-CB 4.22Å; V411-Q416 HydrophobicContact CG2-CB 4.42Å; E413-Q416 HydrophobicContact CB-CG 4.4Å; E413-Q416 VanDerWaalsContact N-OE1 3.09Å; E413-Q416 WeakPolarHBondContact O-CB 3.22Å; E413-Q416 PolarHBondContact O-N 3.4Å; E414-Q416 PolarHBondContact O-N 2.79Å; E414-Q416 VanDerWaalsContact O-N 3.11Å; Q416-M440 HydrophobicContact CB-SD 4.06Å; Q416-M440 HydrophobicContact CG-SD 3.82Å
417	V	91.3	Very high	85.8	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.012	18%	0.175	C	C	.	.	S	Bend	trans	-57.5	125.1	174.6	173.8	0	0	0	0	108.3	W369 L371 A385 V411 E414 R419	W369-V417 HydrophobicContact CE3-CG2 3.84Å; W369-V417 HydrophobicContact CZ3-CG2 4.17Å; L371-V417 HydrophobicContact CD2-CB 4.48Å; L371-V417 HydrophobicContact CD2-CG1 3.77Å; L371-V417 HydrophobicContact CD2-CG2 3.92Å; A385-V417 HydrophobicContact CB-CG1 3.89Å; V411-V417 HydrophobicContact CG1-CG2 3.9Å; E414-V417 VanDerWaalsContact O-CB 3.26Å; E414-V417 WeakPolarHBondContact O-CB 3.42Å; E414-V417 WeakPolarHBondContact O-CG2 3.22Å; E414-V417 PolarHBondContact O-N 3.06Å; V417-R419 PolarHBondContact O-N 3.32Å; V417-R419 PolarHBondContact O-NH1 2.71Å
418	P	93	Very high	84.5	Confident	1 Å²	1	40 Å²	40	1%	0.006	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-62.6	138.7	-174.3	28.7	-38	0	0	0	111.3	P372 A385 I391 W439	P372-P418 WeakPolarHBondContact CG-O 3.27Å; A385-P418 HydrophobicContact CB-CG 3.99Å; I391-P418 HydrophobicContact CD1-CB 4.07Å; I391-P418 HydrophobicContact CD1-CG 4.14Å; I391-P418 HydrophobicContact CG1-CB 4.28Å; I391-P418 HydrophobicContact CG1-CG 3.78Å; P418-W439 HydrophobicContact CB-CD2 4.47Å; P418-W439 HydrophobicContact CB-CE3 3.52Å; P418-W439 HydrophobicContact CB-CH2 4.11Å; P418-W439 HydrophobicContact CB-CZ3 3.31Å; P418-W439 HydrophobicContact CG-CE3 4.25Å; P418-W439 HydrophobicContact CG-CH2 4.37Å; P418-W439 HydrophobicContact CG-CZ3 3.61Å
419	R	88	Confident	83	Confident	20 Å²	20	41.7 Å²	41.7	8%	0.075	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	144.6	169.7	-63.9	-55.1	-173.3	-96.4	6.2	109.4	A144 S145 M147 V417 T437 C438	A144-R419 HydrophobicContact CB-CB 4.39Å; A144-R419 WeakPolarHBondContact O-CG 3.49Å; S145-R419 PolarHBondContact O-NE 3.23Å; M147-R419 HydrophobicContact CG-CB 3.85Å; M147-R419 HydrophobicContact SD-CB 3.88Å; M147-R419 VanDerWaalsContact SD-O 3.41Å; V417-R419 PolarHBondContact O-N 3.32Å; V417-R419 PolarHBondContact O-NH1 2.71Å; R419-T437 CarbonylContact O-C 3.55Å; R419-T437 WeakPolarHBondContact O-CA 3.18Å; R419-C438 PolarHBondContact N-O 2.91Å; R419-C438 PolarHBondContact O-N 2.95Å
420	F	91.1	Very high	81.4	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.018	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	164.6	-176	69	-85	0	0	0	112	P372 T374 A383 A385 I391 V435 L436 T437	P372-F420 HydrophobicContact CB-CD1 4.49Å; P372-F420 HydrophobicContact CB-CE1 3.98Å; P372-F420 HydrophobicContact CG-CD1 4.18Å; P372-F420 HydrophobicContact CG-CE1 3.8Å; T374-F420 HydrophobicContact CG2-CE2 4.28Å; T374-F420 WeakPolarHBondContact OG1-CE2 3.44Å; A383-F420 HydrophobicContact CB-CE2 3.56Å; A383-F420 HydrophobicContact CB-CZ 4.05Å; A385-F420 HydrophobicContact CB-CD1 4.44Å; A385-F420 HydrophobicContact CB-CE1 3.94Å; I391-F420 HydrophobicContact CD1-CB 3.78Å; I391-F420 HydrophobicContact CD1-CD1 3.65Å; I391-F420 HydrophobicContact CD1-CE1 4.46Å; I391-F420 HydrophobicContact CD1-CG 3.78Å; I391-F420 HydrophobicContact CG1-CD1 3.87Å; I391-F420 HydrophobicContact CG1-CE1 4.22Å; I391-F420 HydrophobicContact CG1-CG 4.4Å; I391-F420 HydrophobicContact CG2-CD1 4.19Å; I391-F420 HydrophobicContact CG2-CD2 4.29Å; I391-F420 HydrophobicContact CG2-CE1 4.09Å; I391-F420 HydrophobicContact CG2-CE2 4.21Å; I391-F420 HydrophobicContact CG2-CG 4.3Å; I391-F420 HydrophobicContact CG2-CZ 4.12Å; F420-V435 HydrophobicContact CB-CG1 4.14Å; F420-V435 HydrophobicContact CD2-CG1 4.21Å; F420-L436 CarbonylContact C-O 3.52Å; F420-L436 WeakPolarHBondContact CA-O 3.46Å; F420-L436 WeakPolarHBondContact CB-O 3.37Å; F420-T437 HydrophobicContact CB-CG2 3.84Å
421	V	83	Confident	80.1	Confident	5 Å²	5	36 Å²	36	3%	0.03	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	144	163.9	-70.3	0	0	0	0	108.4	M147 A149 I158 W426 V435 L436	M147-V421 HydrophobicContact CB-CG1 3.82Å; M147-V421 HydrophobicContact CE-CG2 4.25Å; A149-V421 HydrophobicContact CB-CB 4.04Å; A149-V421 HydrophobicContact CB-CG1 4.06Å; A149-V421 HydrophobicContact CB-CG2 4.49Å; I158-V421 HydrophobicContact CD1-CG2 3.84Å; I158-V421 HydrophobicContact CG1-CG2 4.02Å; I158-V421 HydrophobicContact CG2-CG1 4.24Å; I158-V421 HydrophobicContact CG2-CG2 3.76Å; V421-W426 HydrophobicContact CB-CZ2 4.4Å; V421-W426 HydrophobicContact CG2-CH2 3.72Å; V421-W426 HydrophobicContact CG2-CZ2 3.84Å; V421-V435 WeakPolarHBondContact O-CA 3.47Å; V421-L436 HydrophobicContact CG2-CB 3.8Å; V421-L436 PolarHBondContact N-O 3.29Å; V421-L436 PolarHBondContact O-N 3.44Å
422	H	85.7	Confident	79.2	Confident	5 Å²	5	39.8 Å²	39.8	2%	0.023	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	145.5	-178.8	-179.3	-118.6	0	0	0	109.9	Y151 T381 A383 A434	Y151-H422 PolarHBondContact OH-O 2.78Å; T381-H422 PolarHBondContact OG1-CE1 2.84Å; T381-H422 PolarHBondContact OG1-ND1 2.8Å; A383-H422 HydrophobicContact CB-CB 4.12Å; H422-A434 PolarHBondContact CD2-O 3.3Å
423	G	82.7	Confident	78.7	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	145.3	165.4	0	0	0	0	0	112.2	Y151 N425 W426 P433 A434	Y151-G423 WeakPolarHBondContact OH-CA 3.47Å; G423-N425 VanDerWaalsContact C-N 3.3Å; G423-N425 PolarHBondContact O-N 2.86Å; G423-W426 VanDerWaalsContact CA-NE1 3.34Å; G423-P433 CarbonylContact O-C 3.57Å; G423-P433 VanDerWaalsContact O-CA 3.31Å; G423-P433 WeakPolarHBondContact O-CA 3.34Å; G423-A434 PolarHBondContact N-O 3.31Å; G423-A434 PolarHBondContact O-N 3.21Å
424	D	77.1	Confident	78.5	Confident	1 Å²	1	26 Å²	26	1%	0.005	13%	0.13	C	C	.	.	S	Bend	trans	-77.1	-17.8	-176.7	179.5	51.5	0	0	0	112.8	D376 N377 R378 G431 Y432 Y453	D376-D424 HydrophobicContact CB-CB 4.28Å; D376-D424 WeakPolarHBondContact OD2-CB 3.11Å; N377-D424 PolarHBondContact OD1-N 2.85Å; R378-D424 IonicContact NH1-OD2 3.7Å; R378-D424 PolarHBondContact NH1-OD2 2.98Å; D424-G431 CarbonylContact O-C 2.85Å; D424-G431 WeakPolarHBondContact O-CA 3.02Å; D424-Y432 CarbonylContact O-C 3.48Å; D424-Y432 PolarHBondContact O-N 3.23Å; D424-Y453 WeakPolarHBondContact OD1-CE2 3.41Å
425	N	76.6	Confident	78.8	Confident	2 Å²	2	24.4 Å²	24.4	1%	0.011	12%	0.123	C	C	.	.			trans	-142.4	41.6	-164.8	-163.8	22.7	0	0	0	113.9	R378 G423 Y427 G428 G431	R378-N425 PolarHBondContact NH2-ND2 3.28Å; R378-N425 VanDerWaalsContact NH2-ND2 3.18Å; G423-N425 VanDerWaalsContact C-N 3.3Å; G423-N425 PolarHBondContact O-N 2.86Å; N425-Y427 PolarHBondContact O-N 2.97Å; N425-Y427 VanDerWaalsContact O-N 3.13Å; N425-G428 PolarHBondContact ND2-O 3.4Å; N425-G428 PolarHBondContact O-N 2.96Å; N425-G428 PolarHBondContact OD1-N 2.75Å; N425-G428 PolarHBondContact OD1-O 2.8Å; N425-G431 PolarHBondContact OD1-N 3.26Å
426	W	75.1	Confident	79.1	Confident	1 Å²	1	21.9 Å²	21.9	0%	0.004	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-16.5	175.2	-71.1	17.6	0	0	0	112.2	Y151 P156 I158 T177 V179 L189 V421 G423 A434 L436 L445	Y151-W426 AromaticContact CE1-CD1 3.84Å; Y151-W426 AromaticContact CE1-NE1 3.71Å; Y151-W426 AromaticContact CZ-NE1 3.74Å; Y151-W426 PolarHBondContact OH-NE1 3.26Å; P156-W426 HydrophobicContact CB-CD2 4.41Å; P156-W426 HydrophobicContact CG-CB 4.28Å; P156-W426 HydrophobicContact CG-CD2 3.69Å; P156-W426 HydrophobicContact CG-CE3 4.13Å; P156-W426 HydrophobicContact CG-CG 3.73Å; I158-W426 HydrophobicContact CD1-CH2 3.46Å; I158-W426 VanDerWaalsContact CD1-CH2 3.46Å; I158-W426 HydrophobicContact CD1-CZ2 4.11Å; I158-W426 HydrophobicContact CD1-CZ3 3.86Å; T177-W426 HydrophobicContact CG2-CE3 4.31Å; T177-W426 HydrophobicContact CG2-CZ3 4.36Å; V179-W426 WeakPolarHBondContact CG2-O 3.19Å; L189-W426 HydrophobicContact CD1-CB 3.73Å; L189-W426 HydrophobicContact CD1-CE3 3.93Å; L189-W426 HydrophobicContact CD2-CB 4Å; L189-W426 HydrophobicContact CG-CB 4.44Å; V421-W426 HydrophobicContact CB-CZ2 4.4Å; V421-W426 HydrophobicContact CG2-CH2 3.72Å; V421-W426 HydrophobicContact CG2-CZ2 3.84Å; G423-W426 VanDerWaalsContact CA-NE1 3.34Å; W426-A434 HydrophobicContact CB-CB 4.1Å; W426-A434 HydrophobicContact CD2-CB 3.67Å; W426-A434 HydrophobicContact CE3-CB 3.51Å; W426-A434 HydrophobicContact CG-CB 3.96Å; W426-A434 HydrophobicContact CZ3-CB 4.15Å; W426-L436 HydrophobicContact CH2-CB 3.58Å; W426-L436 HydrophobicContact CZ3-CB 3.95Å; W426-L445 HydrophobicContact CE3-CD1 4.08Å; W426-L445 HydrophobicContact CZ3-CD1 3.57Å
427	Y	70	Confident	79.2	Confident	13 Å²	13	20.4 Å²	20.4	5%	0.051	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	15.6	175.7	-74.8	-83.1	0	0	0	115.6	V179 M187 E188 L189 N425 N429 Y432 E447	V179-Y427 HydrophobicContact CG1-CD1 3.67Å; V179-Y427 HydrophobicContact CG1-CE1 4.05Å; V179-Y427 HydrophobicContact CG2-CD1 4.37Å; M187-Y427 HydrophobicContact CB-CD1 4.23Å; M187-Y427 HydrophobicContact CB-CE1 4.33Å; M187-Y427 WeakPolarHBondContact O-CE1 3.4Å; E188-Y427 WeakPolarHBondContact CA-OH 3.1Å; L189-Y427 HydrophobicContact CB-CE1 4.49Å; L189-Y427 HydrophobicContact CD1-CD2 3.92Å; L189-Y427 HydrophobicContact CD1-CE1 4.41Å; L189-Y427 HydrophobicContact CD1-CE2 3.31Å; L189-Y427 HydrophobicContact CG-CD1 4.43Å; L189-Y427 HydrophobicContact CG-CD2 4.25Å; L189-Y427 HydrophobicContact CG-CE1 3.86Å; L189-Y427 HydrophobicContact CG-CE2 3.71Å; L189-Y427 VanDerWaalsContact CG-CZ 3.47Å; L189-Y427 WeakPolarHBondContact CG-OH 3.37Å; L189-Y427 PolarHBondContact N-OH 3.41Å; N425-Y427 PolarHBondContact O-N 2.97Å; N425-Y427 VanDerWaalsContact O-N 3.13Å; Y427-N429 PolarHBondContact O-N 3.32Å; Y427-N429 VanDerWaalsContact O-N 3.16Å; Y427-Y432 HydrophobicContact CD2-CD2 4.39Å; Y427-Y432 HydrophobicContact CG-CD2 4.37Å; Y427-E447 HydrophobicContact CE2-CG 4.35Å; Y427-E447 PolarHBondContact OH-OE1 3.14Å; Y427-E447 PolarHBondContact OH-OE2 3.33Å
428	G	64.9	Low	79.1	Confident	26 Å²	26	20.5 Å²	20.5	27%	0.268	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	-85.3	172.7	0	0	0	0	0	114.7	N425	N425-G428 PolarHBondContact ND2-O 3.4Å; N425-G428 PolarHBondContact O-N 2.96Å; N425-G428 PolarHBondContact OD1-N 2.75Å; N425-G428 PolarHBondContact OD1-O 2.8Å
429	N	57.6	Low	79	Confident	127 Å²	127	20.7 Å²	20.7	68%	0.679	11%	0.107	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.3	-11.9	175.3	-80.6	-2.8	0	0	0	112.8	R154 Y427 G431	R154-N429 PolarHBondContact NH1-OD1 2.97Å; Y427-N429 PolarHBondContact O-N 3.32Å; Y427-N429 VanDerWaalsContact O-N 3.16Å; N429-G431 PolarHBondContact O-N 3.07Å
430	M	58.5	Low	79.1	Confident	118 Å²	118	21.1 Å²	21.1	58%	0.581	11%	0.11	S	C	*	.	S	Bend	trans	-71.5	-15.5	-174.8	-63.3	-76.8	179.8	0	0	112.8	Y432	M430-Y432 VanDerWaalsContact C-N 3.32Å; M430-Y432 HydrophobicContact CB-CD2 3.75Å; M430-Y432 HydrophobicContact CB-CE2 3.81Å; M430-Y432 PolarHBondContact O-N 3.3Å
431	G	64.6	Low	78.9	Confident	8 Å²	8	23.7 Å²	23.7	8%	0.082	12%	0.124	C	C	.	.			trans	65.3	27.5	170.2	0	0	0	0	0	115.3	D424 N425 N429 P433 P451	D424-G431 CarbonylContact O-C 2.85Å; D424-G431 WeakPolarHBondContact O-CA 3.02Å; N425-G431 PolarHBondContact OD1-N 3.26Å; N429-G431 PolarHBondContact O-N 3.07Å; G431-P433 WeakPolarHBondContact O-CD 3.35Å; G431-P451 WeakPolarHBondContact O-CB 3.49Å
432	Y	71.5	Confident	79.1	Confident	94 Å²	94	25 Å²	25	37%	0.369	13%	0.133	S	C	.	.			trans	-83.1	122	172.9	-65.8	-69.8	0	0	0	110.2	D424 Y427 M430 P451	D424-Y432 CarbonylContact O-C 3.48Å; D424-Y432 PolarHBondContact O-N 3.23Å; Y427-Y432 HydrophobicContact CD2-CD2 4.39Å; Y427-Y432 HydrophobicContact CG-CD2 4.37Å; M430-Y432 VanDerWaalsContact C-N 3.32Å; M430-Y432 HydrophobicContact CB-CD2 3.75Å; M430-Y432 HydrophobicContact CB-CE2 3.81Å; M430-Y432 PolarHBondContact O-N 3.3Å; Y432-P451 HydrophobicContact CD1-CG 4.19Å; Y432-P451 HydrophobicContact CE1-CG 4.07Å
433	P	79.1	Confident	79.1	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.006	13%	0.131	C	C	.	.			trans	-66.7	143.1	175.7	7.4	-2.3	0	0	0	110.8	G423 G431 M448 Q452	G423-P433 CarbonylContact O-C 3.57Å; G423-P433 VanDerWaalsContact O-CA 3.31Å; G423-P433 WeakPolarHBondContact O-CA 3.34Å; G431-P433 WeakPolarHBondContact O-CD 3.35Å; P433-M448 HydrophobicContact CB-CB 4.17Å; P433-M448 HydrophobicContact CB-CG 4.48Å; P433-M448 HydrophobicContact CB-SD 4.07Å; P433-M448 HydrophobicContact CG-CB 3.88Å; P433-M448 HydrophobicContact CG-SD 4.41Å; P433-M448 WeakPolarHBondContact O-CB 3.28Å; P433-M448 PolarHBondContact O-N 3.46Å; P433-Q452 HydrophobicContact CG-CG 4.42Å
434	A	84.8	Confident	79.4	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	143.5	174.8	0	0	0	0	0	110.6	L189 H422 G423 W426 L445 S446	L189-A434 HydrophobicContact CD1-CB 3.83Å; H422-A434 PolarHBondContact CD2-O 3.3Å; G423-A434 PolarHBondContact N-O 3.31Å; G423-A434 PolarHBondContact O-N 3.21Å; W426-A434 HydrophobicContact CB-CB 4.1Å; W426-A434 HydrophobicContact CD2-CB 3.67Å; W426-A434 HydrophobicContact CE3-CB 3.51Å; W426-A434 HydrophobicContact CG-CB 3.96Å; W426-A434 HydrophobicContact CZ3-CB 4.15Å; A434-L445 HydrophobicContact CB-CD1 4.48Å; A434-S446 WeakPolarHBondContact CA-O 3.44Å
435	V	88.6	Confident	79.8	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	119.8	174.2	-164.9	0	0	0	0	108.2	I393 L405 F420 V421 T437 S446 M448	I393-V435 HydrophobicContact CD1-CG2 3.7Å; L405-V435 HydrophobicContact CD1-CG2 4.24Å; F420-V435 HydrophobicContact CB-CG1 4.14Å; F420-V435 HydrophobicContact CD2-CG1 4.21Å; V421-V435 WeakPolarHBondContact O-CA 3.47Å; V435-T437 HydrophobicContact CB-CG2 4.29Å; V435-T437 HydrophobicContact CG1-CG2 3.43Å; V435-T437 VanDerWaalsContact CG1-CG2 3.43Å; V435-S446 PolarHBondContact N-O 2.81Å; V435-S446 PolarHBondContact O-N 3.34Å; V435-M448 HydrophobicContact CG2-SD 4.13Å
436	L	88.1	Confident	80.2	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	125.6	162.6	-176.2	70.8	0	0	0	108.3	W119 M147 I158 V175 F420 V421 W426 L445	W119-L436 HydrophobicContact CH2-CD1 3.89Å; M147-L436 HydrophobicContact CE-CB 4.46Å; M147-L436 HydrophobicContact CE-CD2 3.76Å; M147-L436 HydrophobicContact CE-CG 3.91Å; I158-L436 HydrophobicContact CB-CD2 4.45Å; I158-L436 HydrophobicContact CD1-CB 4.15Å; I158-L436 HydrophobicContact CD1-CD2 3.51Å; I158-L436 HydrophobicContact CD1-CG 4.47Å; I158-L436 HydrophobicContact CG2-CD2 4.08Å; V175-L436 HydrophobicContact CB-CD2 4.41Å; V175-L436 HydrophobicContact CG1-CD2 4.1Å; F420-L436 CarbonylContact C-O 3.52Å; F420-L436 WeakPolarHBondContact CA-O 3.46Å; F420-L436 WeakPolarHBondContact CB-O 3.37Å; V421-L436 HydrophobicContact CG2-CB 3.8Å; V421-L436 PolarHBondContact N-O 3.29Å; V421-L436 PolarHBondContact O-N 3.44Å; W426-L436 HydrophobicContact CH2-CB 3.58Å; W426-L436 HydrophobicContact CZ3-CB 3.95Å; L436-L445 HydrophobicContact CB-CD1 4.38Å; L436-L445 HydrophobicContact CD1-CB 4.06Å; L436-L445 HydrophobicContact CD1-CD1 4.42Å
437	T	91.2	Very high	80.4	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	142.8	-173.2	52.7	0	0	0	0	110.2	I391 R419 F420 V435 W439 M443 Q444	I391-T437 HydrophobicContact CD1-CG2 3.48Å; I391-T437 VanDerWaalsContact CD1-CG2 3.48Å; R419-T437 CarbonylContact O-C 3.55Å; R419-T437 WeakPolarHBondContact O-CA 3.18Å; F420-T437 HydrophobicContact CB-CG2 3.84Å; V435-T437 HydrophobicContact CB-CG2 4.29Å; V435-T437 HydrophobicContact CG1-CG2 3.43Å; V435-T437 VanDerWaalsContact CG1-CG2 3.43Å; T437-W439 HydrophobicContact CG2-CZ2 3.88Å; T437-W439 PolarHBondContact OG1-NE1 3.1Å; T437-M443 CarbonylContact O-C 3.57Å; T437-M443 VanDerWaalsContact O-CA 3.32Å; T437-M443 WeakPolarHBondContact O-CA 3.18Å; T437-Q444 PolarHBondContact N-O 2.78Å; T437-Q444 PolarHBondContact O-N 3.45Å; T437-Q444 WeakPolarHBondContact OG1-CB 3.35Å; T437-Q444 PolarHBondContact OG1-O 3.32Å
438	C	89	Confident	80.7	Confident	3 Å²	3	26.2 Å²	26.2	2%	0.02	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	112.6	165.1	-70.2	0	0	0	0	108.7	A144 M147 R419 V442	A144-C438 HydrophobicContact CB-CB 3.71Å; A144-C438 VanDerWaalsContact CB-SG 3.55Å; M147-C438 HydrophobicContact SD-CB 4.04Å; M147-C438 PolarHBondContact SD-SG 2.7Å; R419-C438 PolarHBondContact N-O 2.91Å; R419-C438 PolarHBondContact O-N 2.95Å; C438-V442 CarbonylContact C-O 3.56Å; C438-V442 WeakPolarHBondContact CA-O 3.19Å
439	W	91.7	Very high	80.6	Confident	5 Å²	5	26.5 Å²	26.5	2%	0.019	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	91.7	171	-51.7	105.3	0	0	0	107.5	I391 L405 P408 Y409 P418 T437 D441 V442	I391-W439 HydrophobicContact CD1-CH2 3.61Å; I391-W439 HydrophobicContact CD1-CZ2 4.08Å; I391-W439 HydrophobicContact CD1-CZ3 4.28Å; I391-W439 HydrophobicContact CG1-CH2 4.05Å; L405-W439 HydrophobicContact CB-CH2 4.28Å; L405-W439 HydrophobicContact CB-CZ2 4.28Å; P408-W439 HydrophobicContact CG-CB 4.17Å; P408-W439 HydrophobicContact CG-CG 4.45Å; Y409-W439 HydrophobicContact CE1-CB 3.85Å; P418-W439 HydrophobicContact CB-CD2 4.47Å; P418-W439 HydrophobicContact CB-CE3 3.52Å; P418-W439 HydrophobicContact CB-CH2 4.11Å; P418-W439 HydrophobicContact CB-CZ3 3.31Å; P418-W439 HydrophobicContact CG-CE3 4.25Å; P418-W439 HydrophobicContact CG-CH2 4.37Å; P418-W439 HydrophobicContact CG-CZ3 3.61Å; T437-W439 HydrophobicContact CG2-CZ2 3.88Å; T437-W439 PolarHBondContact OG1-NE1 3.1Å; W439-D441 PolarHBondContact O-N 3.42Å; W439-V442 PolarHBondContact N-O 2.61Å; W439-V442 PolarHBondContact O-N 3.27Å
440	M	90.3	Very high	80.4	Confident	29 Å²	29	25.8 Å²	25.8	14%	0.143	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	-116.8	-169.5	-67	-64.2	-67.7	0	0	110.2	M138 K142 Y143 Y409 Y415 Q416 V442	M138-M440 WeakPolarHBondContact CE-O 3.4Å; K142-M440 HydrophobicContact CG-CE 4.19Å; K142-M440 CarbonylContact O-C 3.57Å; Y143-M440 VanDerWaalsContact CA-O 3.27Å; Y143-M440 WeakPolarHBondContact CA-O 3.49Å; Y143-M440 HydrophobicContact CD1-CE 4.41Å; Y409-M440 HydrophobicContact CD1-CG 4.2Å; Y409-M440 HydrophobicContact CE1-CB 4.1Å; Y409-M440 HydrophobicContact CE1-CG 3.54Å; Y409-M440 HydrophobicContact CE2-CG 4.28Å; Y409-M440 PolarHBondContact OH-N 2.88Å; Y415-M440 HydrophobicContact CD2-CE 3.91Å; Y415-M440 HydrophobicContact CD2-SD 3.97Å; Y415-M440 HydrophobicContact CE2-CE 3.62Å; Y415-M440 HydrophobicContact CE2-SD 4.08Å; Q416-M440 HydrophobicContact CB-SD 4.06Å; Q416-M440 HydrophobicContact CG-SD 3.82Å; M440-V442 VanDerWaalsContact C-N 3.32Å; M440-V442 PolarHBondContact O-N 3.04Å
441	D	86	Confident	80	Confident	59 Å²	59	22.6 Å²	22.6	32%	0.316	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	3.3	-176.5	56.3	-9	0	0	0	114.4	M138 F141 K142 R165 W439	M138-D441 WeakPolarHBondContact CB-O 2.91Å; M138-D441 VanDerWaalsContact CE-CA 3.47Å; M138-D441 WeakPolarHBondContact CG-O 3.47Å; M138-D441 PolarHBondContact N-O 3.42Å; F141-D441 VanDerWaalsContact O-CB 3.31Å; F141-D441 WeakPolarHBondContact O-CB 3.43Å; K142-D441 PolarHBondContact O-N 3.45Å; K142-D441 VanDerWaalsContact O-N 3.13Å; R165-D441 IonicContact CZ-OD2 3.05Å; R165-D441 IonicContact NH2-OD2 4Å; R165-D441 PolarHBondContact NH2-OD2 3.24Å; W439-D441 PolarHBondContact O-N 3.42Å
442	V	87.1	Confident	79.2	Confident	33 Å²	33	24 Å²	24	20%	0.2	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	123.8	-179.9	178.9	0	0	0	0	111	R135 C438 W439 M440	R135-V442 HydrophobicContact CB-CG1 4.36Å; R135-V442 HydrophobicContact CG-CG1 3.93Å; C438-V442 CarbonylContact C-O 3.56Å; C438-V442 WeakPolarHBondContact CA-O 3.19Å; W439-V442 PolarHBondContact N-O 2.61Å; W439-V442 PolarHBondContact O-N 3.27Å; M440-V442 VanDerWaalsContact C-N 3.32Å; M440-V442 PolarHBondContact O-N 3.04Å
443	M	86.8	Confident	78.1	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	137.1	163.4	-64.5	-162.3	-180	0	0	110.3	V114 L117 W119 R135 A136 M138 L162 V175 T437	V114-M443 HydrophobicContact CG1-CE 3.91Å; L117-M443 HydrophobicContact CD1-SD 4.02Å; W119-M443 HydrophobicContact CH2-CB 3.59Å; W119-M443 HydrophobicContact CZ2-CB 4.21Å; W119-M443 HydrophobicContact CZ2-SD 4.5Å; W119-M443 HydrophobicContact CZ3-CB 4.37Å; R135-M443 CarbonylContact C-O 3.44Å; R135-M443 VanDerWaalsContact CA-O 3.29Å; R135-M443 WeakPolarHBondContact CA-O 3.31Å; A136-M443 PolarHBondContact N-O 2.99Å; A136-M443 PolarHBondContact O-N 2.71Å; M138-M443 HydrophobicContact CG-CE 4.2Å; M138-M443 HydrophobicContact CG-CG 3.72Å; M138-M443 HydrophobicContact SD-CE 3.44Å; M138-M443 WeakPolarHBondContact SD-CE 3.36Å; M138-M443 HydrophobicContact SD-CG 3.64Å; M138-M443 HydrophobicContact SD-SD 4.36Å; L162-M443 HydrophobicContact CD2-CE 4.19Å; V175-M443 HydrophobicContact CG2-CE 4.34Å; V175-M443 HydrophobicContact CG2-SD 4Å; T437-M443 CarbonylContact O-C 3.57Å; T437-M443 VanDerWaalsContact O-CA 3.32Å; T437-M443 WeakPolarHBondContact O-CA 3.18Å
444	Q	87.8	Confident	76.2	Confident	5 Å²	5	26.8 Å²	26.8	2%	0.023	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	121.1	177.2	170.8	-175.2	-51.8	0	0	110.1	Y122 K134 R135 T437 S446	Y122-Q444 HydrophobicContact CE1-CG 4.45Å; Y122-Q444 WeakPolarHBondContact OH-CG 3.33Å; Y122-Q444 PolarHBondContact OH-NE2 2.77Å; Y122-Q444 PolarHBondContact OH-OE1 2.97Å; K134-Q444 CarbonylContact O-C 3.46Å; K134-Q444 VanDerWaalsContact O-CA 3.27Å; K134-Q444 WeakPolarHBondContact O-CA 3.36Å; R135-Q444 HydrophobicContact CG-CB 3.92Å; R135-Q444 HydrophobicContact CG-CG 4.14Å; T437-Q444 PolarHBondContact N-O 2.78Å; T437-Q444 PolarHBondContact O-N 3.45Å; T437-Q444 WeakPolarHBondContact OG1-CB 3.35Å; T437-Q444 PolarHBondContact OG1-O 3.32Å; Q444-S446 PolarHBondContact NE2-OG 2.88Å
445	L	86.1	Confident	73.9	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	125.1	167.5	-179	63.1	0	0	0	108.4	W119 R133 K134 L189 I191 W426 A434 L436 E447	W119-L445 HydrophobicContact CZ3-CB 4.26Å; R133-L445 VanDerWaalsContact CA-O 3.29Å; R133-L445 WeakPolarHBondContact CA-O 3.19Å; K134-L445 HydrophobicContact CB-CB 4.33Å; K134-L445 HydrophobicContact CD-CD2 4.49Å; K134-L445 PolarHBondContact N-O 2.83Å; K134-L445 PolarHBondContact O-N 3.43Å; L189-L445 HydrophobicContact CB-CD2 3.82Å; I191-L445 HydrophobicContact CD1-CD2 4.42Å; W426-L445 HydrophobicContact CE3-CD1 4.08Å; W426-L445 HydrophobicContact CZ3-CD1 3.57Å; A434-L445 HydrophobicContact CB-CD1 4.48Å; L436-L445 HydrophobicContact CB-CD1 4.38Å; L436-L445 HydrophobicContact CD1-CB 4.06Å; L436-L445 HydrophobicContact CD1-CD1 4.42Å; L445-E447 HydrophobicContact CG-CG 4.48Å
446	S	85.8	Confident	71.6	Confident	4 Å²	4	34.7 Å²	34.7	3%	0.028	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	114.3	176.8	-46.3	0	0	0	0	108.6	A434 V435 Q444	A434-S446 WeakPolarHBondContact CA-O 3.44Å; V435-S446 PolarHBondContact N-O 2.81Å; V435-S446 PolarHBondContact O-N 3.34Å; Q444-S446 PolarHBondContact NE2-OG 2.88Å
447	E	79.6	Confident	69.2	Low	12 Å²	12	40.4 Å²	40.4	6%	0.056	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	126	175.9	-55.7	169.2	-146.5	0	0	108.1	D131 L132 L189 Y427 L445	D131-E447 WeakPolarHBondContact CA-O 3.49Å; D131-E447 WeakPolarHBondContact CB-O 3.35Å; L132-E447 HydrophobicContact CB-CB 4.11Å; L132-E447 HydrophobicContact CB-CG 4.23Å; L132-E447 WeakPolarHBondContact CB-OE2 3.36Å; L132-E447 WeakPolarHBondContact CD1-OE2 3.47Å; L132-E447 PolarHBondContact O-N 3.31Å; L189-E447 HydrophobicContact CD1-CG 4.47Å; Y427-E447 HydrophobicContact CE2-CG 4.35Å; Y427-E447 PolarHBondContact OH-OE1 3.14Å; Y427-E447 PolarHBondContact OH-OE2 3.33Å; L445-E447 HydrophobicContact CG-CG 4.48Å
448	M	75.7	Confident	66.8	Low	25 Å²	25	46.7 Å²	46.7	12%	0.123	28%	0.279	C	S	.	.			trans	-95.8	126.4	-175.3	-59	-179.1	69.4	0	0	109.3	I393 A403 P433 V435 I450	I393-M448 HydrophobicContact CD1-CE 4.2Å; I393-M448 HydrophobicContact CD1-SD 3.78Å; A403-M448 HydrophobicContact CB-CE 3.3Å; P433-M448 HydrophobicContact CB-CB 4.17Å; P433-M448 HydrophobicContact CB-CG 4.48Å; P433-M448 HydrophobicContact CB-SD 4.07Å; P433-M448 HydrophobicContact CG-CB 3.88Å; P433-M448 HydrophobicContact CG-SD 4.41Å; P433-M448 WeakPolarHBondContact O-CB 3.28Å; P433-M448 PolarHBondContact O-N 3.46Å; V435-M448 HydrophobicContact CG2-SD 4.13Å; M448-I450 VanDerWaalsContact C-N 3.29Å; M448-I450 PolarHBondContact O-N 3.44Å
449	S	62.8	Low	64.4	Low	31 Å²	31	51.3 Å²	51.3	22%	0.217	30%	0.303	C	S	.	.	S	Bend	trans	-72	-15.8	-170.1	42.6	0	0	0	0	116.7	S130 D131	S130-S449 WeakPolarHBondContact O-CB 3.41Å; S130-S449 WeakPolarHBondContact OG-CB 3.28Å; S130-S449 PolarHBondContact OG-OG 2.83Å; D131-S449 VanDerWaalsContact OD1-CB 3.28Å; D131-S449 WeakPolarHBondContact OD1-CB 3.49Å; D131-S449 PolarHBondContact OD1-N 2.82Å; D131-S449 PolarHBondContact OD1-OG 3.48Å
450	I	53.6	Low	61.4	Low	113 Å²	113	54.9 Å²	54.9	58%	0.579	33%	0.334	S	S	*	.	S	Bend	trans	-114.9	117.4	-176.2	-60.5	170	0	0	0	106.3	M448 Q452	M448-I450 VanDerWaalsContact C-N 3.29Å; M448-I450 PolarHBondContact O-N 3.44Å; I450-Q452 PolarHBondContact O-N 3.03Å
451	P	48.9	Very low	58.6	Low	50 Å²	50	67.3 Å²	67.3	33%	0.325	38%	0.381	S	S	.	.			trans	-54	113.5	153.4	-12.5	26.5	0	0	0	104.3	G431 Y432 Y453	G431-P451 WeakPolarHBondContact O-CB 3.49Å; Y432-P451 HydrophobicContact CD1-CG 4.19Å; Y432-P451 HydrophobicContact CE1-CG 4.07Å; P451-Y453 PolarHBondContact O-N 2.9Å
452	Q	49.3	Very low	57.2	Low	37 Å²	37	67.7 Å²	67.7	17%	0.173	38%	0.384	C	S	.	.	S	Bend	trans	-67.9	18.9	-172.7	-66.2	176.3	-25.6	0	0	112.7	L402 P433 I450	L402-Q452 VanDerWaalsContact CB-CD 3.47Å; L402-Q452 HydrophobicContact CB-CG 4.44Å; L402-Q452 VanDerWaalsContact CB-NE2 3.3Å; L402-Q452 HydrophobicContact CD1-CB 3.98Å; L402-Q452 HydrophobicContact CD1-CG 4.31Å; P433-Q452 HydrophobicContact CG-CG 4.42Å; I450-Q452 PolarHBondContact O-N 3.03Å
453	Y	47.8	Very low	55.6	Low	40 Å²	40	69.5 Å²	69.5	16%	0.157	39%	0.394	C	S	.	.			trans	-133.4	83.8	-168.4	-55.7	-66.1	0	0	0	110.5	R380 T381 D424 P451 A455 F456	R380-Y453 HydrophobicContact CB-CE1 3.95Å; R380-Y453 HydrophobicContact CB-CE2 4.14Å; R380-Y453 VanDerWaalsContact CB-CZ 3.44Å; R380-Y453 WeakPolarHBondContact CB-OH 3.14Å; R380-Y453 PolarHBondContact O-OH 3.45Å; T381-Y453 WeakPolarHBondContact CG2-OH 3.15Å; D424-Y453 WeakPolarHBondContact OD1-CE2 3.41Å; P451-Y453 PolarHBondContact O-N 2.9Å; Y453-A455 VanDerWaalsContact C-N 3.27Å; Y453-F456 AromaticContact CD1-CD2 3.61Å; Y453-F456 HydrophobicContact CD1-CD2 3.61Å; Y453-F456 AromaticContact CD1-CE2 3.53Å; Y453-F456 HydrophobicContact CD1-CE2 3.53Å; Y453-F456 HydrophobicContact CE1-CD2 4.27Å; Y453-F456 AromaticContact CE1-CE2 3.8Å; Y453-F456 HydrophobicContact CE1-CE2 3.8Å; Y453-F456 HydrophobicContact CG-CD2 4.38Å
454	A	38.9	Very low	53.9	Low	115 Å²	115	73.4 Å²	73.4	95%	0.95	42%	0.416	S	S	*	.	S	Bend	trans	-86.9	5.3	158.2	0	0	0	0	0	112.4
455	A	36.5	Very low	51.9	Low	76 Å²	76	77.4 Å²	77.4	63%	0.628	44%	0.439	S	S	*	.			trans	-149.1	70.9	-171.4	0	0	0	0	0	113.9	Y453	Y453-A455 VanDerWaalsContact C-N 3.27Å
456	F	39.9	Very low	49.8	Very low	90 Å²	90	82.2 Å²	82.2	40%	0.395	47%	0.466	S	S	.	.			trans	-139.4	109.8	153.9	-77.2	-71.3	0	0	0	109.2	N397 Y453 N458	N397-F456 HydrophobicContact CB-CZ 4.47Å; Y453-F456 AromaticContact CD1-CD2 3.61Å; Y453-F456 HydrophobicContact CD1-CD2 3.61Å; Y453-F456 AromaticContact CD1-CE2 3.53Å; Y453-F456 HydrophobicContact CD1-CE2 3.53Å; Y453-F456 HydrophobicContact CE1-CD2 4.27Å; Y453-F456 AromaticContact CE1-CE2 3.8Å; Y453-F456 HydrophobicContact CE1-CE2 3.8Å; Y453-F456 HydrophobicContact CG-CD2 4.38Å; F456-N458 PolarHBondContact O-N 3.2Å
457	P	39.4	Very low	47.4	Very low	121 Å²	121	87.4 Å²	87.4	79%	0.786	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-66	-7.6	-176.3	-20.1	31.2	0	0	0	115.4
458	N	39.6	Very low	45.1	Very low	132 Å²	132	92.8 Å²	92.8	71%	0.706	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-98.1	9.6	-166.7	-72.3	-2.7	0	0	0	115.3	F456 A460	F456-N458 PolarHBondContact O-N 3.2Å; N458-A460 PolarHBondContact O-N 2.73Å
459	D	38.5	Very low	42.7	Very low	100 Å²	100	98 Å²	98	54%	0.535	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-86.5	13.1	174.1	-80.5	-10.8	0	0	0	113.8	R380	R380-D459 IonicContact CZ-OD1 3.59Å; R380-D459 IonicContact CZ-OD2 2.71Å; R380-D459 VanDerWaalsContact CZ-OD2 3.26Å; R380-D459 IonicContact NH1-OD2 3.74Å; R380-D459 PolarHBondContact NH1-OD2 2.84Å; R380-D459 IonicContact NH2-OD1 3.64Å; R380-D459 PolarHBondContact NH2-OD1 3.49Å; R380-D459 IonicContact NH2-OD2 4Å; R380-D459 PolarHBondContact NH2-OD2 2.71Å
460	A	29.7	Very low	41	Very low	80 Å²	80	103.6 Å²	103.6	66%	0.661	59%	0.586	S	S	*	*			trans	-96.8	62.9	167.7	0	0	0	0	0	111	N458	N458-A460 PolarHBondContact O-N 2.73Å
461	Y	30.2	Very low	39.9	Very low	289 Å²	289	102.7 Å²	102.7	100%	1.133	59%	0.586	S	S	*	*			trans	-144.1	0	162.3	-78.6	-73.7	0	0	0	111.5

Retrieved 461 of 461 residues in 1100 ms (Link to these results)

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