A0A077ZDQ9_TRITR Loading...

PapD C and Fimbrial and PapD N domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZDQ9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 577 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	38.5	Very low	44.5	Very low	221 Å²	221	146.2 Å²	146.2	100%	1.089	82%	0.82	S	S	*	*				0	126.5	0	-79.5	165.2	65.7	0	0	108.5
2	K	39.5	Very low	44.1	Very low	205 Å²	205	143.3 Å²	143.3	89%	0.891	82%	0.816	S	S	*	*			trans	71.6	120.7	166.6	-50.7	176.2	-178.4	-176.2	0	115.4
3	G	41.8	Very low	43.3	Very low	74 Å²	74	145.2 Å²	145.2	76%	0.763	82%	0.821	S	S	*	*			cis	167.9	116.2	1.1	0	0	0	0	0	106.7
4	L	43.1	Very low	42.8	Very low	174 Å²	174	141.7 Å²	141.7	91%	0.911	81%	0.809	S	S	*	*			trans	-89.9	121.2	-178.5	-170.5	73.6	0	0	0	108.9
5	P	50.7	Low	42.5	Very low	117 Å²	117	139.3 Å²	139.3	76%	0.76	81%	0.805	S	S	*	*			trans	-84.5	121.6	176.4	31.7	-27.4	0	0	0	110.1	L7	P5-L7 PolarHBondContact O-N 3.32Å
6	L	45.4	Very low	43.1	Very low	156 Å²	156	139.8 Å²	139.8	82%	0.817	80%	0.797	S	S	*	*			trans	-64.3	110	171.5	-174.9	74.1	0	0	0	109.7	L8	L6-L8 HydrophobicContact CD2-CD1 4.41Å; L6-L8 PolarHBondContact O-N 3.46Å
7	L	52	Low	43.7	Very low	159 Å²	159	133.3 Å²	133.3	83%	0.832	76%	0.764	S	S	*	*			trans	-82.3	104.2	174.5	-153.4	85.1	0	0	0	108.8	P5 L9	P5-L7 PolarHBondContact O-N 3.32Å; L7-L9 PolarHBondContact O-N 2.57Å
8	L	45	Very low	45.3	Very low	143 Å²	143	126.4 Å²	126.4	75%	0.749	73%	0.726	S	S	*	*			trans	-66.6	112.5	171.4	-99	92.8	0	0	0	109.7	L6 V10	L6-L8 HydrophobicContact CD2-CD1 4.41Å; L6-L8 PolarHBondContact O-N 3.46Å; L8-V10 PolarHBondContact O-N 2.94Å
9	L	45.2	Very low	47.2	Very low	157 Å²	157	119.9 Å²	119.9	82%	0.822	69%	0.689	S	S	*	*			trans	-75.8	105.2	168.7	-139.8	87.4	0	0	0	108.7	L7 A11	L7-L9 PolarHBondContact O-N 2.57Å; L9-A11 VanDerWaalsContact C-N 3.34Å; L9-A11 PolarHBondContact O-N 3.02Å
10	V	46.7	Very low	48.9	Very low	129 Å²	129	117.6 Å²	117.6	78%	0.782	67%	0.672	S	S	*	*			trans	-77.3	88.2	170.6	-177.5	0	0	0	0	107.6	L8 S12	L8-V10 PolarHBondContact O-N 2.94Å; V10-S12 PolarHBondContact O-N 3.45Å
11	A	42.1	Very low	50.6	Low	73 Å²	73	112.7 Å²	112.7	60%	0.603	64%	0.644	S	S	*	*			trans	-72.1	112.8	167.4	0	0	0	0	0	108.4	L9 L13	L9-A11 VanDerWaalsContact C-N 3.34Å; L9-A11 PolarHBondContact O-N 3.02Å; A11-L13 PolarHBondContact O-N 3.01Å
12	S	38.8	Very low	52.6	Low	111 Å²	111	104.6 Å²	104.6	78%	0.776	61%	0.605	S	S	*	*			trans	-59.9	98.2	170.4	-66.6	0	0	0	0	109.4	V10 C14	V10-S12 PolarHBondContact O-N 3.45Å; S12-C14 PolarHBondContact O-N 2.84Å
13	L	33.9	Very low	54.3	Low	168 Å²	168	98.6 Å²	98.6	88%	0.88	58%	0.577	S	S	*	*			trans	-66.5	94.5	169.9	-74.1	158.3	0	0	0	108.3	A11 S15	A11-L13 PolarHBondContact O-N 3.01Å; L13-S15 PolarHBondContact O-N 3.26Å
14	C	36.6	Very low	56	Low	97 Å²	97	99.6 Å²	99.6	66%	0.655	57%	0.568	S	S	*	*			trans	-63.1	101.5	160.5	-81.3	0	0	0	0	107.5	S12 H16	S12-C14 PolarHBondContact O-N 2.84Å; C14-H16 PolarHBondContact O-N 3.44Å; C14-H16 VanDerWaalsContact O-N 3.1Å; C14-H16 PolarHBondContact O-ND1 3.17Å
15	S	38.5	Very low	58.1	Low	106 Å²	106	92.1 Å²	92.1	74%	0.741	53%	0.528	S	S	*	.			trans	-64.1	106.8	168.1	-180	0	0	0	0	108.2	L13	L13-S15 PolarHBondContact O-N 3.26Å
16	H	52.4	Low	60	Low	147 Å²	147	86.8 Å²	86.8	68%	0.681	49%	0.493	S	S	*	.			trans	-90.3	108.9	173.3	-67.3	75.5	0	0	0	107.1	C14 A18	C14-H16 PolarHBondContact O-N 3.44Å; C14-H16 VanDerWaalsContact O-N 3.1Å; C14-H16 PolarHBondContact O-ND1 3.17Å; H16-A18 PolarHBondContact O-N 3.03Å
17	A	53.1	Low	62.1	Low	29 Å²	29	80.6 Å²	80.6	24%	0.24	46%	0.462	C	S	.	.			trans	-57.3	136.6	166.3	0	0	0	0	0	108.3	I126	A17-I126 HydrophobicContact CB-CB 4.37Å; A17-I126 HydrophobicContact CB-CG1 4.4Å; A17-I126 HydrophobicContact CB-CG2 4.1Å
18	A	72.1	Confident	64.1	Low	10 Å²	10	73 Å²	73	8%	0.083	42%	0.422	C	S	.	.	S	Bend	trans	-69.9	-40.9	-178.7	0	0	0	0	0	110	H16 N41 R42 Y48 E108	H16-A18 PolarHBondContact O-N 3.03Å; A18-N41 CarbonylContact O-C 3.48Å; A18-N41 WeakPolarHBondContact O-CA 3.38Å; A18-R42 PolarHBondContact O-N 3.47Å; A18-Y48 HydrophobicContact CB-CD1 4.01Å; A18-Y48 HydrophobicContact CB-CD2 3.65Å; A18-Y48 HydrophobicContact CB-CE1 3.64Å; A18-Y48 HydrophobicContact CB-CE2 3.28Å; A18-Y48 HydrophobicContact CB-CG 4.02Å; A18-E108 PolarHBondContact N-OE2 2.85Å; A18-E108 VanDerWaalsContact N-OE2 3.11Å
19	L	81.9	Confident	66.4	Low	2 Å²	2	69 Å²	69	1%	0.01	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	122.7	175	-61.4	-170	0	0	0	112.3	V39 D40 N41 Y48 A50 L75 M106 E108	L19-V39 HydrophobicContact CB-CG1 4.44Å; L19-D40 CarbonylContact C-O 3.57Å; L19-D40 VanDerWaalsContact CA-O 3.32Å; L19-D40 WeakPolarHBondContact CA-O 3.2Å; L19-N41 HydrophobicContact CD2-CB 3.77Å; L19-Y48 HydrophobicContact CD2-CG 4.47Å; L19-Y48 HydrophobicContact CG-CG 4.39Å; L19-A50 HydrophobicContact CD1-CB 3.55Å; L19-L75 HydrophobicContact CD2-CB 4.41Å; L19-L75 HydrophobicContact CD2-CD2 3.89Å; L19-M106 HydrophobicContact CB-CE 3.59Å; L19-E108 HydrophobicContact CB-CB 4.08Å; L19-E108 HydrophobicContact CD1-CB 3.68Å; L19-E108 HydrophobicContact CG-CB 3.79Å; L19-E108 PolarHBondContact N-OE2 2.03Å
20	Q	80.8	Confident	68.6	Low	74 Å²	74	62.4 Å²	62.4	35%	0.346	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	113.9	-178	-174.3	154.8	5.7	0	0	112.4	D40 R42	Q20-D40 PolarHBondContact N-O 3.48Å; Q20-D40 PolarHBondContact O-N 2.9Å; Q20-R42 HydrophobicContact CB-CG 4.47Å; Q20-R42 VanDerWaalsContact CD-CZ 3.43Å
21	P	85.1	Confident	70.6	Confident	15 Å²	15	61.4 Å²	61.4	10%	0.097	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	148.8	165.8	-22	36	0	0	0	112	R23 L37 R38 M106 I130	P21-R23 VanDerWaalsContact C-N 3.28Å; P21-R23 PolarHBondContact O-N 3.23Å; P21-L37 HydrophobicContact CB-CD1 4.05Å; P21-L37 HydrophobicContact CB-CD2 4.09Å; P21-L37 HydrophobicContact CB-CG 4.28Å; P21-R38 CarbonylContact C-O 3.39Å; P21-R38 WeakPolarHBondContact CA-O 3.09Å; P21-M106 HydrophobicContact CG-CE 3.57Å; P21-M106 HydrophobicContact CG-SD 4.16Å; P21-I130 HydrophobicContact CB-CD1 3.61Å; P21-I130 HydrophobicContact CG-CD1 3.76Å
22	D	80.8	Confident	72.9	Confident	51 Å²	51	61.1 Å²	61.1	27%	0.273	35%	0.348	S	S	.	.	S	Bend	trans	-75.8	-8	-177.7	72.8	-17.8	0	0	0	115.3	L37 R38	D22-L37 WeakPolarHBondContact OD1-CD1 3.47Å; D22-R38 HydrophobicContact CB-CB 3.86Å; D22-R38 PolarHBondContact N-O 3.17Å; D22-R38 PolarHBondContact OD1-N 2.84Å; D22-R38 WeakPolarHBondContact OD2-CB 3.47Å
23	R	75.2	Confident	75.3	Confident	79 Å²	79	64.1 Å²	64.1	30%	0.298	35%	0.347	S	S	.	.			trans	-149.9	159.4	-178.9	67.6	-161.5	71.1	-160.9	-1.1	112.4	P21 R25 I26 L37 I130	P21-R23 VanDerWaalsContact C-N 3.28Å; P21-R23 PolarHBondContact O-N 3.23Å; R23-R25 WeakPolarHBondContact CG-O 3.12Å; R23-I26 HydrophobicContact CG-CG1 4.27Å; R23-L37 HydrophobicContact CG-CD1 3.53Å; R23-I130 VanDerWaalsContact O-CD1 3.29Å; R23-I130 WeakPolarHBondContact O-CD1 3.19Å
24	T	77.2	Confident	78	Confident	95 Å²	95	58 Å²	58	58%	0.583	32%	0.321	S	S	*	.	S	Bend	trans	-104.1	-4.9	-176.8	59.1	0	0	0	0	113.9
25	R	85.7	Confident	80.5	Confident	16 Å²	16	54.6 Å²	54.6	6%	0.06	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	151.8	172.7	64.4	179.2	-71.8	171.1	-0.9	110.5	R23 F133 M214 D215 D216	R23-R25 WeakPolarHBondContact CG-O 3.12Å; R25-F133 HydrophobicContact CB-CE2 4.32Å; R25-M214 PolarHBondContact NH1-O 2.55Å; R25-D215 WeakPolarHBondContact CD-O 3.4Å; R25-D215 PolarHBondContact NE-O 2.75Å; R25-D215 PolarHBondContact NH1-O 3.34Å; R25-D216 WeakPolarHBondContact CD-O 3.11Å; R25-D216 VanDerWaalsContact CZ-CA 3.48Å; R25-D216 PolarHBondContact NE-O 2.63Å; R25-D216 IonicContact NH2-OD1 2.66Å; R25-D216 PolarHBondContact NH2-OD1 2.94Å
26	I	90.8	Very high	82.9	Confident	6 Å²	6	51.4 Å²	51.4	3%	0.031	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130.3	178.2	-61	168.3	0	0	0	107.5	R23 T35 L37 I85 Y104 I130 K131 V132 F133	R23-I26 HydrophobicContact CG-CG1 4.27Å; I26-T35 HydrophobicContact CG2-CG2 3.73Å; I26-L37 HydrophobicContact CD1-CD1 4.25Å; I26-I85 HydrophobicContact CD1-CD1 3.64Å; I26-Y104 HydrophobicContact CD1-CG 4.46Å; I26-I130 HydrophobicContact CD1-CG2 4.08Å; I26-I130 HydrophobicContact CG1-CG2 4Å; I26-K131 PolarHBondContact N-O 3.4Å; I26-V132 HydrophobicContact CB-CB 4.47Å; I26-V132 HydrophobicContact CB-CG1 4.48Å; I26-V132 HydrophobicContact CB-CG2 4.05Å; I26-V132 HydrophobicContact CD1-CG2 4.01Å; I26-V132 HydrophobicContact CG2-CG1 4.29Å; I26-V132 HydrophobicContact CG2-CG2 4.5Å; I26-V132 CarbonylContact O-C 3.51Å; I26-V132 WeakPolarHBondContact O-CA 3.16Å; I26-F133 PolarHBondContact O-N 3.11Å
27	V	91	Very high	84.7	Confident	25 Å²	25	44.4 Å²	44.4	15%	0.152	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	119.2	165.4	178.3	0	0	0	0	106.9	F133 R135 D216	V27-F133 WeakPolarHBondContact CA-O 3.49Å; V27-F133 HydrophobicContact CG2-CD2 4.48Å; V27-R135 HydrophobicContact CG1-CB 4.14Å; V27-D216 HydrophobicContact CG2-CB 4.05Å
28	F	94	Very high	86.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	107.8	175.8	-164.8	-56.4	0	0	0	108.1	D32 T35 L66 I85 K87 V132 F133 W134 R135	F28-D32 HydrophobicContact CE1-CB 4.47Å; F28-D32 WeakPolarHBondContact CE1-O 3.35Å; F28-T35 HydrophobicContact CD2-CG2 3.48Å; F28-T35 VanDerWaalsContact CD2-CG2 3.48Å; F28-T35 HydrophobicContact CE2-CG2 3.93Å; F28-T35 HydrophobicContact CG-CG2 4.22Å; F28-L66 HydrophobicContact CD2-CD2 4.03Å; F28-L66 HydrophobicContact CE2-CD2 3.92Å; F28-L66 HydrophobicContact CZ-CD2 4.33Å; F28-I85 HydrophobicContact CD2-CB 4.46Å; F28-I85 HydrophobicContact CD2-CG2 3.99Å; F28-I85 HydrophobicContact CE2-CB 4.33Å; F28-I85 HydrophobicContact CE2-CG2 3.94Å; F28-I85 VanDerWaalsContact CE2-O 3.29Å; F28-I85 WeakPolarHBondContact CE2-O 3.4Å; F28-K87 HydrophobicContact CE1-CB 4Å; F28-K87 HydrophobicContact CE1-CD 4.42Å; F28-K87 HydrophobicContact CZ-CB 3.72Å; F28-K87 HydrophobicContact CZ-CG 4.42Å; F28-V132 HydrophobicContact CB-CG1 4.37Å; F28-F133 PolarHBondContact N-O 2.69Å; F28-W134 HydrophobicContact CB-CE3 4.38Å; F28-W134 AromaticContact CD1-CE3 3.67Å; F28-W134 HydrophobicContact CD1-CE3 3.67Å; F28-W134 AromaticContact CD1-CZ3 3.51Å; F28-W134 HydrophobicContact CD1-CZ3 3.51Å; F28-W134 HydrophobicContact CE1-CE3 4.24Å; F28-W134 HydrophobicContact CE1-CH2 4.44Å; F28-W134 AromaticContact CE1-CZ3 3.61Å; F28-W134 HydrophobicContact CE1-CZ3 3.61Å; F28-W134 HydrophobicContact CG-CE3 4.08Å; F28-W134 HydrophobicContact CG-CZ3 4.27Å; F28-W134 HydrophobicContact CZ-CZ3 4.38Å; F28-R135 PolarHBondContact O-N 3.26Å
29	N	92.5	Very high	87.2	Confident	58 Å²	58	46.7 Å²	46.7	31%	0.31	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	134.3	176.5	-50.4	-74	0	0	0	110.2	N31 D32	N29-N31 PolarHBondContact O-N 3.03Å; N29-D32 WeakPolarHBondContact CB-OD2 3.21Å; N29-D32 PolarHBondContact ND2-OD2 3Å; N29-D32 VanDerWaalsContact ND2-OD2 3.11Å; N29-D32 WeakPolarHBondContact O-CB 3.25Å; N29-D32 PolarHBondContact O-N 2.86Å
30	A	91.7	Very high	87.4	Confident	20 Å²	20	47.4 Å²	47.4	17%	0.165	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.5	-175.8	0	0	0	0	0	114.3	D32 K87 W134 R135	A30-D32 VanDerWaalsContact C-N 3.35Å; A30-K87 PolarHBondContact O-NZ 2.74Å; A30-W134 HydrophobicContact CB-CH2 4.15Å; A30-W134 HydrophobicContact CB-CZ2 3.55Å; A30-R135 WeakPolarHBondContact CB-O 3.33Å; A30-R135 PolarHBondContact N-O 2.85Å
31	N	88.7	Confident	87.7	Confident	107 Å²	107	44 Å²	44	57%	0.572	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-27.7	176.6	-71.3	-6.6	0	0	0	112.3	N29 K87 A137	N29-N31 PolarHBondContact O-N 3.03Å; N31-K87 PolarHBondContact O-NZ 3.25Å; N31-A137 WeakPolarHBondContact OD1-CB 3.35Å
32	D	89.5	Confident	87.5	Confident	68 Å²	68	49.7 Å²	49.7	36%	0.364	25%	0.25	S	S	.	.			trans	-75.6	145.1	-176.9	-56	-25.1	0	0	0	110	F28 N29 A30 K87	F28-D32 HydrophobicContact CE1-CB 4.47Å; F28-D32 WeakPolarHBondContact CE1-O 3.35Å; N29-D32 WeakPolarHBondContact CB-OD2 3.21Å; N29-D32 PolarHBondContact ND2-OD2 3Å; N29-D32 VanDerWaalsContact ND2-OD2 3.11Å; N29-D32 WeakPolarHBondContact O-CB 3.25Å; N29-D32 PolarHBondContact O-N 2.86Å; A30-D32 VanDerWaalsContact C-N 3.35Å; D32-K87 WeakPolarHBondContact O-CD 3.38Å; D32-K87 WeakPolarHBondContact O-CE 3.29Å; D32-K87 PolarHBondContact O-NZ 2.96Å
33	K	90.1	Very high	87.4	Confident	173 Å²	173	48.3 Å²	48.3	75%	0.752	24%	0.244	S	C	*	.	S	Bend	trans	-79.5	-30.6	174.3	-69.3	-176.1	-179.2	177.5	0	112.1	K87	K33-K87 PolarHBondContact O-N 2.78Å
34	A	91.3	Very high	87.5	Confident	39 Å²	39	49.9 Å²	49.9	32%	0.322	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	161.5	-179.9	0	0	0	0	0	110	I85 V86	A34-I85 CarbonylContact C-O 3.53Å; A34-I85 WeakPolarHBondContact CA-O 3.07Å; A34-I85 VanDerWaalsContact CB-O 3.3Å; A34-I85 WeakPolarHBondContact CB-O 2.98Å; A34-V86 HydrophobicContact CB-CG2 4.06Å
35	T	88.5	Confident	87.8	Confident	26 Å²	26	53.7 Å²	53.7	16%	0.16	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	150.7	165.7	-171.7	0	0	0	0	109	I26 F28 R84 I85	I26-T35 HydrophobicContact CG2-CG2 3.73Å; F28-T35 HydrophobicContact CD2-CG2 3.48Å; F28-T35 VanDerWaalsContact CD2-CG2 3.48Å; F28-T35 HydrophobicContact CE2-CG2 3.93Å; F28-T35 HydrophobicContact CG-CG2 4.22Å; T35-R84 CarbonylContact O-C 3.53Å; T35-I85 HydrophobicContact CG2-CB 3.94Å; T35-I85 HydrophobicContact CG2-CD1 4.46Å; T35-I85 PolarHBondContact N-O 2.88Å; T35-I85 PolarHBondContact O-N 2.79Å
36	S	89.5	Confident	87.6	Confident	39 Å²	39	56.7 Å²	56.7	27%	0.273	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	144.7	-174.7	-71.3	0	0	0	0	112.2	Q82 V83	S36-Q82 VanDerWaalsContact CB-CD 3.45Å; S36-Q82 VanDerWaalsContact CB-NE2 3.25Å; S36-Q82 PolarHBondContact OG-NE2 2.81Å; S36-Q82 PolarHBondContact OG-OE1 3Å; S36-V83 WeakPolarHBondContact CA-O 3.43Å
37	L	88.8	Confident	87.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	126.6	174.5	-179.6	75	0	0	0	108.6	P21 D22 R23 I26 V39 Q82 V83 Y104	P21-L37 HydrophobicContact CB-CD1 4.05Å; P21-L37 HydrophobicContact CB-CD2 4.09Å; P21-L37 HydrophobicContact CB-CG 4.28Å; D22-L37 WeakPolarHBondContact OD1-CD1 3.47Å; R23-L37 HydrophobicContact CG-CD1 3.53Å; I26-L37 HydrophobicContact CD1-CD1 4.25Å; L37-V39 HydrophobicContact CD2-CG2 4.33Å; L37-V39 HydrophobicContact CG-CG2 4.45Å; L37-Q82 CarbonylContact O-C 3.57Å; L37-Q82 WeakPolarHBondContact O-CA 3.37Å; L37-V83 PolarHBondContact N-O 3.09Å; L37-V83 PolarHBondContact O-N 3.22Å; L37-Y104 HydrophobicContact CD2-CD1 3.71Å; L37-Y104 HydrophobicContact CD2-CE1 3.12Å; L37-Y104 HydrophobicContact CD2-CE2 4.3Å; L37-Y104 HydrophobicContact CD2-CG 4.47Å; L37-Y104 VanDerWaalsContact CD2-CZ 3.47Å
38	R	88.7	Confident	87.3	Confident	88 Å²	88	58.1 Å²	58.1	33%	0.332	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	138.7	173.4	-174.4	-177.8	77	85.8	17.3	109.2	P21 D22 D40 T80 T81	P21-R38 CarbonylContact C-O 3.39Å; P21-R38 WeakPolarHBondContact CA-O 3.09Å; D22-R38 HydrophobicContact CB-CB 3.86Å; D22-R38 PolarHBondContact N-O 3.17Å; D22-R38 PolarHBondContact OD1-N 2.84Å; D22-R38 WeakPolarHBondContact OD2-CB 3.47Å; R38-D40 IonicContact CZ-OD1 3.56Å; R38-D40 IonicContact CZ-OD2 2.71Å; R38-D40 IonicContact NH1-OD1 2.93Å; R38-D40 PolarHBondContact NH1-OD1 2.81Å; R38-D40 IonicContact NH1-OD2 3.3Å; R38-D40 PolarHBondContact NH1-OD2 2.89Å; R38-D40 IonicContact NH2-OD1 2.74Å; R38-D40 IonicContact NH2-OD2 3.48Å; R38-D40 PolarHBondContact NH2-OD2 2.83Å; R38-T80 HydrophobicContact CG-CG2 3.4Å; R38-T81 CarbonylContact C-O 3.59Å; R38-T81 WeakPolarHBondContact CA-O 3.37Å
39	V	88.5	Confident	87.1	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	126.4	-179.9	-179.5	0	0	0	0	108.7	L19 L37 L75 T80 T81 V83 M106	L19-V39 HydrophobicContact CB-CG1 4.44Å; L37-V39 HydrophobicContact CD2-CG2 4.33Å; L37-V39 HydrophobicContact CG-CG2 4.45Å; V39-L75 HydrophobicContact CG1-CD2 4.03Å; V39-T80 CarbonylContact O-C 3.6Å; V39-T80 WeakPolarHBondContact O-CA 3.31Å; V39-T81 HydrophobicContact CB-CG2 3.96Å; V39-T81 PolarHBondContact N-O 3.23Å; V39-T81 PolarHBondContact O-N 2.79Å; V39-V83 HydrophobicContact CG2-CG2 4.16Å; V39-M106 HydrophobicContact CB-SD 4.26Å; V39-M106 HydrophobicContact CG1-CE 3.96Å; V39-M106 HydrophobicContact CG1-SD 3.48Å; V39-M106 WeakPolarHBondContact CG1-SD 3.35Å; V39-M106 HydrophobicContact CG2-SD 3.7Å
40	D	87.5	Confident	87	Confident	17 Å²	17	58.2 Å²	58.2	9%	0.091	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	137.5	177.7	-64.6	-37.4	0	0	0	111.2	L19 Q20 R38 R42 T80	L19-D40 CarbonylContact C-O 3.57Å; L19-D40 VanDerWaalsContact CA-O 3.32Å; L19-D40 WeakPolarHBondContact CA-O 3.2Å; Q20-D40 PolarHBondContact N-O 3.48Å; Q20-D40 PolarHBondContact O-N 2.9Å; R38-D40 IonicContact CZ-OD1 3.56Å; R38-D40 IonicContact CZ-OD2 2.71Å; R38-D40 IonicContact NH1-OD1 2.93Å; R38-D40 PolarHBondContact NH1-OD1 2.81Å; R38-D40 IonicContact NH1-OD2 3.3Å; R38-D40 PolarHBondContact NH1-OD2 2.89Å; R38-D40 IonicContact NH2-OD1 2.74Å; R38-D40 IonicContact NH2-OD2 3.48Å; R38-D40 PolarHBondContact NH2-OD2 2.83Å; D40-R42 HydrophobicContact CB-CG 4.22Å; D40-T80 WeakPolarHBondContact OD1-CB 3.4Å; D40-T80 WeakPolarHBondContact OD1-CG2 3.34Å; D40-T80 PolarHBondContact OD1-OG1 2.98Å
41	N	85.9	Confident	87.1	Confident	2 Å²	2	61 Å²	61	1%	0.011	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	102.4	159.3	-177.1	5.3	0	0	0	109.5	A18 L19 S43 L46 L75 E76 K78 A79	A18-N41 CarbonylContact O-C 3.48Å; A18-N41 WeakPolarHBondContact O-CA 3.38Å; L19-N41 HydrophobicContact CD2-CB 3.77Å; N41-S43 PolarHBondContact O-N 3.32Å; N41-S43 WeakPolarHBondContact OD1-CB 3.44Å; N41-S43 PolarHBondContact OD1-N 3Å; N41-L46 PolarHBondContact ND2-O 2.89Å; N41-L75 HydrophobicContact CB-CB 3.72Å; N41-L75 HydrophobicContact CB-CD2 4.03Å; N41-L75 PolarHBondContact ND2-O 2.82Å; N41-E76 WeakPolarHBondContact CB-O 3.19Å; N41-E76 PolarHBondContact ND2-O 2.79Å; N41-K78 WeakPolarHBondContact O-CA 3.49Å; N41-K78 PolarHBondContact O-N 3.13Å; N41-A79 PolarHBondContact N-O 2.97Å
42	R	81.8	Confident	87.4	Confident	135 Å²	135	56 Å²	56	51%	0.509	27%	0.271	S	S	.	.			trans	-82.6	3.4	177.8	-63.1	-167.8	172.5	-165	0.6	113.7	A18 Q20 D40	A18-R42 PolarHBondContact O-N 3.47Å; Q20-R42 HydrophobicContact CB-CG 4.47Å; Q20-R42 VanDerWaalsContact CD-CZ 3.43Å; D40-R42 HydrophobicContact CB-CG 4.22Å
43	S	78.7	Confident	87.6	Confident	21 Å²	21	53.7 Å²	53.7	15%	0.147	26%	0.257	C	S	.	.			trans	-71	129.4	170.7	-174.4	0	0	0	0	110.7	N41 K45 L46 P77 K78	N41-S43 PolarHBondContact O-N 3.32Å; N41-S43 WeakPolarHBondContact OD1-CB 3.44Å; N41-S43 PolarHBondContact OD1-N 3Å; S43-K45 VanDerWaalsContact C-N 3.26Å; S43-K45 PolarHBondContact O-N 2.77Å; S43-K45 PolarHBondContact OG-N 3.06Å; S43-L46 WeakPolarHBondContact CB-O 3.48Å; S43-L46 PolarHBondContact OG-N 2.84Å; S43-L46 PolarHBondContact OG-O 2.81Å; S43-P77 VanDerWaalsContact O-CA 3.31Å; S43-P77 WeakPolarHBondContact O-CA 2.91Å; S43-P77 WeakPolarHBondContact O-CB 3.4Å; S43-K78 PolarHBondContact O-N 2.89Å
44	D	77.8	Confident	87.9	Confident	112 Å²	112	45.5 Å²	45.5	60%	0.599	22%	0.221	S	C	*	.	S	Bend	trans	-72.5	-18.5	173.6	-74.2	-54.5	0	0	0	113.3	K78	D44-K78 WeakPolarHBondContact OD1-CE 3.21Å; D44-K78 IonicContact OD1-NZ 3.03Å; D44-K78 PolarHBondContact OD1-NZ 2.9Å
45	K	81.9	Confident	88.1	Confident	176 Å²	176	44.7 Å²	44.7	77%	0.765	21%	0.211	S	C	*	.	S	Bend	trans	-135.6	-26.3	-163.7	-63	-176.2	-178	179.4	0	115.6	S43	S43-K45 VanDerWaalsContact C-N 3.26Å; S43-K45 PolarHBondContact O-N 2.77Å; S43-K45 PolarHBondContact OG-N 3.06Å
46	L	82.7	Confident	88.3	Confident	78 Å²	78	45.4 Å²	45.4	41%	0.408	21%	0.214	S	C	.	.			trans	-115.6	133.1	-169.8	-61.9	177.2	0	0	0	111.2	N41 S43 Y48 P111	N41-L46 PolarHBondContact ND2-O 2.89Å; S43-L46 WeakPolarHBondContact CB-O 3.48Å; S43-L46 PolarHBondContact OG-N 2.84Å; S43-L46 PolarHBondContact OG-O 2.81Å; L46-Y48 HydrophobicContact CB-CD2 4.42Å; L46-Y48 HydrophobicContact CB-CE2 3.81Å; L46-Y48 WeakPolarHBondContact O-CD2 3.39Å; L46-P111 HydrophobicContact CB-CG 4.2Å; L46-P111 HydrophobicContact CD1-CG 4.39Å; L46-P111 HydrophobicContact CD2-CG 4.06Å; L46-P111 HydrophobicContact CG-CG 4.45Å
47	P	87.2	Confident	88.4	Confident	28 Å²	28	48.8 Å²	48.8	18%	0.182	23%	0.225	C	C	.	.			trans	-72.2	152.5	167.8	32	-34.7	0	0	0	110	L75 P111	P47-L75 VanDerWaalsContact CA-O 3.26Å; P47-L75 WeakPolarHBondContact CA-O 3.29Å; P47-P111 WeakPolarHBondContact O-CD 3.39Å
48	Y	87.1	Confident	88.4	Confident	34 Å²	34	57 Å²	57	13%	0.133	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	148.1	175.3	-80	-100.7	0	0	0	110.5	A18 L19 L46 R74 L75 E108 P110	A18-Y48 HydrophobicContact CB-CD1 4.01Å; A18-Y48 HydrophobicContact CB-CD2 3.65Å; A18-Y48 HydrophobicContact CB-CE1 3.64Å; A18-Y48 HydrophobicContact CB-CE2 3.28Å; A18-Y48 HydrophobicContact CB-CG 4.02Å; L19-Y48 HydrophobicContact CD2-CG 4.47Å; L19-Y48 HydrophobicContact CG-CG 4.39Å; L46-Y48 HydrophobicContact CB-CD2 4.42Å; L46-Y48 HydrophobicContact CB-CE2 3.81Å; L46-Y48 WeakPolarHBondContact O-CD2 3.39Å; Y48-R74 WeakPolarHBondContact O-CA 3.4Å; Y48-L75 PolarHBondContact N-O 3.15Å; Y48-L75 PolarHBondContact O-N 3.23Å; Y48-E108 HydrophobicContact CD1-CB 3.99Å; Y48-E108 HydrophobicContact CD1-CG 4.16Å; Y48-E108 HydrophobicContact CE1-CG 4.28Å; Y48-P110 HydrophobicContact CD1-CB 4.28Å; Y48-P110 HydrophobicContact CE1-CB 3.7Å
49	L	90.7	Very high	88.4	Confident	60 Å²	60	54.2 Å²	54.2	31%	0.314	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	132.4	163.5	-54.8	162.2	0	0	0	109.7	I72 Q73 R74 E108 I109	L49-I72 HydrophobicContact CB-CG1 4.35Å; L49-I72 HydrophobicContact CD1-CD1 4.31Å; L49-Q73 CarbonylContact C-O 3.55Å; L49-Q73 VanDerWaalsContact CA-O 3.24Å; L49-Q73 WeakPolarHBondContact CA-O 3.25Å; L49-R74 HydrophobicContact CD2-CB 3.66Å; L49-R74 HydrophobicContact CD2-CG 4.18Å; L49-E108 CarbonylContact O-C 3.55Å; L49-E108 WeakPolarHBondContact O-CA 3.32Å; L49-I109 HydrophobicContact CB-CB 3.98Å; L49-I109 HydrophobicContact CB-CD1 4.21Å; L49-I109 HydrophobicContact CB-CG1 4.31Å; L49-I109 HydrophobicContact CD1-CB 4.4Å; L49-I109 HydrophobicContact CD1-CD1 4.36Å; L49-I109 PolarHBondContact N-O 3.02Å; L49-I109 PolarHBondContact O-N 2.85Å
50	A	91.1	Very high	88.5	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	109.7	168.5	0	0	0	0	0	109	L19 I72 Q73 L75 M106	L19-A50 HydrophobicContact CD1-CB 3.55Å; A50-I72 VanDerWaalsContact O-CA 3.31Å; A50-I72 WeakPolarHBondContact O-CA 3.5Å; A50-Q73 HydrophobicContact CB-CG 3.9Å; A50-Q73 PolarHBondContact N-O 2.78Å; A50-Q73 PolarHBondContact O-N 2.97Å; A50-Q73 VanDerWaalsContact O-N 3.15Å; A50-L75 HydrophobicContact CB-CD1 3.78Å; A50-M106 HydrophobicContact CB-CG 4.33Å; A50-M106 HydrophobicContact CB-SD 4.31Å
51	Y	92.7	Very high	88.7	Confident	78 Å²	78	63 Å²	63	31%	0.306	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	117.9	172.8	-177.2	-126.7	0	0	0	110.5	W53 K61 P71 I72 M106 R107	Y51-W53 AromaticContact CD1-CE3 3.58Å; Y51-W53 HydrophobicContact CD1-CE3 3.58Å; Y51-W53 HydrophobicContact CD1-CH2 4.38Å; Y51-W53 AromaticContact CD1-CZ3 3.41Å; Y51-W53 HydrophobicContact CD1-CZ3 3.41Å; Y51-W53 VanDerWaalsContact CD1-CZ3 3.41Å; Y51-W53 HydrophobicContact CE1-CD2 4.43Å; Y51-W53 AromaticContact CE1-CE3 3.69Å; Y51-W53 HydrophobicContact CE1-CE3 3.69Å; Y51-W53 AromaticContact CE1-CZ3 3.86Å; Y51-W53 HydrophobicContact CE1-CZ3 3.86Å; Y51-W53 HydrophobicContact CG-CE3 4.26Å; Y51-W53 HydrophobicContact CG-CZ3 4.22Å; Y51-W53 WeakPolarHBondContact O-CZ3 3.38Å; Y51-K61 PolarHBondContact OH-NZ 2.87Å; Y51-P71 CarbonylContact C-O 3.5Å; Y51-P71 WeakPolarHBondContact CA-O 2.7Å; Y51-P71 WeakPolarHBondContact CD2-O 3.15Å; Y51-I72 HydrophobicContact CD2-CB 4.23Å; Y51-M106 CarbonylContact O-C 3.44Å; Y51-M106 VanDerWaalsContact O-CA 3.27Å; Y51-M106 WeakPolarHBondContact O-CA 3.38Å; Y51-R107 PolarHBondContact N-O 3.4Å; Y51-R107 PolarHBondContact O-N 2.91Å
52	S	94.5	Very high	88.7	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.014	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	135.2	-167.9	-52.3	0	0	0	0	112.1	P71 Y104 N105	S52-P71 PolarHBondContact N-O 3.02Å; S52-Y104 WeakPolarHBondContact CB-OH 3.26Å; S52-Y104 PolarHBondContact OG-OH 2.77Å; S52-N105 CarbonylContact C-O 3.59Å; S52-N105 VanDerWaalsContact CA-O 3.26Å; S52-N105 WeakPolarHBondContact CA-O 3.29Å
53	W	94.9	Very high	89.2	Confident	19 Å²	19	62 Å²	62	7%	0.072	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	166.3	176	69	97.1	0	0	0	112.9	Y51 E55 K61 N105 R107 Q127	Y51-W53 AromaticContact CD1-CE3 3.58Å; Y51-W53 HydrophobicContact CD1-CE3 3.58Å; Y51-W53 HydrophobicContact CD1-CH2 4.38Å; Y51-W53 AromaticContact CD1-CZ3 3.41Å; Y51-W53 HydrophobicContact CD1-CZ3 3.41Å; Y51-W53 VanDerWaalsContact CD1-CZ3 3.41Å; Y51-W53 HydrophobicContact CE1-CD2 4.43Å; Y51-W53 AromaticContact CE1-CE3 3.69Å; Y51-W53 HydrophobicContact CE1-CE3 3.69Å; Y51-W53 AromaticContact CE1-CZ3 3.86Å; Y51-W53 HydrophobicContact CE1-CZ3 3.86Å; Y51-W53 HydrophobicContact CG-CE3 4.26Å; Y51-W53 HydrophobicContact CG-CZ3 4.22Å; Y51-W53 WeakPolarHBondContact O-CZ3 3.38Å; W53-E55 PolarHBondContact NE1-OE1 2.86Å; W53-K61 HydrophobicContact CB-CD 3.99Å; W53-K61 HydrophobicContact CB-CG 4.28Å; W53-K61 HydrophobicContact CG-CD 3.94Å; W53-K61 HydrophobicContact CG-CG 4.24Å; W53-N105 HydrophobicContact CD2-CB 3.59Å; W53-N105 HydrophobicContact CE3-CB 4Å; W53-N105 HydrophobicContact CG-CB 4.16Å; W53-N105 HydrophobicContact CH2-CB 3.82Å; W53-N105 HydrophobicContact CZ2-CB 3.4Å; W53-N105 HydrophobicContact CZ3-CB 4.09Å; W53-N105 PolarHBondContact N-O 2.93Å; W53-N105 PolarHBondContact O-N 2.8Å; W53-R107 HydrophobicContact CH2-CB 4Å; W53-R107 HydrophobicContact CZ3-CB 3.86Å; W53-Q127 HydrophobicContact CH2-CG 4.22Å
54	L	96.6	Very high	89.8	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	145.3	173.8	-82.3	-67.8	0	0	0	110.9	K61 S62 L66 A68 I85 F102 F103 Y104 V132	L54-K61 WeakPolarHBondContact O-CA 3.4Å; L54-S62 PolarHBondContact O-N 3.31Å; L54-L66 HydrophobicContact CD1-CB 4.46Å; L54-L66 HydrophobicContact CG-CB 3.96Å; L54-A68 HydrophobicContact CD2-CB 3.53Å; L54-I85 HydrophobicContact CD2-CG1 4.37Å; L54-I85 HydrophobicContact CD2-CG2 4.25Å; L54-I85 HydrophobicContact CG-CG2 4.45Å; L54-F102 HydrophobicContact CD1-CB 4.47Å; L54-F103 CarbonylContact C-O 3.45Å; L54-F103 WeakPolarHBondContact CA-O 3.42Å; L54-Y104 HydrophobicContact CD2-CD2 4.06Å; L54-V132 HydrophobicContact CD1-CG2 4.06Å
55	E	95.9	Very high	90.6	Very high	22 Å²	22	62.9 Å²	62.9	10%	0.103	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	148.7	169.9	-70	166.4	-172.5	0	0	110	W53 E60 F102 F103 N105 R129	W53-E55 PolarHBondContact NE1-OE1 2.86Å; E55-E60 CarbonylContact C-O 3.51Å; E55-E60 VanDerWaalsContact CA-O 3.26Å; E55-E60 WeakPolarHBondContact CA-O 3.08Å; E55-F102 CarbonylContact O-C 3.51Å; E55-F102 WeakPolarHBondContact O-CA 3.27Å; E55-F102 WeakPolarHBondContact O-CB 3.45Å; E55-F103 HydrophobicContact CB-CB 4.28Å; E55-F103 PolarHBondContact N-O 3.01Å; E55-F103 PolarHBondContact O-N 2.97Å; E55-N105 WeakPolarHBondContact CG-ND2 3.44Å; E55-N105 PolarHBondContact OE1-ND2 3.18Å; E55-N105 VanDerWaalsContact OE1-ND2 3.15Å; E55-N105 PolarHBondContact OE2-ND2 2.83Å; E55-R129 IonicContact OE2-CZ 3.24Å; E55-R129 IonicContact OE2-NE 3.94Å; E55-R129 PolarHBondContact OE2-NE 3.14Å; E55-R129 IonicContact OE2-NH2 2.69Å; E55-R129 PolarHBondContact OE2-NH2 3.19Å
56	N	92.8	Very high	91.3	Very high	41 Å²	41	54.6 Å²	54.6	22%	0.219	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	178.7	166	70.6	15.5	0	0	0	111.5	K58 G59 E60	N56-K58 PolarHBondContact O-N 3.08Å; N56-K58 VanDerWaalsContact O-N 3.13Å; N56-K58 WeakPolarHBondContact OD1-CA 3.43Å; N56-K58 WeakPolarHBondContact OD1-CB 3.31Å; N56-K58 PolarHBondContact OD1-N 3.34Å; N56-G59 PolarHBondContact O-N 3.32Å; N56-G59 PolarHBondContact OD1-N 3.25Å; N56-E60 PolarHBondContact N-O 3.26Å; N56-E60 PolarHBondContact ND2-OE2 3.38Å; N56-E60 PolarHBondContact OD1-N 2.84Å
57	E	90.1	Very high	91.9	Very high	110 Å²	110	51.7 Å²	51.7	51%	0.514	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-26.2	179.6	-172.9	167.9	-143.7	0	0	113.6	G59 L101 Y169	E57-G59 VanDerWaalsContact C-N 3.28Å; E57-G59 PolarHBondContact O-N 2.96Å; E57-L101 HydrophobicContact CG-CD2 4.27Å; E57-Y169 PolarHBondContact OE1-OH 3.48Å
58	K	89.8	Confident	92.3	Very high	172 Å²	172	50.5 Å²	50.5	75%	0.748	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-4.6	176.4	-58.9	179.1	-177.8	174.8	0	113.6	N56 E60	N56-K58 PolarHBondContact O-N 3.08Å; N56-K58 VanDerWaalsContact O-N 3.13Å; N56-K58 WeakPolarHBondContact OD1-CA 3.43Å; N56-K58 WeakPolarHBondContact OD1-CB 3.31Å; N56-K58 PolarHBondContact OD1-N 3.34Å; K58-E60 HydrophobicContact CB-CG 4.11Å
59	G	87.9	Confident	92.6	Very high	29 Å²	29	52.9 Å²	52.9	30%	0.299	27%	0.265	S	S	.	.	S	Bend	trans	81.4	13.6	-175.4	0	0	0	0	0	114	N56 E57	N56-G59 PolarHBondContact O-N 3.32Å; N56-G59 PolarHBondContact OD1-N 3.25Å; E57-G59 VanDerWaalsContact C-N 3.28Å; E57-G59 PolarHBondContact O-N 2.96Å
60	E	90.5	Very high	92.8	Very high	103 Å²	103	52.5 Å²	52.5	48%	0.481	27%	0.266	S	S	.	.			trans	-85.2	124.6	178.1	-57	164.2	150.7	0	0	109	E55 N56 K58 S62	E55-E60 CarbonylContact C-O 3.51Å; E55-E60 VanDerWaalsContact CA-O 3.26Å; E55-E60 WeakPolarHBondContact CA-O 3.08Å; N56-E60 PolarHBondContact N-O 3.26Å; N56-E60 PolarHBondContact ND2-OE2 3.38Å; N56-E60 PolarHBondContact OD1-N 2.84Å; K58-E60 HydrophobicContact CB-CG 4.11Å; E60-S62 PolarHBondContact O-N 3.09Å
61	K	92.5	Very high	92.7	Very high	100 Å²	100	55.5 Å²	55.5	44%	0.435	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-66.2	125.9	173.7	178.7	177.3	174.5	180	0	109.7	Y51 W53 L54	Y51-K61 PolarHBondContact OH-NZ 2.87Å; W53-K61 HydrophobicContact CB-CD 3.99Å; W53-K61 HydrophobicContact CB-CG 4.28Å; W53-K61 HydrophobicContact CG-CD 3.94Å; W53-K61 HydrophobicContact CG-CG 4.24Å; L54-K61 WeakPolarHBondContact O-CA 3.4Å
62	S	85.5	Confident	92.8	Very high	35 Å²	35	56 Å²	56	25%	0.245	29%	0.293	C	S	.	.			trans	-151.5	137.9	175.3	169.6	0	0	0	0	110.2	L54 E60 D64	L54-S62 PolarHBondContact O-N 3.31Å; E60-S62 PolarHBondContact O-N 3.09Å; S62-D64 WeakPolarHBondContact OG-CB 3.26Å; S62-D64 VanDerWaalsContact OG-CG 3.27Å; S62-D64 PolarHBondContact OG-N 2.93Å; S62-D64 VanDerWaalsContact OG-N 3.1Å; S62-D64 PolarHBondContact OG-OD2 3.2Å
63	D	91.4	Very high	92.6	Very high	80 Å²	80	57.1 Å²	57.1	43%	0.428	30%	0.298	S	S	.	.			trans	-100.1	6.3	175.1	-70.4	-22.2	0	0	0	111.4	L65 V67 Q88	D63-L65 VanDerWaalsContact C-N 3.33Å; D63-L65 PolarHBondContact O-N 2.93Å; D63-V67 HydrophobicContact CB-CG1 4.49Å; D63-V67 HydrophobicContact CB-CG2 3.69Å; D63-V67 WeakPolarHBondContact O-CG2 3.44Å; D63-Q88 WeakPolarHBondContact O-CG 3.44Å
64	D	91.6	Very high	92.6	Very high	111 Å²	111	61.9 Å²	61.9	59%	0.594	32%	0.316	S	S	*	.	S	Bend	trans	-70.9	-28.2	-172	-63.9	-38	0	0	0	113.4	S62 Q88 S90	S62-D64 WeakPolarHBondContact OG-CB 3.26Å; S62-D64 VanDerWaalsContact OG-CG 3.27Å; S62-D64 PolarHBondContact OG-N 2.93Å; S62-D64 VanDerWaalsContact OG-N 3.1Å; S62-D64 PolarHBondContact OG-OD2 3.2Å; D64-Q88 WeakPolarHBondContact O-CB 3.29Å; D64-S90 VanDerWaalsContact O-CB 3.25Å; D64-S90 WeakPolarHBondContact O-CB 3.2Å; D64-S90 PolarHBondContact O-OG 3.28Å
65	L	95.9	Very high	92.3	Very high	41 Å²	41	62 Å²	62	22%	0.215	32%	0.316	C	S	.	.	S	Bend	trans	-113.7	-50.2	-173.5	-69	164.1	0	0	0	111.3	D63 Q88 S90 T91 L94 F102	D63-L65 VanDerWaalsContact C-N 3.33Å; D63-L65 PolarHBondContact O-N 2.93Å; L65-Q88 WeakPolarHBondContact O-CB 3.23Å; L65-Q88 PolarHBondContact O-N 2.77Å; L65-S90 VanDerWaalsContact CD2-C 3.46Å; L65-S90 VanDerWaalsContact CD2-O 3.29Å; L65-S90 WeakPolarHBondContact CD2-O 3.21Å; L65-T91 HydrophobicContact CB-CG2 4.25Å; L65-T91 HydrophobicContact CD2-CG2 4.23Å; L65-T91 WeakPolarHBondContact O-CG2 3.32Å; L65-L94 HydrophobicContact CD1-CD2 4.09Å; L65-L94 HydrophobicContact CD2-CD1 4.41Å; L65-L94 HydrophobicContact CD2-CD2 4.22Å; L65-L94 HydrophobicContact CD2-CG 4.15Å; L65-F102 HydrophobicContact CB-CE1 4.15Å; L65-F102 HydrophobicContact CB-CZ 4.26Å; L65-F102 HydrophobicContact CD1-CE1 3.77Å; L65-F102 HydrophobicContact CD1-CZ 3.89Å
66	L	96.3	Very high	92.1	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.005	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	137.5	-178.9	-63	178.2	0	0	0	109	F28 L54 I85 V86 K87 T91 F102 V132 W134	F28-L66 HydrophobicContact CD2-CD2 4.03Å; F28-L66 HydrophobicContact CE2-CD2 3.92Å; F28-L66 HydrophobicContact CZ-CD2 4.33Å; L54-L66 HydrophobicContact CD1-CB 4.46Å; L54-L66 HydrophobicContact CG-CB 3.96Å; L66-I85 HydrophobicContact CB-CG2 4.07Å; L66-I85 HydrophobicContact CD2-CG2 4.47Å; L66-V86 WeakPolarHBondContact CA-O 3.28Å; L66-K87 HydrophobicContact CD2-CB 4.23Å; L66-T91 HydrophobicContact CD2-CG2 4.27Å; L66-F102 HydrophobicContact CD1-CB 4.33Å; L66-F102 HydrophobicContact CD1-CD1 4.36Å; L66-F102 HydrophobicContact CD1-CD2 3.71Å; L66-F102 HydrophobicContact CD1-CE2 4.04Å; L66-F102 HydrophobicContact CD1-CG 3.88Å; L66-F102 HydrophobicContact CD1-CZ 4.49Å; L66-V132 HydrophobicContact CD1-CG1 4.07Å; L66-W134 HydrophobicContact CD2-CE3 3.97Å; L66-W134 HydrophobicContact CD2-CZ3 3.9Å
67	V	95.8	Very high	91.8	Very high	18 Å²	18	62.5 Å²	62.5	11%	0.109	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	132.7	-177.4	-173.8	0	0	0	0	110.4	D63 L69 I85 V86 Q88	D63-V67 HydrophobicContact CB-CG1 4.49Å; D63-V67 HydrophobicContact CB-CG2 3.69Å; D63-V67 WeakPolarHBondContact O-CG2 3.44Å; V67-L69 HydrophobicContact CG1-CD2 3.85Å; V67-L69 HydrophobicContact CG1-CG 4.04Å; V67-I85 CarbonylContact O-C 3.57Å; V67-I85 VanDerWaalsContact O-CA 3.28Å; V67-I85 WeakPolarHBondContact O-CA 3.43Å; V67-V86 PolarHBondContact N-O 3.03Å; V67-V86 PolarHBondContact O-N 2.85Å; V67-Q88 HydrophobicContact CG2-CG 3.89Å; V67-Q88 VanDerWaalsContact CG2-NE2 3.28Å
68	A	95.1	Very high	91.5	Very high	3 Å²	3	64.1 Å²	64.1	3%	0.025	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	125.5	173.1	0	0	0	0	0	110.8	L54 V83 R84 Y104	L54-A68 HydrophobicContact CD2-CB 3.53Å; A68-V83 HydrophobicContact CB-CG1 3.92Å; A68-R84 CarbonylContact C-O 3.48Å; A68-R84 WeakPolarHBondContact CA-O 3.1Å; A68-Y104 HydrophobicContact CB-CD2 4.3Å; A68-Y104 HydrophobicContact CB-CE2 3.94Å
69	L	92.5	Very high	91.3	Very high	83 Å²	83	57.4 Å²	57.4	44%	0.435	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	133.6	-177.9	-61.5	176.5	0	0	0	111	V67 R84 V86	V67-L69 HydrophobicContact CG1-CD2 3.85Å; V67-L69 HydrophobicContact CG1-CG 4.04Å; L69-R84 PolarHBondContact N-O 2.99Å; L69-R84 PolarHBondContact O-N 2.82Å; L69-V86 HydrophobicContact CD1-CG2 4.11Å
70	P	94.5	Very high	91.3	Very high	52 Å²	52	58.9 Å²	58.9	34%	0.338	31%	0.306	S	S	.	.	S	Bend	cis	-70.9	147.4	-8.6	31.2	-34.7	0	0	0	111.3	I72 Q73	P70-I72 VanDerWaalsContact C-N 3.28Å; P70-I72 PolarHBondContact O-N 2.77Å; P70-Q73 HydrophobicContact CG-CB 4Å; P70-Q73 HydrophobicContact CG-CG 4.23Å
71	P	90.2	Very high	91.1	Very high	63 Å²	63	55.8 Å²	55.8	41%	0.409	29%	0.294	S	S	.	.	S	Bend	trans	-72.1	-23.1	179.1	29.4	-35.3	0	0	0	112.3	Y51 S52	Y51-P71 CarbonylContact C-O 3.5Å; Y51-P71 WeakPolarHBondContact CA-O 2.7Å; Y51-P71 WeakPolarHBondContact CD2-O 3.15Å; S52-P71 PolarHBondContact N-O 3.02Å
72	I	93.6	Very high	91	Very high	88 Å²	88	54.8 Å²	54.8	45%	0.451	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	138.3	172.6	-164.9	167.2	0	0	0	109.8	L49 A50 Y51 P70	L49-I72 HydrophobicContact CB-CG1 4.35Å; L49-I72 HydrophobicContact CD1-CD1 4.31Å; A50-I72 VanDerWaalsContact O-CA 3.31Å; A50-I72 WeakPolarHBondContact O-CA 3.5Å; Y51-I72 HydrophobicContact CD2-CB 4.23Å; P70-I72 VanDerWaalsContact C-N 3.28Å; P70-I72 PolarHBondContact O-N 2.77Å
73	Q	92.3	Very high	91.2	Very high	26 Å²	26	53.1 Å²	53.1	12%	0.121	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	148.5	177.3	53.1	-177.7	-25.3	0	0	110.7	L49 A50 P70 L75 T81	L49-Q73 CarbonylContact C-O 3.55Å; L49-Q73 VanDerWaalsContact CA-O 3.24Å; L49-Q73 WeakPolarHBondContact CA-O 3.25Å; A50-Q73 HydrophobicContact CB-CG 3.9Å; A50-Q73 PolarHBondContact N-O 2.78Å; A50-Q73 PolarHBondContact O-N 2.97Å; A50-Q73 VanDerWaalsContact O-N 3.15Å; P70-Q73 HydrophobicContact CG-CB 4Å; P70-Q73 HydrophobicContact CG-CG 4.23Å; Q73-L75 HydrophobicContact CG-CD1 3.83Å; Q73-T81 HydrophobicContact CG-CG2 4.45Å; Q73-T81 VanDerWaalsContact NE2-CG2 3.32Å; Q73-T81 PolarHBondContact OE1-OG1 3.08Å
74	R	93.1	Very high	91.3	Very high	120 Å²	120	56 Å²	56	45%	0.453	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	130.6	174.9	-176.1	171.8	163.2	169.2	-8.3	109.1	Y48 L49 E76	Y48-R74 WeakPolarHBondContact O-CA 3.4Å; L49-R74 HydrophobicContact CD2-CB 3.66Å; L49-R74 HydrophobicContact CD2-CG 4.18Å; R74-E76 IonicContact CZ-OE1 2.69Å; R74-E76 IonicContact NE-OE1 3.42Å; R74-E76 PolarHBondContact NE-OE1 2.85Å; R74-E76 IonicContact NH2-OE1 2.94Å; R74-E76 PolarHBondContact NH2-OE1 2.9Å; R74-E76 IonicContact NH2-OE2 2.95Å; R74-E76 PolarHBondContact NH2-OE2 2.53Å
75	L	90.4	Very high	91.5	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.016	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	120.5	173.2	-68.7	73.4	0	0	0	108.1	L19 V39 N41 P47 Y48 A50 Q73 A79 T81	L19-L75 HydrophobicContact CD2-CB 4.41Å; L19-L75 HydrophobicContact CD2-CD2 3.89Å; V39-L75 HydrophobicContact CG1-CD2 4.03Å; N41-L75 HydrophobicContact CB-CB 3.72Å; N41-L75 HydrophobicContact CB-CD2 4.03Å; N41-L75 PolarHBondContact ND2-O 2.82Å; P47-L75 VanDerWaalsContact CA-O 3.26Å; P47-L75 WeakPolarHBondContact CA-O 3.29Å; Y48-L75 PolarHBondContact N-O 3.15Å; Y48-L75 PolarHBondContact O-N 3.23Å; A50-L75 HydrophobicContact CB-CD1 3.78Å; Q73-L75 HydrophobicContact CG-CD1 3.83Å; L75-A79 HydrophobicContact CB-CB 4.41Å; L75-T81 HydrophobicContact CD1-CG2 3.87Å; L75-T81 HydrophobicContact CD2-CG2 3.62Å; L75-T81 HydrophobicContact CG-CG2 3.77Å
76	E	91.8	Very high	91.4	Very high	33 Å²	33	50.7 Å²	50.7	15%	0.154	26%	0.258	C	S	.	.			trans	-66.3	163.5	170.6	-66.5	-49	133.5	0	0	111.2	N41 R74 K78 A79	N41-E76 WeakPolarHBondContact CB-O 3.19Å; N41-E76 PolarHBondContact ND2-O 2.79Å; R74-E76 IonicContact CZ-OE1 2.69Å; R74-E76 IonicContact NE-OE1 3.42Å; R74-E76 PolarHBondContact NE-OE1 2.85Å; R74-E76 IonicContact NH2-OE1 2.94Å; R74-E76 PolarHBondContact NH2-OE1 2.9Å; R74-E76 IonicContact NH2-OE2 2.95Å; R74-E76 PolarHBondContact NH2-OE2 2.53Å; E76-K78 PolarHBondContact O-N 3.18Å; E76-A79 HydrophobicContact CB-CB 4.28Å; E76-A79 WeakPolarHBondContact O-CB 3.46Å; E76-A79 PolarHBondContact O-N 2.76Å
77	P	87.2	Confident	91.3	Very high	42 Å²	42	53.4 Å²	53.4	27%	0.273	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	132.1	175.6	-27.5	36	0	0	0	111.6	S43 A79	S43-P77 VanDerWaalsContact O-CA 3.31Å; S43-P77 WeakPolarHBondContact O-CA 2.91Å; S43-P77 WeakPolarHBondContact O-CB 3.4Å; P77-A79 PolarHBondContact O-N 2.93Å; P77-A79 VanDerWaalsContact O-N 3.12Å
78	K	84.3	Confident	91.3	Very high	143 Å²	143	56 Å²	56	62%	0.622	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	5.1	-178	-49.1	-175.3	-176.4	-156.7	0	115.9	N41 S43 D44 E76	N41-K78 WeakPolarHBondContact O-CA 3.49Å; N41-K78 PolarHBondContact O-N 3.13Å; S43-K78 PolarHBondContact O-N 2.89Å; D44-K78 WeakPolarHBondContact OD1-CE 3.21Å; D44-K78 IonicContact OD1-NZ 3.03Å; D44-K78 PolarHBondContact OD1-NZ 2.9Å; E76-K78 PolarHBondContact O-N 3.18Å
79	A	85	Confident	91.1	Very high	31 Å²	31	60.3 Å²	60.3	26%	0.256	32%	0.316	S	S	.	.			trans	-72.8	149.7	178.8	0	0	0	0	0	111.5	N41 L75 E76 P77	N41-A79 PolarHBondContact N-O 2.97Å; L75-A79 HydrophobicContact CB-CB 4.41Å; E76-A79 HydrophobicContact CB-CB 4.28Å; E76-A79 WeakPolarHBondContact O-CB 3.46Å; E76-A79 PolarHBondContact O-N 2.76Å; P77-A79 PolarHBondContact O-N 2.93Å; P77-A79 VanDerWaalsContact O-N 3.12Å
80	T	87.6	Confident	91.2	Very high	60 Å²	60	58.4 Å²	58.4	37%	0.368	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	143.3	171.3	-66.5	0	0	0	0	108.4	R38 V39 D40	R38-T80 HydrophobicContact CG-CG2 3.4Å; V39-T80 CarbonylContact O-C 3.6Å; V39-T80 WeakPolarHBondContact O-CA 3.31Å; D40-T80 WeakPolarHBondContact OD1-CB 3.4Å; D40-T80 WeakPolarHBondContact OD1-CG2 3.34Å; D40-T80 PolarHBondContact OD1-OG1 2.98Å
81	T	86.6	Confident	91.2	Very high	38 Å²	38	56.6 Å²	56.6	23%	0.233	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	176.5	174	-170.6	0	0	0	0	111.2	R38 V39 Q73 L75	R38-T81 CarbonylContact C-O 3.59Å; R38-T81 WeakPolarHBondContact CA-O 3.37Å; V39-T81 HydrophobicContact CB-CG2 3.96Å; V39-T81 PolarHBondContact N-O 3.23Å; V39-T81 PolarHBondContact O-N 2.79Å; Q73-T81 HydrophobicContact CG-CG2 4.45Å; Q73-T81 VanDerWaalsContact NE2-CG2 3.32Å; Q73-T81 PolarHBondContact OE1-OG1 3.08Å; L75-T81 HydrophobicContact CD1-CG2 3.87Å; L75-T81 HydrophobicContact CD2-CG2 3.62Å; L75-T81 HydrophobicContact CG-CG2 3.77Å
82	Q	90.5	Very high	91.2	Very high	80 Å²	80	58 Å²	58	37%	0.374	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	134.9	176.5	-175.1	176.2	84.5	0	0	111.4	S36 L37 R84	S36-Q82 VanDerWaalsContact CB-CD 3.45Å; S36-Q82 VanDerWaalsContact CB-NE2 3.25Å; S36-Q82 PolarHBondContact OG-NE2 2.81Å; S36-Q82 PolarHBondContact OG-OE1 3Å; L37-Q82 CarbonylContact O-C 3.57Å; L37-Q82 WeakPolarHBondContact O-CA 3.37Å; Q82-R84 HydrophobicContact CG-CG 4.49Å
83	V	90.7	Very high	91.2	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126.5	165.5	179.8	0	0	0	0	108.7	S36 L37 V39 A68 Y104	S36-V83 WeakPolarHBondContact CA-O 3.43Å; L37-V83 PolarHBondContact N-O 3.09Å; L37-V83 PolarHBondContact O-N 3.22Å; V39-V83 HydrophobicContact CG2-CG2 4.16Å; A68-V83 HydrophobicContact CB-CG1 3.92Å; V83-Y104 HydrophobicContact CG1-CE2 3.84Å
84	R	93.3	Very high	91.4	Very high	139 Å²	139	62.3 Å²	62.3	53%	0.525	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	125	175.3	-65.7	-176.4	178.9	176	0.6	109.8	T35 A68 L69 Q82 V86	T35-R84 CarbonylContact O-C 3.53Å; A68-R84 CarbonylContact C-O 3.48Å; A68-R84 WeakPolarHBondContact CA-O 3.1Å; L69-R84 PolarHBondContact N-O 2.99Å; L69-R84 PolarHBondContact O-N 2.82Å; Q82-R84 HydrophobicContact CG-CG 4.49Å; R84-V86 HydrophobicContact CB-CG2 4.34Å
85	I	94.4	Very high	91.5	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	120.3	166.8	-55.2	178.2	0	0	0	106.7	I26 F28 A34 T35 L54 L66 V67 Y104 V132	I26-I85 HydrophobicContact CD1-CD1 3.64Å; F28-I85 HydrophobicContact CD2-CB 4.46Å; F28-I85 HydrophobicContact CD2-CG2 3.99Å; F28-I85 HydrophobicContact CE2-CB 4.33Å; F28-I85 HydrophobicContact CE2-CG2 3.94Å; F28-I85 VanDerWaalsContact CE2-O 3.29Å; F28-I85 WeakPolarHBondContact CE2-O 3.4Å; A34-I85 CarbonylContact C-O 3.53Å; A34-I85 WeakPolarHBondContact CA-O 3.07Å; A34-I85 VanDerWaalsContact CB-O 3.3Å; A34-I85 WeakPolarHBondContact CB-O 2.98Å; T35-I85 HydrophobicContact CG2-CB 3.94Å; T35-I85 HydrophobicContact CG2-CD1 4.46Å; T35-I85 PolarHBondContact N-O 2.88Å; T35-I85 PolarHBondContact O-N 2.79Å; L54-I85 HydrophobicContact CD2-CG1 4.37Å; L54-I85 HydrophobicContact CD2-CG2 4.25Å; L54-I85 HydrophobicContact CG-CG2 4.45Å; L66-I85 HydrophobicContact CB-CG2 4.07Å; L66-I85 HydrophobicContact CD2-CG2 4.47Å; V67-I85 CarbonylContact O-C 3.57Å; V67-I85 VanDerWaalsContact O-CA 3.28Å; V67-I85 WeakPolarHBondContact O-CA 3.43Å; I85-Y104 HydrophobicContact CD1-CD2 3.92Å; I85-Y104 HydrophobicContact CD1-CG 4.29Å; I85-Y104 HydrophobicContact CG1-CD2 4.3Å; I85-V132 HydrophobicContact CD1-CG2 4.18Å
86	V	94.4	Very high	91.8	Very high	40 Å²	40	61.4 Å²	61.4	24%	0.242	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	136.6	-174.8	-175.1	0	0	0	0	109.8	A34 L66 V67 L69 R84	A34-V86 HydrophobicContact CB-CG2 4.06Å; L66-V86 WeakPolarHBondContact CA-O 3.28Å; V67-V86 PolarHBondContact N-O 3.03Å; V67-V86 PolarHBondContact O-N 2.85Å; L69-V86 HydrophobicContact CD1-CG2 4.11Å; R84-V86 HydrophobicContact CB-CG2 4.34Å
87	K	94.8	Very high	91.9	Very high	58 Å²	58	63.8 Å²	63.8	25%	0.252	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	140.9	174.9	75.5	177.5	176.3	-152.6	0	111.8	F28 A30 N31 D32 K33 L66 T91 W134	F28-K87 HydrophobicContact CE1-CB 4Å; F28-K87 HydrophobicContact CE1-CD 4.42Å; F28-K87 HydrophobicContact CZ-CB 3.72Å; F28-K87 HydrophobicContact CZ-CG 4.42Å; A30-K87 PolarHBondContact O-NZ 2.74Å; N31-K87 PolarHBondContact O-NZ 3.25Å; D32-K87 WeakPolarHBondContact O-CD 3.38Å; D32-K87 WeakPolarHBondContact O-CE 3.29Å; D32-K87 PolarHBondContact O-NZ 2.96Å; K33-K87 PolarHBondContact O-N 2.78Å; L66-K87 HydrophobicContact CD2-CB 4.23Å; K87-T91 HydrophobicContact CB-CG2 4.13Å; K87-W134 HydrophobicContact CB-CH2 4.17Å; K87-W134 HydrophobicContact CB-CZ3 3.93Å; K87-W134 HydrophobicContact CD-CH2 4.01Å; K87-W134 HydrophobicContact CD-CZ3 4.45Å
88	Q	95.1	Very high	92.4	Very high	74 Å²	74	66.1 Å²	66.1	35%	0.346	37%	0.367	S	S	.	.			trans	-96.5	160.7	170.9	-62.4	-59	-35.9	0	0	111.3	D63 D64 L65 V67 S90 T91	D63-Q88 WeakPolarHBondContact O-CG 3.44Å; D64-Q88 WeakPolarHBondContact O-CB 3.29Å; L65-Q88 WeakPolarHBondContact O-CB 3.23Å; L65-Q88 PolarHBondContact O-N 2.77Å; V67-Q88 HydrophobicContact CG2-CG 3.89Å; V67-Q88 VanDerWaalsContact CG2-NE2 3.28Å; Q88-S90 PolarHBondContact O-N 2.93Å; Q88-T91 WeakPolarHBondContact O-CB 2.89Å; Q88-T91 WeakPolarHBondContact O-CG2 3.41Å; Q88-T91 PolarHBondContact O-N 2.85Å; Q88-T91 PolarHBondContact O-OG1 2.81Å
89	A	91.7	Very high	93	Very high	93 Å²	93	59.5 Å²	59.5	77%	0.769	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-57.5	-33.1	178	0	0	0	0	0	112.8	T91 A92	A89-T91 PolarHBondContact O-N 2.81Å; A89-T91 VanDerWaalsContact O-N 3.07Å; A89-A92 PolarHBondContact O-N 2.9Å
90	S	93.6	Very high	93.6	Very high	43 Å²	43	59.2 Å²	59.2	30%	0.301	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-62.9	-14	178.2	-55.7	0	0	0	0	114	D64 L65 Q88 A92 K93	D64-S90 VanDerWaalsContact O-CB 3.25Å; D64-S90 WeakPolarHBondContact O-CB 3.2Å; D64-S90 PolarHBondContact O-OG 3.28Å; L65-S90 VanDerWaalsContact CD2-C 3.46Å; L65-S90 VanDerWaalsContact CD2-O 3.29Å; L65-S90 WeakPolarHBondContact CD2-O 3.21Å; Q88-S90 PolarHBondContact O-N 2.93Å; S90-A92 PolarHBondContact O-N 2.89Å; S90-A92 VanDerWaalsContact O-N 3.14Å; S90-K93 VanDerWaalsContact O-CB 3.32Å; S90-K93 WeakPolarHBondContact O-CB 3.13Å; S90-K93 WeakPolarHBondContact O-CG 3.01Å; S90-K93 PolarHBondContact O-N 2.9Å
91	T	94	Very high	94	Very high	14 Å²	14	56.5 Å²	56.5	9%	0.086	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-60.5	-20.1	174.7	55.4	0	0	0	0	113.2	L65 L66 K87 Q88 A89 K93 L94 W134	L65-T91 HydrophobicContact CB-CG2 4.25Å; L65-T91 HydrophobicContact CD2-CG2 4.23Å; L65-T91 WeakPolarHBondContact O-CG2 3.32Å; L66-T91 HydrophobicContact CD2-CG2 4.27Å; K87-T91 HydrophobicContact CB-CG2 4.13Å; Q88-T91 WeakPolarHBondContact O-CB 2.89Å; Q88-T91 WeakPolarHBondContact O-CG2 3.41Å; Q88-T91 PolarHBondContact O-N 2.85Å; Q88-T91 PolarHBondContact O-OG1 2.81Å; A89-T91 PolarHBondContact O-N 2.81Å; A89-T91 VanDerWaalsContact O-N 3.07Å; T91-K93 PolarHBondContact O-N 2.89Å; T91-K93 VanDerWaalsContact O-N 3.12Å; T91-L94 HydrophobicContact CG2-CD1 4.22Å; T91-L94 VanDerWaalsContact O-CB 3.3Å; T91-L94 WeakPolarHBondContact O-CB 3.22Å; T91-L94 WeakPolarHBondContact O-CG 3.36Å; T91-L94 PolarHBondContact O-N 3.19Å; T91-W134 VanDerWaalsContact CB-CH2 3.41Å; T91-W134 HydrophobicContact CG2-CE3 4.45Å; T91-W134 HydrophobicContact CG2-CH2 3.74Å; T91-W134 HydrophobicContact CG2-CZ2 4.33Å; T91-W134 HydrophobicContact CG2-CZ3 3.81Å; T91-W134 WeakPolarHBondContact OG1-CH2 3.41Å
92	A	91.7	Very high	94.5	Very high	93 Å²	93	55.2 Å²	55.2	77%	0.769	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-60.2	-17	170.6	0	0	0	0	0	113.9	A89 S90 L94	A89-A92 PolarHBondContact O-N 2.9Å; S90-A92 PolarHBondContact O-N 2.89Å; S90-A92 VanDerWaalsContact O-N 3.14Å; A92-L94 VanDerWaalsContact C-N 3.35Å
93	K	93.6	Very high	94.7	Very high	176 Å²	176	52.6 Å²	52.6	77%	0.765	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-83.7	-9.4	175.7	-59.5	175.6	-178.6	173.4	0	113.2	S90 T91	S90-K93 VanDerWaalsContact O-CB 3.32Å; S90-K93 WeakPolarHBondContact O-CB 3.13Å; S90-K93 WeakPolarHBondContact O-CG 3.01Å; S90-K93 PolarHBondContact O-N 2.9Å; T91-K93 PolarHBondContact O-N 2.89Å; T91-K93 VanDerWaalsContact O-N 3.12Å
94	L	95.5	Very high	95	Very high	28 Å²	28	52.6 Å²	52.6	15%	0.147	30%	0.295	C	S	.	.	S	Bend	trans	-72.4	149.9	179.8	-64.7	175.9	0	0	0	110.9	L65 T91 A92 G96 T100 F102 W134	L65-L94 HydrophobicContact CD1-CD2 4.09Å; L65-L94 HydrophobicContact CD2-CD1 4.41Å; L65-L94 HydrophobicContact CD2-CD2 4.22Å; L65-L94 HydrophobicContact CD2-CG 4.15Å; T91-L94 HydrophobicContact CG2-CD1 4.22Å; T91-L94 VanDerWaalsContact O-CB 3.3Å; T91-L94 WeakPolarHBondContact O-CB 3.22Å; T91-L94 WeakPolarHBondContact O-CG 3.36Å; T91-L94 PolarHBondContact O-N 3.19Å; A92-L94 VanDerWaalsContact C-N 3.35Å; L94-G96 PolarHBondContact O-N 3.4Å; L94-T100 HydrophobicContact CD2-CG2 4.09Å; L94-F102 HydrophobicContact CD1-CE2 4.01Å; L94-F102 HydrophobicContact CD1-CZ 3.9Å; L94-F102 HydrophobicContact CD2-CZ 3.99Å; L94-W134 HydrophobicContact CD1-CB 4.39Å; L94-W134 HydrophobicContact CD1-CD2 3.68Å; L94-W134 HydrophobicContact CD1-CE3 4.35Å; L94-W134 HydrophobicContact CD1-CG 3.66Å; L94-W134 HydrophobicContact CD1-CZ2 4.34Å
95	P	96	Very high	95	Very high	54 Å²	54	46 Å²	46	35%	0.351	27%	0.27	S	S	.	.			trans	-51.1	129.9	175.4	-27.1	34.1	0	0	0	112.1	R98 P136	P95-R98 HydrophobicContact CB-CG 3.75Å; P95-R98 HydrophobicContact CG-CG 4.37Å; P95-P136 WeakPolarHBondContact O-CG 3.21Å
96	G	95.3	Very high	94.9	Very high	50 Å²	50	46 Å²	46	52%	0.515	27%	0.27	S	S	.	.	S	Bend	trans	-85.5	-10.1	176.4	0	0	0	0	0	114.3	L94 P136	L94-G96 PolarHBondContact O-N 3.4Å; G96-P136 VanDerWaalsContact O-CB 3.28Å; G96-P136 WeakPolarHBondContact O-CB 3.45Å
97	D	95.3	Very high	94.6	Very high	83 Å²	83	49.3 Å²	49.3	44%	0.444	28%	0.279	S	S	.	.	S	Bend	trans	-109.4	-4.3	-170.1	73.8	-31	0	0	0	114	A167	D97-A167 WeakPolarHBondContact O-CB 3.4Å
98	R	96.9	Very high	94.2	Very high	91 Å²	91	47 Å²	47	34%	0.343	27%	0.269	S	S	.	.	S	Bend	trans	-153.1	155.5	-179.9	67.3	-164.7	70.4	-159	-4.7	112.1	P95 P136 A167 P193 F194	P95-R98 HydrophobicContact CB-CG 3.75Å; P95-R98 HydrophobicContact CG-CG 4.37Å; R98-P136 WeakPolarHBondContact O-CD 3.43Å; R98-P136 WeakPolarHBondContact O-CG 3.15Å; R98-A167 WeakPolarHBondContact CA-O 3.36Å; R98-P193 HydrophobicContact CB-CB 3.91Å; R98-P193 HydrophobicContact CB-CG 4.13Å; R98-F194 HydrophobicContact CB-CE2 4.11Å
99	E	97.3	Very high	93.6	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.019	27%	0.268	C	S	.	.			trans	-62.2	148.7	170.4	-72.4	-174.9	151.7	0	0	111.4	W134 R135 A167 Y168 Y169	E99-W134 VanDerWaalsContact CA-O 3.24Å; E99-W134 WeakPolarHBondContact CA-O 3.26Å; E99-R135 HydrophobicContact CG-CB 4.44Å; E99-R135 IonicContact OE1-CZ 4Å; E99-R135 VanDerWaalsContact OE1-CZ 3.23Å; E99-R135 IonicContact OE1-NE 2.83Å; E99-R135 PolarHBondContact OE1-NE 3.28Å; E99-R135 IonicContact OE1-NH2 2.78Å; E99-R135 PolarHBondContact OE1-NH2 2.82Å; E99-A167 PolarHBondContact N-O 2.79Å; E99-Y168 HydrophobicContact CG-CD1 4.17Å; E99-Y168 WeakPolarHBondContact OE1-CD1 3.49Å; E99-Y168 WeakPolarHBondContact OE2-CA 3.44Å; E99-Y169 HydrophobicContact CB-CD2 3.79Å; E99-Y169 HydrophobicContact CB-CE2 4.19Å; E99-Y169 WeakPolarHBondContact O-CE2 3.23Å; E99-Y169 PolarHBondContact OE2-N 2.78Å
100	T	97.2	Very high	93.1	Very high	25 Å²	25	43.5 Å²	43.5	15%	0.153	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	135.1	170.1	-54.9	0	0	0	0	109.9	L94 F102 W134	L94-T100 HydrophobicContact CD2-CG2 4.09Å; T100-F102 HydrophobicContact CG2-CD2 4.38Å; T100-F102 HydrophobicContact CG2-CE2 3.69Å; T100-F102 HydrophobicContact CG2-CZ 3.96Å; T100-W134 PolarHBondContact N-O 2.83Å; T100-W134 PolarHBondContact O-N 2.83Å
101	L	95.9	Very high	92.4	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.016	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	131.9	179.6	178.8	66.9	0	0	0	112.2	E57 F103 K131 F133 Y169 M190	E57-L101 HydrophobicContact CG-CD2 4.27Å; L101-F103 HydrophobicContact CD1-CZ 4.4Å; L101-F103 HydrophobicContact CD2-CE2 3.84Å; L101-F103 HydrophobicContact CD2-CZ 3.68Å; L101-F103 HydrophobicContact CG-CE2 4.01Å; L101-F103 HydrophobicContact CG-CZ 4.13Å; L101-K131 HydrophobicContact CD1-CB 4.05Å; L101-K131 HydrophobicContact CD1-CG 4.3Å; L101-F133 HydrophobicContact CD1-CD1 3.96Å; L101-F133 HydrophobicContact CD1-CE1 3.72Å; L101-F133 HydrophobicContact CD1-CZ 4.45Å; L101-Y169 HydrophobicContact CB-CE1 3.96Å; L101-Y169 HydrophobicContact CB-CE2 3.84Å; L101-Y169 VanDerWaalsContact CB-CZ 3.49Å; L101-Y169 WeakPolarHBondContact CB-OH 3.48Å; L101-Y169 HydrophobicContact CD2-CE1 4.08Å; L101-M190 HydrophobicContact CD2-CE 3.31Å; L101-M190 HydrophobicContact CD2-SD 4.17Å
102	F	96.9	Very high	91.5	Very high	11 Å²	11	47 Å²	47	5%	0.048	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	171.3	165.6	-60.3	-91.6	0	0	0	109.3	L54 E55 L65 L66 L94 T100 V132 W134	L54-F102 HydrophobicContact CD1-CB 4.47Å; E55-F102 CarbonylContact O-C 3.51Å; E55-F102 WeakPolarHBondContact O-CA 3.27Å; E55-F102 WeakPolarHBondContact O-CB 3.45Å; L65-F102 HydrophobicContact CB-CE1 4.15Å; L65-F102 HydrophobicContact CB-CZ 4.26Å; L65-F102 HydrophobicContact CD1-CE1 3.77Å; L65-F102 HydrophobicContact CD1-CZ 3.89Å; L66-F102 HydrophobicContact CD1-CB 4.33Å; L66-F102 HydrophobicContact CD1-CD1 4.36Å; L66-F102 HydrophobicContact CD1-CD2 3.71Å; L66-F102 HydrophobicContact CD1-CE2 4.04Å; L66-F102 HydrophobicContact CD1-CG 3.88Å; L66-F102 HydrophobicContact CD1-CZ 4.49Å; L94-F102 HydrophobicContact CD1-CE2 4.01Å; L94-F102 HydrophobicContact CD1-CZ 3.9Å; L94-F102 HydrophobicContact CD2-CZ 3.99Å; T100-F102 HydrophobicContact CG2-CD2 4.38Å; T100-F102 HydrophobicContact CG2-CE2 3.69Å; T100-F102 HydrophobicContact CG2-CZ 3.96Å; F102-V132 HydrophobicContact CB-CB 3.99Å; F102-V132 HydrophobicContact CB-CG1 4.38Å; F102-V132 PolarHBondContact N-O 3.23Å; F102-V132 PolarHBondContact O-N 3.46Å; F102-W134 HydrophobicContact CD2-CB 4.14Å; F102-W134 HydrophobicContact CE2-CB 3.78Å
103	F	95.5	Very high	90.3	Very high	24 Å²	24	45.3 Å²	45.3	11%	0.105	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	126.1	172.3	-64.1	-88.8	0	0	0	110.5	L54 E55 L101 N105 R129 I130 K131	L54-F103 CarbonylContact C-O 3.45Å; L54-F103 WeakPolarHBondContact CA-O 3.42Å; E55-F103 HydrophobicContact CB-CB 4.28Å; E55-F103 PolarHBondContact N-O 3.01Å; E55-F103 PolarHBondContact O-N 2.97Å; L101-F103 HydrophobicContact CD1-CZ 4.4Å; L101-F103 HydrophobicContact CD2-CE2 3.84Å; L101-F103 HydrophobicContact CD2-CZ 3.68Å; L101-F103 HydrophobicContact CG-CE2 4.01Å; L101-F103 HydrophobicContact CG-CZ 4.13Å; F103-N105 PolarHBondContact O-ND2 2.86Å; F103-R129 HydrophobicContact CB-CG 4.06Å; F103-R129 HydrophobicContact CD1-CG 3.94Å; F103-R129 VanDerWaalsContact CD2-NH2 3.31Å; F103-R129 HydrophobicContact CG-CG 4.3Å; F103-I130 CarbonylContact C-O 3.45Å; F103-I130 WeakPolarHBondContact CA-O 3.33Å; F103-K131 HydrophobicContact CD1-CG 4.32Å; F103-K131 HydrophobicContact CE1-CG 3.91Å
104	Y	96.1	Very high	88.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	127.2	165.2	171.5	-96.2	0	0	0	108.9	I26 L37 S52 L54 A68 V83 I85 M106 R129 I130	I26-Y104 HydrophobicContact CD1-CG 4.46Å; L37-Y104 HydrophobicContact CD2-CD1 3.71Å; L37-Y104 HydrophobicContact CD2-CE1 3.12Å; L37-Y104 HydrophobicContact CD2-CE2 4.3Å; L37-Y104 HydrophobicContact CD2-CG 4.47Å; L37-Y104 VanDerWaalsContact CD2-CZ 3.47Å; S52-Y104 WeakPolarHBondContact CB-OH 3.26Å; S52-Y104 PolarHBondContact OG-OH 2.77Å; L54-Y104 HydrophobicContact CD2-CD2 4.06Å; A68-Y104 HydrophobicContact CB-CD2 4.3Å; A68-Y104 HydrophobicContact CB-CE2 3.94Å; V83-Y104 HydrophobicContact CG1-CE2 3.84Å; I85-Y104 HydrophobicContact CD1-CD2 3.92Å; I85-Y104 HydrophobicContact CD1-CG 4.29Å; I85-Y104 HydrophobicContact CG1-CD2 4.3Å; Y104-M106 HydrophobicContact CE1-CB 3.73Å; Y104-R129 CarbonylContact O-C 3.54Å; Y104-R129 WeakPolarHBondContact O-CA 3.25Å; Y104-I130 HydrophobicContact CD1-CB 4.3Å; Y104-I130 HydrophobicContact CD1-CD1 4.14Å; Y104-I130 PolarHBondContact N-O 2.71Å; Y104-I130 PolarHBondContact O-N 3.3Å
105	N	94.3	Very high	86.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	138.5	177.2	-71.8	-88.1	0	0	0	109.7	S52 W53 E55 F103 Q127 S128 R129	S52-N105 CarbonylContact C-O 3.59Å; S52-N105 VanDerWaalsContact CA-O 3.26Å; S52-N105 WeakPolarHBondContact CA-O 3.29Å; W53-N105 HydrophobicContact CD2-CB 3.59Å; W53-N105 HydrophobicContact CE3-CB 4Å; W53-N105 HydrophobicContact CG-CB 4.16Å; W53-N105 HydrophobicContact CH2-CB 3.82Å; W53-N105 HydrophobicContact CZ2-CB 3.4Å; W53-N105 HydrophobicContact CZ3-CB 4.09Å; W53-N105 PolarHBondContact N-O 2.93Å; W53-N105 PolarHBondContact O-N 2.8Å; E55-N105 WeakPolarHBondContact CG-ND2 3.44Å; E55-N105 PolarHBondContact OE1-ND2 3.18Å; E55-N105 VanDerWaalsContact OE1-ND2 3.15Å; E55-N105 PolarHBondContact OE2-ND2 2.83Å; F103-N105 PolarHBondContact O-ND2 2.86Å; N105-Q127 PolarHBondContact OD1-NE2 2.8Å; N105-S128 CarbonylContact C-O 3.5Å; N105-S128 WeakPolarHBondContact CA-O 3.31Å; N105-R129 WeakPolarHBondContact OD1-CG 3.47Å
106	M	92.1	Very high	84.9	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.01	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	117.9	171.5	-174.4	-174.6	78.4	0	0	109.2	L19 P21 V39 A50 Y51 Y104 Q127 S128	L19-M106 HydrophobicContact CB-CE 3.59Å; P21-M106 HydrophobicContact CG-CE 3.57Å; P21-M106 HydrophobicContact CG-SD 4.16Å; V39-M106 HydrophobicContact CB-SD 4.26Å; V39-M106 HydrophobicContact CG1-CE 3.96Å; V39-M106 HydrophobicContact CG1-SD 3.48Å; V39-M106 WeakPolarHBondContact CG1-SD 3.35Å; V39-M106 HydrophobicContact CG2-SD 3.7Å; A50-M106 HydrophobicContact CB-CG 4.33Å; A50-M106 HydrophobicContact CB-SD 4.31Å; Y51-M106 CarbonylContact O-C 3.44Å; Y51-M106 VanDerWaalsContact O-CA 3.27Å; Y51-M106 WeakPolarHBondContact O-CA 3.38Å; Y104-M106 HydrophobicContact CE1-CB 3.73Å; M106-Q127 CarbonylContact O-C 3.6Å; M106-Q127 WeakPolarHBondContact O-CA 3.24Å; M106-S128 PolarHBondContact N-O 2.56Å; M106-S128 PolarHBondContact O-N 2.76Å
107	R	88.7	Confident	82.7	Confident	109 Å²	109	58.7 Å²	58.7	41%	0.411	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.5	173.7	-178.7	176.1	-65.9	177	-0.5	109.3	Y51 W53 Q127	Y51-R107 PolarHBondContact N-O 3.4Å; Y51-R107 PolarHBondContact O-N 2.91Å; W53-R107 HydrophobicContact CH2-CB 4Å; W53-R107 HydrophobicContact CZ3-CB 3.86Å; R107-Q127 HydrophobicContact CB-CB 4.46Å; R107-Q127 HydrophobicContact CB-CG 4.43Å
108	E	86.2	Confident	80.6	Confident	10 Å²	10	62.6 Å²	62.6	5%	0.047	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	141.7	167.8	78.9	-169.6	-179.8	0	0	109.8	A18 L19 Y48 L49 A125 I126	A18-E108 PolarHBondContact N-OE2 2.85Å; A18-E108 VanDerWaalsContact N-OE2 3.11Å; L19-E108 HydrophobicContact CB-CB 4.08Å; L19-E108 HydrophobicContact CD1-CB 3.68Å; L19-E108 HydrophobicContact CG-CB 3.79Å; L19-E108 PolarHBondContact N-OE2 2.03Å; Y48-E108 HydrophobicContact CD1-CB 3.99Å; Y48-E108 HydrophobicContact CD1-CG 4.16Å; Y48-E108 HydrophobicContact CE1-CG 4.28Å; L49-E108 CarbonylContact O-C 3.55Å; L49-E108 WeakPolarHBondContact O-CA 3.32Å; E108-A125 VanDerWaalsContact O-CB 3.32Å; E108-A125 WeakPolarHBondContact O-CB 3.4Å; E108-I126 HydrophobicContact CG-CB 4.28Å; E108-I126 WeakPolarHBondContact CG-O 3.42Å; E108-I126 PolarHBondContact N-O 2.68Å; E108-I126 VanDerWaalsContact OE1-CB 3.24Å; E108-I126 WeakPolarHBondContact OE1-CB 3.09Å; E108-I126 WeakPolarHBondContact OE1-CG1 3.46Å; E108-I126 PolarHBondContact OE1-N 2.97Å
109	I	83	Confident	78.4	Confident	65 Å²	65	65.5 Å²	65.5	33%	0.333	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	109.7	173.5	-48.8	176.6	0	0	0	106.7	L49	L49-I109 HydrophobicContact CB-CB 3.98Å; L49-I109 HydrophobicContact CB-CD1 4.21Å; L49-I109 HydrophobicContact CB-CG1 4.31Å; L49-I109 HydrophobicContact CD1-CB 4.4Å; L49-I109 HydrophobicContact CD1-CD1 4.36Å; L49-I109 PolarHBondContact N-O 3.02Å; L49-I109 PolarHBondContact O-N 2.85Å
110	P	79.3	Confident	76.2	Confident	29 Å²	29	70.6 Å²	70.6	19%	0.188	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-68.4	161.9	177.2	28.6	-33.8	0	0	0	111.1	Y48 Q123	Y48-P110 HydrophobicContact CD1-CB 4.28Å; Y48-P110 HydrophobicContact CE1-CB 3.7Å; P110-Q123 HydrophobicContact CG-CB 4.46Å
111	P	80.3	Confident	74	Confident	43 Å²	43	73.1 Å²	73.1	28%	0.279	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-66.2	154.2	171.9	28.6	-29.7	0	0	0	110	L46 P47 Q123	L46-P111 HydrophobicContact CB-CG 4.2Å; L46-P111 HydrophobicContact CD1-CG 4.39Å; L46-P111 HydrophobicContact CD2-CG 4.06Å; L46-P111 HydrophobicContact CG-CG 4.45Å; P47-P111 WeakPolarHBondContact O-CD 3.39Å; P111-Q123 PolarHBondContact O-NE2 2.78Å
112	A	73.7	Confident	71.7	Confident	87 Å²	87	80.2 Å²	80.2	72%	0.719	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-60.4	144.2	175.6	0	0	0	0	0	110.6
113	P	66.6	Low	69.8	Low	57 Å²	57	84 Å²	84	37%	0.37	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-60.6	147.6	174.4	-10.5	23.1	0	0	0	110.5	K115 V121 Q123	P113-K115 PolarHBondContact O-N 2.78Å; P113-V121 HydrophobicContact CB-CB 4.3Å; P113-V121 HydrophobicContact CB-CG1 4.2Å; P113-V121 HydrophobicContact CB-CG2 4.17Å; P113-V121 HydrophobicContact CG-CB 4.16Å; P113-V121 HydrophobicContact CG-CG1 4.01Å; P113-Q123 VanDerWaalsContact CD-NE2 3.3Å; P113-Q123 HydrophobicContact CG-CG 4.23Å
114	E	62.2	Low	67.8	Low	168 Å²	168	87.6 Å²	87.6	79%	0.785	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-60.9	134.9	174.3	-68.8	-172.9	177.2	0	0	110.8	N116	E114-N116 PolarHBondContact O-N 3.39Å
115	K	56.1	Low	66.3	Low	213 Å²	213	90 Å²	90	93%	0.926	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-2.1	-174.9	-72.2	-174.5	177	-179.2	0	115	P113	P113-K115 PolarHBondContact O-N 2.78Å
116	N	53.2	Low	65.1	Low	153 Å²	153	93 Å²	93	82%	0.818	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	12.4	-172.8	-73.7	-8.5	0	0	0	114.6	E114	E114-N116 PolarHBondContact O-N 3.39Å
117	S	49	Very low	64.6	Low	55 Å²	55	96.2 Å²	96.2	39%	0.385	53%	0.53	S	S	.	.			trans	-90.4	116.2	172.2	67.9	0	0	0	0	111.2	H119	S117-H119 PolarHBondContact O-N 2.95Å
118	D	52.1	Low	64.3	Low	166 Å²	166	92.5 Å²	92.5	89%	0.888	52%	0.52	S	S	*	.	S	Bend	trans	-69.1	28.9	170.6	-78.7	-22.1	0	0	0	113.2
119	H	51.4	Low	64.5	Low	151 Å²	151	97.9 Å²	97.9	70%	0.699	54%	0.54	S	S	*	.	S	Bend	trans	-129.3	142.9	-175.6	-60.2	-35.9	0	0	0	110.9	S117 V121	S117-H119 PolarHBondContact O-N 2.95Å; H119-V121 PolarHBondContact O-N 2.85Å
120	A	51.2	Low	64.9	Low	111 Å²	111	95.4 Å²	95.4	92%	0.917	53%	0.528	S	S	*	.			trans	-66.8	116.3	170.1	0	0	0	0	0	109.5
121	V	50.9	Low	65.5	Low	78 Å²	78	96.5 Å²	96.5	47%	0.473	53%	0.529	S	S	.	.			trans	-97.1	119.6	179.3	-175	0	0	0	0	109.7	P113 H119 Q123	P113-V121 HydrophobicContact CB-CB 4.3Å; P113-V121 HydrophobicContact CB-CG1 4.2Å; P113-V121 HydrophobicContact CB-CG2 4.17Å; P113-V121 HydrophobicContact CG-CB 4.16Å; P113-V121 HydrophobicContact CG-CG1 4.01Å; H119-V121 PolarHBondContact O-N 2.85Å; V121-Q123 HydrophobicContact CG1-CG 4.09Å
122	L	47.6	Very low	66.2	Low	153 Å²	153	94.4 Å²	94.4	80%	0.801	52%	0.516	S	S	*	.			trans	-87.9	115.1	166.3	176.1	64.6	0	0	0	108.8	V124	L122-V124 HydrophobicContact CD2-CG2 4.37Å; L122-V124 HydrophobicContact CG-CG2 4.22Å
123	Q	56.1	Low	67.2	Low	91 Å²	91	90.3 Å²	90.3	43%	0.425	48%	0.482	S	S	.	.			trans	-99.3	122.6	170.3	-69.6	-168.1	-36.4	0	0	110.1	P110 P111 P113 V121	P110-Q123 HydrophobicContact CG-CB 4.46Å; P111-Q123 PolarHBondContact O-NE2 2.78Å; P113-Q123 VanDerWaalsContact CD-NE2 3.3Å; P113-Q123 HydrophobicContact CG-CG 4.23Å; V121-Q123 HydrophobicContact CG1-CG 4.09Å
124	V	54.6	Low	68.6	Low	98 Å²	98	88.1 Å²	88.1	59%	0.594	47%	0.466	S	S	*	.			trans	-103.1	127.9	173.6	-178.9	0	0	0	0	107.8	L122 I126	L122-V124 HydrophobicContact CD2-CG2 4.37Å; L122-V124 HydrophobicContact CG-CG2 4.22Å; V124-I126 HydrophobicContact CG1-CD1 4.29Å
125	A	62.7	Low	70.2	Confident	51 Å²	51	80.7 Å²	80.7	42%	0.421	43%	0.431	S	S	.	.			trans	-106.1	122.5	173.3	0	0	0	0	0	109.4	E108	E108-A125 VanDerWaalsContact O-CB 3.32Å; E108-A125 WeakPolarHBondContact O-CB 3.4Å
126	I	69.9	Low	72.1	Confident	62 Å²	62	70.9 Å²	70.9	32%	0.318	39%	0.389	S	S	.	.			trans	-80.6	135.1	174.7	-55.9	-61.8	0	0	0	110.4	A17 E108 V124	A17-I126 HydrophobicContact CB-CB 4.37Å; A17-I126 HydrophobicContact CB-CG1 4.4Å; A17-I126 HydrophobicContact CB-CG2 4.1Å; E108-I126 HydrophobicContact CG-CB 4.28Å; E108-I126 WeakPolarHBondContact CG-O 3.42Å; E108-I126 PolarHBondContact N-O 2.68Å; E108-I126 VanDerWaalsContact OE1-CB 3.24Å; E108-I126 WeakPolarHBondContact OE1-CB 3.09Å; E108-I126 WeakPolarHBondContact OE1-CG1 3.46Å; E108-I126 PolarHBondContact OE1-N 2.97Å; V124-I126 HydrophobicContact CG1-CD1 4.29Å
127	Q	82.1	Confident	73.9	Confident	71 Å²	71	66 Å²	66	33%	0.332	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	117.4	170.5	-179.8	176.9	-40	0	0	109.7	W53 N105 M106 R107	W53-Q127 HydrophobicContact CH2-CG 4.22Å; N105-Q127 PolarHBondContact OD1-NE2 2.8Å; M106-Q127 CarbonylContact O-C 3.6Å; M106-Q127 WeakPolarHBondContact O-CA 3.24Å; R107-Q127 HydrophobicContact CB-CB 4.46Å; R107-Q127 HydrophobicContact CB-CG 4.43Å
128	S	83	Confident	75.9	Confident	30 Å²	30	67.6 Å²	67.6	21%	0.21	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	134	168.6	-69.1	0	0	0	0	109.9	N105 M106	N105-S128 CarbonylContact C-O 3.5Å; N105-S128 WeakPolarHBondContact CA-O 3.31Å; M106-S128 PolarHBondContact N-O 2.56Å; M106-S128 PolarHBondContact O-N 2.76Å
129	R	89.2	Confident	77.8	Confident	124 Å²	124	60.8 Å²	60.8	47%	0.468	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	107.1	174.3	-171.5	170.9	-167.6	-118.6	2.4	109.5	E55 F103 Y104 N105	E55-R129 IonicContact OE2-CZ 3.24Å; E55-R129 IonicContact OE2-NE 3.94Å; E55-R129 PolarHBondContact OE2-NE 3.14Å; E55-R129 IonicContact OE2-NH2 2.69Å; E55-R129 PolarHBondContact OE2-NH2 3.19Å; F103-R129 HydrophobicContact CB-CG 4.06Å; F103-R129 HydrophobicContact CD1-CG 3.94Å; F103-R129 VanDerWaalsContact CD2-NH2 3.31Å; F103-R129 HydrophobicContact CG-CG 4.3Å; Y104-R129 CarbonylContact O-C 3.54Å; Y104-R129 WeakPolarHBondContact O-CA 3.25Å; N105-R129 WeakPolarHBondContact OD1-CG 3.47Å
130	I	90.8	Very high	79.3	Confident	12 Å²	12	61.1 Å²	61.1	6%	0.062	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	135.2	-172.1	-68.3	166.3	0	0	0	109.3	P21 R23 I26 F103 Y104	P21-I130 HydrophobicContact CB-CD1 3.61Å; P21-I130 HydrophobicContact CG-CD1 3.76Å; R23-I130 VanDerWaalsContact O-CD1 3.29Å; R23-I130 WeakPolarHBondContact O-CD1 3.19Å; I26-I130 HydrophobicContact CD1-CG2 4.08Å; I26-I130 HydrophobicContact CG1-CG2 4Å; F103-I130 CarbonylContact C-O 3.45Å; F103-I130 WeakPolarHBondContact CA-O 3.33Å; Y104-I130 HydrophobicContact CD1-CB 4.3Å; Y104-I130 HydrophobicContact CD1-CD1 4.14Å; Y104-I130 PolarHBondContact N-O 2.71Å; Y104-I130 PolarHBondContact O-N 3.3Å
131	K	92.6	Very high	80.5	Confident	52 Å²	52	56.7 Å²	56.7	23%	0.226	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	134.1	175.6	-62.3	174	-174.1	171.1	0	110.2	I26 L101 F103 F133 T171 M190	I26-K131 PolarHBondContact N-O 3.4Å; L101-K131 HydrophobicContact CD1-CB 4.05Å; L101-K131 HydrophobicContact CD1-CG 4.3Å; F103-K131 HydrophobicContact CD1-CG 4.32Å; F103-K131 HydrophobicContact CE1-CG 3.91Å; K131-F133 HydrophobicContact CB-CE1 4.46Å; K131-F133 HydrophobicContact CB-CE2 3.87Å; K131-F133 HydrophobicContact CB-CZ 3.83Å; K131-F133 HydrophobicContact CD-CE1 4.48Å; K131-F133 HydrophobicContact CD-CE2 4.34Å; K131-F133 HydrophobicContact CD-CZ 3.7Å; K131-F133 HydrophobicContact CG-CZ 4.38Å; K131-T171 PolarHBondContact NZ-OG1 2.74Å; K131-M190 HydrophobicContact CD-SD 3.68Å; K131-M190 VanDerWaalsContact CE-SD 3.59Å
132	V	95.2	Very high	81.6	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	111.9	173.5	178.2	0	0	0	0	107.7	I26 F28 L54 L66 I85 F102	I26-V132 HydrophobicContact CB-CB 4.47Å; I26-V132 HydrophobicContact CB-CG1 4.48Å; I26-V132 HydrophobicContact CB-CG2 4.05Å; I26-V132 HydrophobicContact CD1-CG2 4.01Å; I26-V132 HydrophobicContact CG2-CG1 4.29Å; I26-V132 HydrophobicContact CG2-CG2 4.5Å; I26-V132 CarbonylContact O-C 3.51Å; I26-V132 WeakPolarHBondContact O-CA 3.16Å; F28-V132 HydrophobicContact CB-CG1 4.37Å; L54-V132 HydrophobicContact CD1-CG2 4.06Å; L66-V132 HydrophobicContact CD1-CG1 4.07Å; I85-V132 HydrophobicContact CD1-CG2 4.18Å; F102-V132 HydrophobicContact CB-CB 3.99Å; F102-V132 HydrophobicContact CB-CG1 4.38Å; F102-V132 PolarHBondContact N-O 3.23Å; F102-V132 PolarHBondContact O-N 3.46Å
133	F	95.1	Very high	81.8	Confident	1 Å²	1	56 Å²	56	0%	0.004	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	107.3	177.2	-56.8	-73.6	0	0	0	109.1	R25 I26 V27 F28 L101 K131 R135 Y169 M190	R25-F133 HydrophobicContact CB-CE2 4.32Å; I26-F133 PolarHBondContact O-N 3.11Å; V27-F133 WeakPolarHBondContact CA-O 3.49Å; V27-F133 HydrophobicContact CG2-CD2 4.48Å; F28-F133 PolarHBondContact N-O 2.69Å; L101-F133 HydrophobicContact CD1-CD1 3.96Å; L101-F133 HydrophobicContact CD1-CE1 3.72Å; L101-F133 HydrophobicContact CD1-CZ 4.45Å; K131-F133 HydrophobicContact CB-CE1 4.46Å; K131-F133 HydrophobicContact CB-CE2 3.87Å; K131-F133 HydrophobicContact CB-CZ 3.83Å; K131-F133 HydrophobicContact CD-CE1 4.48Å; K131-F133 HydrophobicContact CD-CE2 4.34Å; K131-F133 HydrophobicContact CD-CZ 3.7Å; K131-F133 HydrophobicContact CG-CZ 4.38Å; F133-R135 PolarHBondContact O-N 3.03Å; F133-Y169 AromaticContact CD1-CD2 3.82Å; F133-Y169 HydrophobicContact CD1-CD2 3.82Å; F133-Y169 AromaticContact CD1-CG 3.89Å; F133-Y169 HydrophobicContact CD1-CG 3.89Å; F133-Y169 HydrophobicContact CE1-CD1 4.27Å; F133-Y169 HydrophobicContact CE1-CD2 4.08Å; F133-Y169 AromaticContact CE1-CG 3.66Å; F133-Y169 HydrophobicContact CE1-CG 3.66Å; F133-M190 HydrophobicContact CE1-SD 4.09Å; F133-M190 HydrophobicContact CZ-SD 4.24Å
134	W	96	Very high	82	Confident	11 Å²	11	54.9 Å²	54.9	4%	0.042	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	119.6	168.1	173.5	-89.9	0	0	0	109.1	F28 A30 L66 K87 T91 L94 E99 T100 F102	F28-W134 HydrophobicContact CB-CE3 4.38Å; F28-W134 AromaticContact CD1-CE3 3.67Å; F28-W134 HydrophobicContact CD1-CE3 3.67Å; F28-W134 AromaticContact CD1-CZ3 3.51Å; F28-W134 HydrophobicContact CD1-CZ3 3.51Å; F28-W134 HydrophobicContact CE1-CE3 4.24Å; F28-W134 HydrophobicContact CE1-CH2 4.44Å; F28-W134 AromaticContact CE1-CZ3 3.61Å; F28-W134 HydrophobicContact CE1-CZ3 3.61Å; F28-W134 HydrophobicContact CG-CE3 4.08Å; F28-W134 HydrophobicContact CG-CZ3 4.27Å; F28-W134 HydrophobicContact CZ-CZ3 4.38Å; A30-W134 HydrophobicContact CB-CH2 4.15Å; A30-W134 HydrophobicContact CB-CZ2 3.55Å; L66-W134 HydrophobicContact CD2-CE3 3.97Å; L66-W134 HydrophobicContact CD2-CZ3 3.9Å; K87-W134 HydrophobicContact CB-CH2 4.17Å; K87-W134 HydrophobicContact CB-CZ3 3.93Å; K87-W134 HydrophobicContact CD-CH2 4.01Å; K87-W134 HydrophobicContact CD-CZ3 4.45Å; T91-W134 VanDerWaalsContact CB-CH2 3.41Å; T91-W134 HydrophobicContact CG2-CE3 4.45Å; T91-W134 HydrophobicContact CG2-CH2 3.74Å; T91-W134 HydrophobicContact CG2-CZ2 4.33Å; T91-W134 HydrophobicContact CG2-CZ3 3.81Å; T91-W134 WeakPolarHBondContact OG1-CH2 3.41Å; L94-W134 HydrophobicContact CD1-CB 4.39Å; L94-W134 HydrophobicContact CD1-CD2 3.68Å; L94-W134 HydrophobicContact CD1-CE3 4.35Å; L94-W134 HydrophobicContact CD1-CG 3.66Å; L94-W134 HydrophobicContact CD1-CZ2 4.34Å; E99-W134 VanDerWaalsContact CA-O 3.24Å; E99-W134 WeakPolarHBondContact CA-O 3.26Å; T100-W134 PolarHBondContact N-O 2.83Å; T100-W134 PolarHBondContact O-N 2.83Å; F102-W134 HydrophobicContact CD2-CB 4.14Å; F102-W134 HydrophobicContact CE2-CB 3.78Å
135	R	95.3	Very high	82.9	Confident	12 Å²	12	53.3 Å²	53.3	5%	0.045	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	110.6	-177	-176.4	173.7	-69.8	171.7	-0.6	110.5	V27 F28 A30 E99 F133 L139 D216	V27-R135 HydrophobicContact CG1-CB 4.14Å; F28-R135 PolarHBondContact O-N 3.26Å; A30-R135 WeakPolarHBondContact CB-O 3.33Å; A30-R135 PolarHBondContact N-O 2.85Å; E99-R135 HydrophobicContact CG-CB 4.44Å; E99-R135 IonicContact OE1-CZ 4Å; E99-R135 VanDerWaalsContact OE1-CZ 3.23Å; E99-R135 IonicContact OE1-NE 2.83Å; E99-R135 PolarHBondContact OE1-NE 3.28Å; E99-R135 IonicContact OE1-NH2 2.78Å; E99-R135 PolarHBondContact OE1-NH2 2.82Å; F133-R135 PolarHBondContact O-N 3.03Å; R135-L139 VanDerWaalsContact CD-O 3.31Å; R135-L139 WeakPolarHBondContact CD-O 3.39Å; R135-L139 HydrophobicContact CG-CB 4.11Å; R135-D216 IonicContact CZ-OD1 3.15Å; R135-D216 IonicContact CZ-OD2 2.83Å; R135-D216 VanDerWaalsContact CZ-OD2 3.29Å; R135-D216 IonicContact NH1-OD1 2.99Å; R135-D216 IonicContact NH1-OD2 3.24Å; R135-D216 PolarHBondContact NH1-OD2 3.29Å; R135-D216 IonicContact NH2-OD1 3.16Å; R135-D216 PolarHBondContact NH2-OD1 3.36Å; R135-D216 IonicContact NH2-OD2 2.76Å; R135-D216 PolarHBondContact NH2-OD2 2.93Å
136	P	96.2	Very high	83.6	Confident	7 Å²	7	55.3 Å²	55.3	5%	0.045	30%	0.297	C	S	.	.			trans	-54.8	150.1	172.2	-26.9	35.8	0	0	0	112.6	P95 G96 R98 A138 L139	P95-P136 WeakPolarHBondContact O-CG 3.21Å; G96-P136 VanDerWaalsContact O-CB 3.28Å; G96-P136 WeakPolarHBondContact O-CB 3.45Å; R98-P136 WeakPolarHBondContact O-CD 3.43Å; R98-P136 WeakPolarHBondContact O-CG 3.15Å; P136-A138 PolarHBondContact O-N 2.88Å; P136-L139 HydrophobicContact CG-CD1 4.39Å; P136-L139 PolarHBondContact O-N 2.9Å
137	A	90.7	Very high	84.3	Confident	51 Å²	51	52.3 Å²	52.3	42%	0.421	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-56.9	-35.1	-179.8	0	0	0	0	0	112.8	N31 L139 R140	N31-A137 WeakPolarHBondContact OD1-CB 3.35Å; A137-L139 PolarHBondContact O-N 3.43Å; A137-R140 WeakPolarHBondContact O-CB 3.41Å; A137-R140 PolarHBondContact O-N 3.4Å
138	A	92	Very high	84.4	Confident	87 Å²	87	49.5 Å²	49.5	72%	0.719	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-65.3	-21	177.6	0	0	0	0	0	113.8	P136	P136-A138 PolarHBondContact O-N 2.88Å
139	L	90.7	Very high	84.4	Confident	23 Å²	23	51 Å²	51	12%	0.12	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-103.7	21.9	179.7	-58.8	-174.1	0	0	0	112.6	R135 P136 A137 K141 A167 Y168	R135-L139 VanDerWaalsContact CD-O 3.31Å; R135-L139 WeakPolarHBondContact CD-O 3.39Å; R135-L139 HydrophobicContact CG-CB 4.11Å; P136-L139 HydrophobicContact CG-CD1 4.39Å; P136-L139 PolarHBondContact O-N 2.9Å; A137-L139 PolarHBondContact O-N 3.43Å; L139-K141 PolarHBondContact O-N 2.96Å; L139-A167 HydrophobicContact CD1-CB 3.59Å; L139-A167 HydrophobicContact CD2-CB 3.67Å; L139-A167 HydrophobicContact CG-CB 4.3Å; L139-Y168 HydrophobicContact CB-CE1 4.2Å; L139-Y168 WeakPolarHBondContact O-CE1 3.42Å; L139-Y168 PolarHBondContact O-OH 2.87Å
140	R	84.1	Confident	84.3	Confident	159 Å²	159	49.6 Å²	49.6	60%	0.6	27%	0.272	S	S	*	.			trans	-62.2	107.3	170.9	-176.9	175.5	177.1	141.9	-1.3	108.2	A137	A137-R140 WeakPolarHBondContact O-CB 3.41Å; A137-R140 PolarHBondContact O-N 3.4Å
141	K	75.9	Confident	84.3	Confident	17 Å²	17	49.3 Å²	49.3	7%	0.074	27%	0.271	C	S	.	.			trans	-50.1	144	176.1	-69.3	-175.2	-179.2	175.2	0	109.9	L139 E145 V147 E148 Y168 D216 R336	L139-K141 PolarHBondContact O-N 2.96Å; K141-E145 VanDerWaalsContact CA-OE2 3.3Å; K141-E145 WeakPolarHBondContact CA-OE2 3.45Å; K141-V147 HydrophobicContact CD-CG2 4.44Å; K141-V147 VanDerWaalsContact CE-CG2 3.41Å; K141-E148 IonicContact NZ-OE1 3.44Å; K141-E148 PolarHBondContact NZ-OE1 3.12Å; K141-Y168 HydrophobicContact CD-CE1 4.15Å; K141-Y168 HydrophobicContact CG-CD1 4.41Å; K141-Y168 HydrophobicContact CG-CE1 3.52Å; K141-Y168 WeakPolarHBondContact CG-OH 3.48Å; K141-D216 WeakPolarHBondContact CD-OD2 3.43Å; K141-D216 IonicContact NZ-OD1 3.91Å; K141-D216 PolarHBondContact NZ-OD1 2.91Å; K141-D216 IonicContact NZ-OD2 2.79Å; K141-D216 PolarHBondContact NZ-OD2 3.02Å; K141-R336 VanDerWaalsContact CB-NH2 3.28Å; K141-R336 PolarHBondContact O-NH2 3.44Å
142	K	73.5	Confident	84.2	Confident	165 Å²	165	51.4 Å²	51.4	72%	0.717	28%	0.282	S	S	*	.			trans	-87.3	151.6	168.3	-66.7	-178.6	-177	178.1	0	112.2	G144 E145 R336	K142-G144 PolarHBondContact O-N 3.41Å; K142-E145 HydrophobicContact CB-CB 4.38Å; K142-E145 PolarHBondContact N-OE2 2.97Å; K142-E145 WeakPolarHBondContact O-CB 3.21Å; K142-E145 PolarHBondContact O-N 3.04Å; K142-R336 PolarHBondContact O-NH1 3.31Å; K142-R336 VanDerWaalsContact O-NH1 3.09Å; K142-R336 PolarHBondContact O-NH2 3.49Å
143	A	52.1	Low	83.8	Confident	52 Å²	52	52 Å²	52	43%	0.43	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-38.2	123	176	0	0	0	0	0	113.5	E145 Q335 R336	A143-E145 PolarHBondContact O-N 2.84Å; A143-E145 VanDerWaalsContact O-N 3.15Å; A143-Q335 VanDerWaalsContact CB-O 3.3Å; A143-Q335 WeakPolarHBondContact CB-O 3.02Å; A143-R336 HydrophobicContact CB-CB 4.45Å; A143-R336 HydrophobicContact CB-CG 3.23Å
144	G	61	Low	83.5	Confident	67 Å²	67	55 Å²	55	69%	0.691	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	0.8	179.3	0	0	0	0	0	116.1	K142 K146	K142-G144 PolarHBondContact O-N 3.41Å; G144-K146 PolarHBondContact O-N 3.41Å
145	E	73	Confident	82.9	Confident	65 Å²	65	56.5 Å²	56.5	30%	0.304	31%	0.314	S	S	.	.			trans	-63.9	103.9	177.8	-168.4	-175.1	-180	0	0	110.3	K141 K142 A143 V147	K141-E145 VanDerWaalsContact CA-OE2 3.3Å; K141-E145 WeakPolarHBondContact CA-OE2 3.45Å; K142-E145 HydrophobicContact CB-CB 4.38Å; K142-E145 PolarHBondContact N-OE2 2.97Å; K142-E145 WeakPolarHBondContact O-CB 3.21Å; K142-E145 PolarHBondContact O-N 3.04Å; A143-E145 PolarHBondContact O-N 2.84Å; A143-E145 VanDerWaalsContact O-N 3.15Å; E145-V147 HydrophobicContact CG-CG1 3.67Å; E145-V147 PolarHBondContact O-N 2.91Å; E145-V147 WeakPolarHBondContact OE1-CG1 3.41Å
146	K	76.7	Confident	82.4	Confident	93 Å²	93	63.5 Å²	63.5	40%	0.404	35%	0.347	S	S	.	.			trans	-90.8	74	174.6	-63.4	-176.5	174.3	-173.6	0	109.8	G144 E148 L149 E223	G144-K146 PolarHBondContact O-N 3.41Å; K146-E148 WeakPolarHBondContact CA-OE2 3.42Å; K146-E148 PolarHBondContact O-N 2.91Å; K146-E148 VanDerWaalsContact O-N 3.15Å; K146-L149 HydrophobicContact CB-CB 4.36Å; K146-L149 HydrophobicContact CB-CD1 3.85Å; K146-L149 HydrophobicContact CB-CG 3.83Å; K146-L149 HydrophobicContact CD-CD1 3.34Å; K146-L149 HydrophobicContact CD-CG 3.96Å; K146-L149 HydrophobicContact CG-CD1 4.3Å; K146-L149 WeakPolarHBondContact O-CB 2.89Å; K146-L149 PolarHBondContact O-N 3.36Å; K146-E223 IonicContact NZ-OE1 3.65Å; K146-E223 IonicContact NZ-OE2 3.01Å; K146-E223 PolarHBondContact NZ-OE2 2.79Å
147	V	86.2	Confident	81.7	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-59.3	-25.6	178.4	-56.3	0	0	0	0	111.9	K141 E145 L149 Q150 T166 Y168 L170	K141-V147 HydrophobicContact CD-CG2 4.44Å; K141-V147 VanDerWaalsContact CE-CG2 3.41Å; E145-V147 HydrophobicContact CG-CG1 3.67Å; E145-V147 PolarHBondContact O-N 2.91Å; E145-V147 WeakPolarHBondContact OE1-CG1 3.41Å; V147-L149 PolarHBondContact O-N 2.8Å; V147-Q150 WeakPolarHBondContact O-CB 3.26Å; V147-Q150 PolarHBondContact O-N 2.76Å; V147-T166 HydrophobicContact CB-CG2 4.46Å; V147-Y168 HydrophobicContact CB-CD2 3.9Å; V147-Y168 HydrophobicContact CB-CE2 4.17Å; V147-Y168 HydrophobicContact CB-CG 4.49Å; V147-Y168 HydrophobicContact CG1-CD2 3.84Å; V147-Y168 HydrophobicContact CG1-CE2 3.58Å; V147-Y168 HydrophobicContact CG2-CD1 4.48Å; V147-Y168 HydrophobicContact CG2-CD2 3.8Å; V147-Y168 HydrophobicContact CG2-CE2 4.33Å; V147-Y168 HydrophobicContact CG2-CG 3.89Å; V147-L170 HydrophobicContact CG2-CD2 4.1Å
148	E	82.6	Confident	81.2	Confident	12 Å²	12	67.3 Å²	67.3	6%	0.056	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-60.4	-31.5	176.6	-58.5	75.2	-167	0	0	111.9	K141 K146 Q150 L151 L170 Y213	K141-E148 IonicContact NZ-OE1 3.44Å; K141-E148 PolarHBondContact NZ-OE1 3.12Å; K146-E148 WeakPolarHBondContact CA-OE2 3.42Å; K146-E148 PolarHBondContact O-N 2.91Å; K146-E148 VanDerWaalsContact O-N 3.15Å; E148-Q150 VanDerWaalsContact C-N 3.25Å; E148-Q150 PolarHBondContact O-N 2.64Å; E148-L151 WeakPolarHBondContact O-CB 3.39Å; E148-L151 PolarHBondContact O-N 3.38Å; E148-L170 HydrophobicContact CB-CD2 4.45Å; E148-L170 HydrophobicContact CG-CD2 4.11Å; E148-Y213 HydrophobicContact CB-CD1 4.27Å; E148-Y213 HydrophobicContact CB-CD2 3.68Å; E148-Y213 HydrophobicContact CB-CE2 4.11Å; E148-Y213 HydrophobicContact CB-CG 3.76Å; E148-Y213 HydrophobicContact CG-CD2 3.62Å; E148-Y213 HydrophobicContact CG-CE2 4.15Å; E148-Y213 HydrophobicContact CG-CG 4.12Å
149	L	82.7	Confident	80.8	Confident	61 Å²	61	67.3 Å²	67.3	32%	0.319	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-77.4	-7.6	177.1	-62.2	-174.4	0	0	0	113.9	K146 V147 L151 Y213 E223	K146-L149 HydrophobicContact CB-CB 4.36Å; K146-L149 HydrophobicContact CB-CD1 3.85Å; K146-L149 HydrophobicContact CB-CG 3.83Å; K146-L149 HydrophobicContact CD-CD1 3.34Å; K146-L149 HydrophobicContact CD-CG 3.96Å; K146-L149 HydrophobicContact CG-CD1 4.3Å; K146-L149 WeakPolarHBondContact O-CB 2.89Å; K146-L149 PolarHBondContact O-N 3.36Å; V147-L149 PolarHBondContact O-N 2.8Å; L149-L151 PolarHBondContact O-N 3.12Å; L149-Y213 HydrophobicContact CD2-CE1 3.99Å; L149-E223 WeakPolarHBondContact CD1-OE1 2.92Å; L149-E223 HydrophobicContact CD2-CB 3.9Å; L149-E223 HydrophobicContact CD2-CG 4.16Å; L149-E223 WeakPolarHBondContact CD2-OE2 3.26Å
150	Q	89	Confident	80.6	Confident	94 Å²	94	66.2 Å²	66.2	44%	0.439	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-81.2	-0.9	174.1	-56.9	-178.7	27	0	0	112.3	V147 E148 Q152 P165 T166	V147-Q150 WeakPolarHBondContact O-CB 3.26Å; V147-Q150 PolarHBondContact O-N 2.76Å; E148-Q150 VanDerWaalsContact C-N 3.25Å; E148-Q150 PolarHBondContact O-N 2.64Å; Q150-Q152 PolarHBondContact O-N 3.29Å; Q150-P165 HydrophobicContact CB-CG 4.3Å; Q150-P165 VanDerWaalsContact O-CD 3.25Å; Q150-P165 WeakPolarHBondContact O-CD 3.46Å; Q150-P165 WeakPolarHBondContact O-CG 3.34Å; Q150-T166 HydrophobicContact CB-CG2 3.66Å; Q150-T166 HydrophobicContact CG-CG2 4.33Å
151	L	89.4	Confident	81	Confident	7 Å²	7	60.1 Å²	60.1	4%	0.037	33%	0.333	C	S	.	.			trans	-56.6	130.4	176.1	-171.9	73.5	0	0	0	110.5	E148 L149 V153 L162 K163 N164 L170 I172 I191 L211 M225	E148-L151 WeakPolarHBondContact O-CB 3.39Å; E148-L151 PolarHBondContact O-N 3.38Å; L149-L151 PolarHBondContact O-N 3.12Å; L151-V153 HydrophobicContact CD2-CG2 3.94Å; L151-V153 HydrophobicContact CG-CG2 4.15Å; L151-L162 HydrophobicContact CD1-CB 4.37Å; L151-L162 HydrophobicContact CD2-CD2 4.19Å; L151-K163 WeakPolarHBondContact CD1-O 3.34Å; L151-N164 HydrophobicContact CD1-CB 4.45Å; L151-L170 HydrophobicContact CB-CD1 4.3Å; L151-L170 HydrophobicContact CD1-CD1 4.01Å; L151-I172 HydrophobicContact CD2-CD1 3.68Å; L151-I172 HydrophobicContact CD2-CG1 4.14Å; L151-I191 HydrophobicContact CD1-CD1 3.57Å; L151-L211 HydrophobicContact CD2-CD1 3.62Å; L151-M225 VanDerWaalsContact O-CE 3.3Å; L151-M225 WeakPolarHBondContact O-CE 3.43Å
152	Q	90.9	Very high	81.7	Confident	95 Å²	95	59.3 Å²	59.3	44%	0.444	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	121.6	175.7	-66.5	175.8	6.7	0	0	108.7	Q150 K163 P165	Q150-Q152 PolarHBondContact O-N 3.29Å; Q152-K163 HydrophobicContact CB-CB 4.09Å; Q152-K163 PolarHBondContact N-O 3.21Å; Q152-K163 PolarHBondContact O-N 2.82Å; Q152-P165 HydrophobicContact CG-CG 4.38Å
153	V	87	Confident	82.7	Confident	14 Å²	14	56 Å²	56	9%	0.085	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	126.4	-176.8	-177.2	0	0	0	0	109.4	L151 L160 T161 L162 M225	L151-V153 HydrophobicContact CD2-CG2 3.94Å; L151-V153 HydrophobicContact CG-CG2 4.15Å; V153-L160 HydrophobicContact CG1-CD1 3.52Å; V153-L160 HydrophobicContact CG1-CD2 4.01Å; V153-L160 HydrophobicContact CG1-CG 3.89Å; V153-T161 WeakPolarHBondContact CA-O 3.49Å; V153-L162 HydrophobicContact CB-CD2 4.34Å; V153-L162 HydrophobicContact CG1-CD2 3.96Å; V153-L162 HydrophobicContact CG2-CD2 3.77Å; V153-M225 HydrophobicContact CB-CE 4.47Å; V153-M225 HydrophobicContact CG2-CE 3.72Å; V153-M225 HydrophobicContact CG2-SD 4.04Å
154	S	87.9	Confident	84.9	Confident	62 Å²	62	53.6 Å²	53.6	43%	0.434	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	141.4	173.9	59.9	0	0	0	0	110.9	T161	S154-T161 PolarHBondContact N-O 3.16Å; S154-T161 PolarHBondContact O-N 3.19Å; S154-T161 WeakPolarHBondContact OG-CB 3.45Å
155	Q	83.7	Confident	86.5	Confident	43 Å²	43	52.4 Å²	52.4	20%	0.201	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	137.3	179.7	-160.3	-175.6	23	0	0	111.5	G157 Q159 L160 T201 Y204 G206 F209 A227	Q155-G157 PolarHBondContact NE2-O 2.99Å; Q155-Q159 CarbonylContact C-O 3.59Å; Q155-Q159 WeakPolarHBondContact CA-O 3.5Å; Q155-Q159 VanDerWaalsContact CG-O 3.29Å; Q155-Q159 WeakPolarHBondContact CG-O 3.48Å; Q155-L160 HydrophobicContact CB-CD1 3.71Å; Q155-L160 HydrophobicContact CG-CD1 3.93Å; Q155-T201 PolarHBondContact NE2-OG1 3.16Å; Q155-Y204 PolarHBondContact NE2-O 2.83Å; Q155-G206 PolarHBondContact OE1-O 2.63Å; Q155-F209 HydrophobicContact CB-CZ 4.26Å; Q155-F209 HydrophobicContact CG-CZ 4.42Å; Q155-A227 HydrophobicContact CB-CB 4.43Å
156	Q	85	Confident	87.6	Confident	160 Å²	160	49.7 Å²	49.7	75%	0.748	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.5	107.6	169.2	-172.9	176.5	7	0	0	109.1	N158 Q159	Q156-N158 PolarHBondContact O-N 3.46Å; Q156-Q159 PolarHBondContact N-O 2.8Å; Q156-Q159 PolarHBondContact O-N 3.13Å; Q156-Q159 VanDerWaalsContact O-N 3.08Å
157	G	82.6	Confident	88.5	Confident	54 Å²	54	45.8 Å²	45.8	56%	0.557	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.2	-121.7	-171.8	0	0	0	0	0	111.1	Q155	Q155-G157 PolarHBondContact NE2-O 2.99Å
158	N	78.6	Confident	89	Confident	83 Å²	83	46.5 Å²	46.5	44%	0.444	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-0.6	174.7	64.6	-11.6	0	0	0	114	Q156 N200 T201 G202	Q156-N158 PolarHBondContact O-N 3.46Å; N158-N200 PolarHBondContact ND2-ND2 2.77Å; N158-N200 WeakPolarHBondContact O-CA 3.33Å; N158-N200 VanDerWaalsContact O-CG 3.29Å; N158-N200 PolarHBondContact O-OD1 3.04Å; N158-N200 VanDerWaalsContact O-OD1 3.1Å; N158-T201 PolarHBondContact O-N 2.73Å; N158-T201 VanDerWaalsContact O-N 3.12Å; N158-T201 PolarHBondContact O-OG1 3.28Å; N158-G202 VanDerWaalsContact CB-O 3.23Å; N158-G202 WeakPolarHBondContact CB-O 3.47Å
159	Q	85.2	Confident	89.6	Confident	87 Å²	87	46.8 Å²	46.8	41%	0.407	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	126.4	177.5	-175.6	171.3	88	0	0	110	Q155 Q156 N198	Q155-Q159 CarbonylContact C-O 3.59Å; Q155-Q159 WeakPolarHBondContact CA-O 3.5Å; Q155-Q159 VanDerWaalsContact CG-O 3.29Å; Q155-Q159 WeakPolarHBondContact CG-O 3.48Å; Q156-Q159 PolarHBondContact N-O 2.8Å; Q156-Q159 PolarHBondContact O-N 3.13Å; Q156-Q159 VanDerWaalsContact O-N 3.08Å; Q159-N198 HydrophobicContact CG-CB 4.3Å
160	L	86.4	Confident	90.1	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.5	174.3	-166.6	75.4	0	0	0	109.5	V153 Q155 L162 L175 N198 T199 T201 F209	V153-L160 HydrophobicContact CG1-CD1 3.52Å; V153-L160 HydrophobicContact CG1-CD2 4.01Å; V153-L160 HydrophobicContact CG1-CG 3.89Å; Q155-L160 HydrophobicContact CB-CD1 3.71Å; Q155-L160 HydrophobicContact CG-CD1 3.93Å; L160-L162 HydrophobicContact CD2-CD2 3.76Å; L160-L162 HydrophobicContact CG-CD2 4.07Å; L160-L175 HydrophobicContact CD2-CD1 4.1Å; L160-L175 HydrophobicContact CD2-CD2 3.36Å; L160-L175 HydrophobicContact CD2-CG 4.35Å; L160-N198 CarbonylContact O-C 3.57Å; L160-N198 WeakPolarHBondContact O-CA 3.4Å; L160-T199 HydrophobicContact CB-CG2 3.91Å; L160-T199 HydrophobicContact CD2-CG2 4.17Å; L160-T199 HydrophobicContact CG-CG2 4.49Å; L160-T199 PolarHBondContact N-O 2.95Å; L160-T199 PolarHBondContact O-N 2.93Å; L160-T201 HydrophobicContact CB-CG2 3.92Å; L160-T201 HydrophobicContact CD1-CG2 4.48Å; L160-T201 HydrophobicContact CD2-CG2 4.06Å; L160-T201 HydrophobicContact CG-CG2 4.41Å; L160-F209 HydrophobicContact CD1-CE1 3.92Å; L160-F209 HydrophobicContact CD1-CE2 4.17Å; L160-F209 HydrophobicContact CD1-CZ 3.71Å; L160-F209 HydrophobicContact CD2-CD1 4.47Å; L160-F209 HydrophobicContact CD2-CE1 4.43Å
161	T	91.5	Very high	89.9	Confident	32 Å²	32	39.6 Å²	39.6	20%	0.196	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	121.7	175.6	-60.2	0	0	0	0	109	V153 S154 T196 N198	V153-T161 WeakPolarHBondContact CA-O 3.49Å; S154-T161 PolarHBondContact N-O 3.16Å; S154-T161 PolarHBondContact O-N 3.19Å; S154-T161 WeakPolarHBondContact OG-CB 3.45Å; T161-T196 HydrophobicContact CG2-CG2 3.34Å; T161-N198 WeakPolarHBondContact CB-OD1 3.41Å; T161-N198 WeakPolarHBondContact CG2-OD1 3.32Å; T161-N198 PolarHBondContact OG1-OD1 2.81Å
162	L	90.8	Very high	89.8	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	108	177	-54.1	177.8	0	0	0	108.3	L151 V153 L160 I172 V189 I191 T196 V197 T199	L151-L162 HydrophobicContact CD1-CB 4.37Å; L151-L162 HydrophobicContact CD2-CD2 4.19Å; V153-L162 HydrophobicContact CB-CD2 4.34Å; V153-L162 HydrophobicContact CG1-CD2 3.96Å; V153-L162 HydrophobicContact CG2-CD2 3.77Å; L160-L162 HydrophobicContact CD2-CD2 3.76Å; L160-L162 HydrophobicContact CG-CD2 4.07Å; L162-I172 HydrophobicContact CD1-CG1 4.35Å; L162-V189 HydrophobicContact CD1-CG1 3.78Å; L162-I191 HydrophobicContact CB-CD1 3.51Å; L162-I191 HydrophobicContact CD1-CD1 4Å; L162-I191 HydrophobicContact CG-CD1 4.41Å; L162-T196 WeakPolarHBondContact O-CA 3.47Å; L162-V197 PolarHBondContact N-O 2.71Å; L162-V197 PolarHBondContact O-N 3.11Å; L162-T199 HydrophobicContact CD1-CG2 4.04Å; L162-T199 HydrophobicContact CG-CG2 4.32Å
163	K	95.4	Very high	89	Confident	96 Å²	96	35.7 Å²	35.7	42%	0.417	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122.9	179.1	172.4	177.6	176	-164.7	0	109.5	L151 Q152 P165 T196	L151-K163 WeakPolarHBondContact CD1-O 3.34Å; Q152-K163 HydrophobicContact CB-CB 4.09Å; Q152-K163 PolarHBondContact N-O 3.21Å; Q152-K163 PolarHBondContact O-N 2.82Å; K163-P165 WeakPolarHBondContact O-CD 3.49Å; K163-T196 HydrophobicContact CB-CG2 4.32Å
164	N	96.3	Very high	88.5	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.203	C	C	.	.			trans	-94.9	103.2	174.8	176.9	10.7	0	0	0	109.4	L151 T166 Y168 L170 I191 A192 F194 S195	L151-N164 HydrophobicContact CD1-CB 4.45Å; N164-T166 PolarHBondContact O-N 2.87Å; N164-T166 WeakPolarHBondContact OD1-CA 3.25Å; N164-T166 WeakPolarHBondContact OD1-CB 3.2Å; N164-T166 PolarHBondContact OD1-N 2.94Å; N164-T166 PolarHBondContact OD1-OG1 2.8Å; N164-Y168 PolarHBondContact ND2-O 2.8Å; N164-L170 HydrophobicContact CB-CD1 4.17Å; N164-L170 VanDerWaalsContact OD1-CD1 3.3Å; N164-L170 WeakPolarHBondContact OD1-CD1 3.48Å; N164-I191 HydrophobicContact CB-CB 4.11Å; N164-I191 HydrophobicContact CB-CG2 3.41Å; N164-I191 VanDerWaalsContact CB-CG2 3.41Å; N164-I191 PolarHBondContact ND2-O 3.03Å; N164-I191 VanDerWaalsContact ND2-O 3.11Å; N164-A192 PolarHBondContact ND2-O 2.99Å; N164-F194 CarbonylContact O-C 3.59Å; N164-F194 WeakPolarHBondContact O-CA 3.44Å; N164-F194 PolarHBondContact O-N 2.81Å; N164-S195 PolarHBondContact N-O 3.18Å
165	P	95.8	Very high	88.1	Confident	43 Å²	43	33.8 Å²	33.8	28%	0.279	18%	0.183	S	C	.	.			trans	-80.8	-1	176.9	35.5	-37.1	0	0	0	113	Q150 Q152 K163 F194	Q150-P165 HydrophobicContact CB-CG 4.3Å; Q150-P165 VanDerWaalsContact O-CD 3.25Å; Q150-P165 WeakPolarHBondContact O-CD 3.46Å; Q150-P165 WeakPolarHBondContact O-CG 3.34Å; Q152-P165 HydrophobicContact CG-CG 4.38Å; K163-P165 WeakPolarHBondContact O-CD 3.49Å; P165-F194 WeakPolarHBondContact O-CD1 3.05Å; P165-F194 WeakPolarHBondContact O-CE1 3.42Å
166	T	95.6	Very high	87.8	Confident	7 Å²	7	31.7 Å²	31.7	4%	0.043	17%	0.174	C	C	.	.	S	Bend	trans	-95.6	165.7	-170.6	82.4	0	0	0	0	112.5	V147 Q150 N164 Y168 P193 F194	V147-T166 HydrophobicContact CB-CG2 4.46Å; Q150-T166 HydrophobicContact CB-CG2 3.66Å; Q150-T166 HydrophobicContact CG-CG2 4.33Å; N164-T166 PolarHBondContact O-N 2.87Å; N164-T166 WeakPolarHBondContact OD1-CA 3.25Å; N164-T166 WeakPolarHBondContact OD1-CB 3.2Å; N164-T166 PolarHBondContact OD1-N 2.94Å; N164-T166 PolarHBondContact OD1-OG1 2.8Å; T166-Y168 PolarHBondContact O-N 2.78Å; T166-Y168 PolarHBondContact OG1-N 3.09Å; T166-Y168 PolarHBondContact OG1-O 3.13Å; T166-P193 VanDerWaalsContact O-CA 3.28Å; T166-P193 WeakPolarHBondContact O-CA 3.49Å; T166-F194 PolarHBondContact O-N 2.78Å; T166-F194 VanDerWaalsContact O-N 3.09Å
167	A	96.9	Very high	87.4	Confident	12 Å²	12	31.8 Å²	31.8	10%	0.099	17%	0.167	C	C	.	.	S	Bend	trans	-80.2	4.7	174.8	0	0	0	0	0	114.1	D97 R98 E99 L139 P193 F194	D97-A167 WeakPolarHBondContact O-CB 3.4Å; R98-A167 WeakPolarHBondContact CA-O 3.36Å; E99-A167 PolarHBondContact N-O 2.79Å; L139-A167 HydrophobicContact CD1-CB 3.59Å; L139-A167 HydrophobicContact CD2-CB 3.67Å; L139-A167 HydrophobicContact CG-CB 4.3Å; A167-P193 WeakPolarHBondContact O-CG 3.39Å; A167-F194 HydrophobicContact CB-CE2 4.33Å; A167-F194 HydrophobicContact CB-CZ 3.79Å
168	Y	95.8	Very high	86.9	Confident	15 Å²	15	33 Å²	33	6%	0.059	16%	0.16	C	C	.	.	S	Bend	trans	-111.1	153.9	-174	-57.3	-93.5	0	0	0	111.3	E99 L139 K141 V147 N164 T166	E99-Y168 HydrophobicContact CG-CD1 4.17Å; E99-Y168 WeakPolarHBondContact OE1-CD1 3.49Å; E99-Y168 WeakPolarHBondContact OE2-CA 3.44Å; L139-Y168 HydrophobicContact CB-CE1 4.2Å; L139-Y168 WeakPolarHBondContact O-CE1 3.42Å; L139-Y168 PolarHBondContact O-OH 2.87Å; K141-Y168 HydrophobicContact CD-CE1 4.15Å; K141-Y168 HydrophobicContact CG-CD1 4.41Å; K141-Y168 HydrophobicContact CG-CE1 3.52Å; K141-Y168 WeakPolarHBondContact CG-OH 3.48Å; V147-Y168 HydrophobicContact CB-CD2 3.9Å; V147-Y168 HydrophobicContact CB-CE2 4.17Å; V147-Y168 HydrophobicContact CB-CG 4.49Å; V147-Y168 HydrophobicContact CG1-CD2 3.84Å; V147-Y168 HydrophobicContact CG1-CE2 3.58Å; V147-Y168 HydrophobicContact CG2-CD1 4.48Å; V147-Y168 HydrophobicContact CG2-CD2 3.8Å; V147-Y168 HydrophobicContact CG2-CE2 4.33Å; V147-Y168 HydrophobicContact CG2-CG 3.89Å; N164-Y168 PolarHBondContact ND2-O 2.8Å; T166-Y168 PolarHBondContact O-N 2.78Å; T166-Y168 PolarHBondContact OG1-N 3.09Å; T166-Y168 PolarHBondContact OG1-O 3.13Å
169	Y	94.4	Very high	86.5	Confident	18 Å²	18	34.7 Å²	34.7	7%	0.071	17%	0.166	C	C	.	.			trans	-75.7	123.2	165.5	-78.7	-97.1	0	0	0	109.8	E57 E99 L101 F133 M190 A192 P193	E57-Y169 PolarHBondContact OE1-OH 3.48Å; E99-Y169 HydrophobicContact CB-CD2 3.79Å; E99-Y169 HydrophobicContact CB-CE2 4.19Å; E99-Y169 WeakPolarHBondContact O-CE2 3.23Å; E99-Y169 PolarHBondContact OE2-N 2.78Å; L101-Y169 HydrophobicContact CB-CE1 3.96Å; L101-Y169 HydrophobicContact CB-CE2 3.84Å; L101-Y169 VanDerWaalsContact CB-CZ 3.49Å; L101-Y169 WeakPolarHBondContact CB-OH 3.48Å; L101-Y169 HydrophobicContact CD2-CE1 4.08Å; F133-Y169 AromaticContact CD1-CD2 3.82Å; F133-Y169 HydrophobicContact CD1-CD2 3.82Å; F133-Y169 AromaticContact CD1-CG 3.89Å; F133-Y169 HydrophobicContact CD1-CG 3.89Å; F133-Y169 HydrophobicContact CE1-CD1 4.27Å; F133-Y169 HydrophobicContact CE1-CD2 4.08Å; F133-Y169 AromaticContact CE1-CG 3.66Å; F133-Y169 HydrophobicContact CE1-CG 3.66Å; Y169-M190 HydrophobicContact CD1-CE 3.96Å; Y169-M190 HydrophobicContact CD1-CG 3.97Å; Y169-M190 HydrophobicContact CD1-SD 3.92Å; Y169-M190 HydrophobicContact CE1-CE 4.08Å; Y169-A192 HydrophobicContact CD1-CB 4.16Å; Y169-A192 HydrophobicContact CE1-CB 3.67Å; Y169-P193 HydrophobicContact CD2-CG 3.99Å; Y169-P193 HydrophobicContact CE2-CG 4.01Å
170	L	92.7	Very high	85	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.2	177.2	-55.8	-173.9	0	0	0	109.6	V147 E148 L151 N164 M190 I191	V147-L170 HydrophobicContact CG2-CD2 4.1Å; E148-L170 HydrophobicContact CB-CD2 4.45Å; E148-L170 HydrophobicContact CG-CD2 4.11Å; L151-L170 HydrophobicContact CB-CD1 4.3Å; L151-L170 HydrophobicContact CD1-CD1 4.01Å; N164-L170 HydrophobicContact CB-CD1 4.17Å; N164-L170 VanDerWaalsContact OD1-CD1 3.3Å; N164-L170 WeakPolarHBondContact OD1-CD1 3.48Å; L170-M190 CarbonylContact O-C 3.53Å; L170-M190 WeakPolarHBondContact O-CA 3.43Å; L170-I191 PolarHBondContact N-O 3.24Å; L170-I191 PolarHBondContact O-N 2.86Å
171	T	86.7	Confident	83.8	Confident	3 Å²	3	39.1 Å²	39.1	2%	0.018	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	119.4	174.7	-61.2	0	0	0	0	110.2	K131 T188 V189 Y213 M214	K131-T171 PolarHBondContact NZ-OG1 2.74Å; T171-T188 HydrophobicContact CG2-CG2 3.78Å; T171-V189 WeakPolarHBondContact CA-O 3.11Å; T171-Y213 WeakPolarHBondContact O-CA 3.31Å; T171-M214 HydrophobicContact CG2-CB 4.46Å; T171-M214 HydrophobicContact CG2-CG 4.01Å; T171-M214 HydrophobicContact CG2-SD 3.59Å; T171-M214 VanDerWaalsContact CG2-SD 3.59Å; T171-M214 PolarHBondContact O-N 2.99Å
172	I	86.9	Confident	82.7	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	106	176.5	-46.4	-50.2	0	0	0	107.8	L151 L162 F186 T188 V189 I191 L211 G212	L151-I172 HydrophobicContact CD2-CD1 3.68Å; L151-I172 HydrophobicContact CD2-CG1 4.14Å; L162-I172 HydrophobicContact CD1-CG1 4.35Å; I172-F186 HydrophobicContact CB-CZ 4.19Å; I172-F186 HydrophobicContact CG2-CZ 3.74Å; I172-T188 WeakPolarHBondContact O-CA 3.06Å; I172-T188 WeakPolarHBondContact O-CG2 3.42Å; I172-V189 HydrophobicContact CB-CG1 3.82Å; I172-V189 HydrophobicContact CG1-CG1 4.12Å; I172-V189 PolarHBondContact N-O 2.93Å; I172-V189 PolarHBondContact O-N 3.01Å; I172-V189 VanDerWaalsContact O-N 3.11Å; I172-I191 HydrophobicContact CG1-CD1 3.98Å; I172-L211 HydrophobicContact CD1-CD1 4.02Å; I172-L211 HydrophobicContact CD1-CD2 3.78Å; I172-L211 HydrophobicContact CD1-CG 4.34Å; I172-L211 HydrophobicContact CG1-CD1 4.24Å; I172-L211 HydrophobicContact CG2-CD1 3.55Å; I172-L211 HydrophobicContact CG2-CD2 4.02Å; I172-L211 HydrophobicContact CG2-CG 3.57Å; I172-G212 CarbonylContact C-O 3.48Å; I172-G212 WeakPolarHBondContact CA-O 3.19Å
173	A	74.5	Confident	81.9	Confident	19 Å²	19	42.2 Å²	42.2	16%	0.157	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	-37.1	-174.1	0	0	0	0	0	112.8	T188 G212 M214	A173-T188 PolarHBondContact O-OG1 3.2Å; A173-G212 PolarHBondContact N-O 3.28Å; A173-M214 HydrophobicContact CB-CG 3.88Å; A173-M214 HydrophobicContact CB-SD 4.41Å
174	Y	76.6	Confident	80.3	Confident	34 Å²	34	42.4 Å²	42.4	13%	0.133	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	159.1	176.9	65	-99.6	0	0	0	110.6	Y210 G212 G222	Y174-Y210 AromaticContact CE2-CD1 3.47Å; Y174-Y210 HydrophobicContact CE2-CD1 3.47Å; Y174-Y210 VanDerWaalsContact CE2-CD1 3.47Å; Y174-Y210 AromaticContact CE2-CE1 3.65Å; Y174-Y210 HydrophobicContact CE2-CE1 3.65Å; Y174-Y210 AromaticContact CZ-CE1 3.76Å; Y174-Y210 WeakPolarHBondContact OH-CE1 3.42Å; Y174-G212 VanDerWaalsContact CE2-CA 3.43Å; Y174-G212 PolarHBondContact N-O 2.74Å; Y174-G212 PolarHBondContact O-N 3.13Å; Y174-G212 WeakPolarHBondContact OH-CA 3.09Å; Y174-G222 WeakPolarHBondContact OH-CA 3.19Å
175	L	77.9	Confident	78.8	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	126.8	177.1	-177.3	76.7	0	0	0	108.2	L160 V182 F183 F186 T201 F209 L211	L160-L175 HydrophobicContact CD2-CD1 4.1Å; L160-L175 HydrophobicContact CD2-CD2 3.36Å; L160-L175 HydrophobicContact CD2-CG 4.35Å; L175-V182 CarbonylContact O-C 3.59Å; L175-V182 WeakPolarHBondContact O-CA 3.49Å; L175-F183 HydrophobicContact CB-CD2 4.26Å; L175-F183 HydrophobicContact CD2-CD2 3.77Å; L175-F183 HydrophobicContact CD2-CE2 4.22Å; L175-F183 HydrophobicContact CG-CD2 3.67Å; L175-F183 HydrophobicContact CG-CE2 3.89Å; L175-F183 VanDerWaalsContact O-CD2 3.29Å; L175-F183 WeakPolarHBondContact O-CD2 3.26Å; L175-F183 PolarHBondContact O-N 3.35Å; L175-F186 HydrophobicContact CB-CD1 3.96Å; L175-F186 HydrophobicContact CB-CD2 3.57Å; L175-F186 HydrophobicContact CB-CE1 4.03Å; L175-F186 HydrophobicContact CB-CE2 3.63Å; L175-F186 HydrophobicContact CB-CG 3.74Å; L175-F186 HydrophobicContact CB-CZ 3.87Å; L175-F186 HydrophobicContact CD2-CD2 3.72Å; L175-F186 HydrophobicContact CD2-CE2 4.01Å; L175-F186 HydrophobicContact CD2-CG 4.47Å; L175-F186 HydrophobicContact CG-CD2 4.31Å; L175-F186 HydrophobicContact CG-CE2 4.43Å; L175-T201 HydrophobicContact CD2-CG2 3.96Å; L175-F209 HydrophobicContact CD1-CB 4.06Å; L175-F209 HydrophobicContact CD1-CD1 4.23Å; L175-F209 HydrophobicContact CD1-CG 4.47Å; L175-L211 HydrophobicContact CD1-CB 4.43Å; L175-L211 HydrophobicContact CD1-CD1 4.29Å
176	G	78.5	Confident	77.7	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	179.1	-170.8	0	0	0	0	0	114.1	N178 G181 F183 F209 Y210	G176-N178 VanDerWaalsContact C-N 3.34Å; G176-G181 WeakPolarHBondContact CA-O 3.4Å; G176-F183 WeakPolarHBondContact O-CE2 3.42Å; G176-F183 WeakPolarHBondContact O-CZ 3.3Å; G176-F209 CarbonylContact O-C 3.39Å; G176-F209 WeakPolarHBondContact O-CA 3.2Å; G176-Y210 PolarHBondContact N-O 3.11Å; G176-Y210 PolarHBondContact O-N 2.84Å
177	R	76.5	Confident	76.4	Confident	161 Å²	161	52.2 Å²	52.2	61%	0.608	28%	0.278	S	S	*	.	S	Bend	trans	-80.1	-22.7	162.6	-60.4	-174.8	-176.3	179.3	2.4	111.9	F183 Y204	R177-F183 HydrophobicContact CG-CE1 3.55Å; R177-F183 HydrophobicContact CG-CZ 3.69Å; R177-Y204 HydrophobicContact CG-CD2 4.16Å; R177-Y204 HydrophobicContact CG-CE2 3.89Å
178	N	72.3	Confident	75.5	Confident	79 Å²	79	55.8 Å²	55.8	42%	0.422	30%	0.299	S	S	.	.	S	Bend	trans	-155.7	-178.1	179.7	61.6	28.3	0	0	0	108.9	G176 K180 G181	G176-N178 VanDerWaalsContact C-N 3.34Å; N178-K180 PolarHBondContact O-N 3.11Å; N178-K180 VanDerWaalsContact O-N 3.16Å; N178-K180 PolarHBondContact OD1-N 2.88Å; N178-G181 PolarHBondContact OD1-N 2.96Å
179	E	69.2	Low	75	Confident	119 Å²	119	56 Å²	56	56%	0.556	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-13.9	-179.9	68.8	-158.2	-174.9	0	0	116.2	Y210	E179-Y210 HydrophobicContact CB-CD1 3.81Å; E179-Y210 HydrophobicContact CB-CE1 3.24Å
180	K	55.1	Low	74.7	Confident	149 Å²	149	57.8 Å²	57.8	65%	0.648	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-15.2	-169.3	-56.1	-168.1	178.4	-172.8	0	114.1	N178	N178-K180 PolarHBondContact O-N 3.11Å; N178-K180 VanDerWaalsContact O-N 3.16Å; N178-K180 PolarHBondContact OD1-N 2.88Å
181	G	60.4	Low	74.8	Confident	32 Å²	32	57.7 Å²	57.7	33%	0.33	31%	0.311	S	S	.	.			trans	-124	125.9	-173.7	0	0	0	0	0	112.4	G176 N178	G176-G181 WeakPolarHBondContact CA-O 3.4Å; N178-G181 PolarHBondContact OD1-N 2.96Å
182	V	69.5	Low	75.3	Confident	84 Å²	84	59 Å²	59	51%	0.509	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-90.5	132.8	167.9	-172.4	0	0	0	0	108.6	L175 F186	L175-V182 CarbonylContact O-C 3.59Å; L175-V182 WeakPolarHBondContact O-CA 3.49Å; V182-F186 HydrophobicContact CG1-CB 4.03Å; V182-F186 HydrophobicContact CG1-CD1 4Å; V182-F186 HydrophobicContact CG1-CG 4.47Å
183	F	72.7	Confident	75.8	Confident	13 Å²	13	59.6 Å²	59.6	6%	0.057	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-57.8	133.8	174.5	-72.2	-58.8	0	0	0	110.5	L175 G176 R177 G185 F186 T201 Y204 F209	L175-F183 HydrophobicContact CB-CD2 4.26Å; L175-F183 HydrophobicContact CD2-CD2 3.77Å; L175-F183 HydrophobicContact CD2-CE2 4.22Å; L175-F183 HydrophobicContact CG-CD2 3.67Å; L175-F183 HydrophobicContact CG-CE2 3.89Å; L175-F183 VanDerWaalsContact O-CD2 3.29Å; L175-F183 WeakPolarHBondContact O-CD2 3.26Å; L175-F183 PolarHBondContact O-N 3.35Å; G176-F183 WeakPolarHBondContact O-CE2 3.42Å; G176-F183 WeakPolarHBondContact O-CZ 3.3Å; R177-F183 HydrophobicContact CG-CE1 3.55Å; R177-F183 HydrophobicContact CG-CZ 3.69Å; F183-G185 PolarHBondContact O-N 2.74Å; F183-G185 VanDerWaalsContact O-N 3.12Å; F183-F186 HydrophobicContact CB-CB 4.37Å; F183-F186 WeakPolarHBondContact O-CB 3.22Å; F183-F186 PolarHBondContact O-N 2.76Å; F183-T201 HydrophobicContact CD2-CG2 4.17Å; F183-T201 HydrophobicContact CE2-CG2 4.4Å; F183-Y204 HydrophobicContact CD1-CD1 4.44Å; F183-Y204 HydrophobicContact CD1-CG 4.19Å; F183-Y204 AromaticContact CE1-CD1 3.45Å; F183-Y204 HydrophobicContact CE1-CD1 3.45Å; F183-Y204 VanDerWaalsContact CE1-CD1 3.45Å; F183-Y204 AromaticContact CE1-CD2 3.97Å; F183-Y204 HydrophobicContact CE1-CD2 3.97Å; F183-Y204 HydrophobicContact CE1-CE1 4.21Å; F183-Y204 AromaticContact CE1-CG 3.29Å; F183-Y204 HydrophobicContact CE1-CG 3.29Å; F183-Y204 AromaticContact CE2-CD1 3.99Å; F183-Y204 HydrophobicContact CE2-CD1 3.99Å; F183-Y204 HydrophobicContact CE2-CE1 4.45Å; F183-Y204 AromaticContact CZ-CD1 3.17Å; F183-Y204 HydrophobicContact CZ-CD1 3.17Å; F183-Y204 HydrophobicContact CZ-CD2 4.32Å; F183-Y204 AromaticContact CZ-CE1 3.61Å; F183-Y204 HydrophobicContact CZ-CE1 3.61Å; F183-Y204 AromaticContact CZ-CG 3.57Å; F183-Y204 HydrophobicContact CZ-CG 3.57Å; F183-F209 AromaticContact CE2-CD1 3.82Å; F183-F209 HydrophobicContact CE2-CD1 3.82Å; F183-F209 HydrophobicContact CE2-CE1 4.3Å; F183-F209 HydrophobicContact CZ-CD1 4.31Å
184	P	62.9	Low	76.9	Confident	100 Å²	100	63.6 Å²	63.6	65%	0.649	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	120.7	174.7	-25.1	33.7	0	0	0	110.6
185	G	64.3	Low	77.8	Confident	68 Å²	68	63.6 Å²	63.6	70%	0.701	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.6	-10.2	-179.8	0	0	0	0	0	115.4	F183 K187	F183-G185 PolarHBondContact O-N 2.74Å; F183-G185 VanDerWaalsContact O-N 3.12Å; G185-K187 PolarHBondContact O-N 2.9Å
186	F	72	Confident	78.7	Confident	18 Å²	18	67.1 Å²	67.1	8%	0.079	37%	0.367	C	S	.	.			trans	-68.9	130	170.6	-177.5	-93.1	0	0	0	110.1	I172 L175 V182 F183 V189 T199	I172-F186 HydrophobicContact CB-CZ 4.19Å; I172-F186 HydrophobicContact CG2-CZ 3.74Å; L175-F186 HydrophobicContact CB-CD1 3.96Å; L175-F186 HydrophobicContact CB-CD2 3.57Å; L175-F186 HydrophobicContact CB-CE1 4.03Å; L175-F186 HydrophobicContact CB-CE2 3.63Å; L175-F186 HydrophobicContact CB-CG 3.74Å; L175-F186 HydrophobicContact CB-CZ 3.87Å; L175-F186 HydrophobicContact CD2-CD2 3.72Å; L175-F186 HydrophobicContact CD2-CE2 4.01Å; L175-F186 HydrophobicContact CD2-CG 4.47Å; L175-F186 HydrophobicContact CG-CD2 4.31Å; L175-F186 HydrophobicContact CG-CE2 4.43Å; V182-F186 HydrophobicContact CG1-CB 4.03Å; V182-F186 HydrophobicContact CG1-CD1 4Å; V182-F186 HydrophobicContact CG1-CG 4.47Å; F183-F186 HydrophobicContact CB-CB 4.37Å; F183-F186 WeakPolarHBondContact O-CB 3.22Å; F183-F186 PolarHBondContact O-N 2.76Å; F186-V189 HydrophobicContact CE2-CG1 4.16Å; F186-V189 HydrophobicContact CZ-CG1 4.01Å; F186-T199 HydrophobicContact CD2-CG2 4.16Å; F186-T199 HydrophobicContact CE2-CG2 4.13Å
187	K	69.4	Low	79.4	Confident	169 Å²	169	69.2 Å²	69.2	74%	0.735	38%	0.379	S	S	*	.			trans	-117.1	146.8	169.8	-65.3	-176.6	179.8	-178.6	0	108.2	G185 V189	G185-K187 PolarHBondContact O-N 2.9Å; K187-V189 PolarHBondContact O-N 2.78Å
188	T	76.4	Confident	80	Confident	87 Å²	87	65.9 Å²	65.9	53%	0.534	37%	0.373	S	S	.	.			trans	-47.4	126.5	172.8	-58.4	0	0	0	0	110.1	T171 I172 A173	T171-T188 HydrophobicContact CG2-CG2 3.78Å; I172-T188 WeakPolarHBondContact O-CA 3.06Å; I172-T188 WeakPolarHBondContact O-CG2 3.42Å; A173-T188 PolarHBondContact O-OG1 3.2Å
189	V	86.2	Confident	80.4	Confident	20 Å²	20	63.3 Å²	63.3	12%	0.121	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135.8	-177.9	58.4	0	0	0	0	109.3	L162 T171 I172 F186 K187 I191 V197	L162-V189 HydrophobicContact CD1-CG1 3.78Å; T171-V189 WeakPolarHBondContact CA-O 3.11Å; I172-V189 HydrophobicContact CB-CG1 3.82Å; I172-V189 HydrophobicContact CG1-CG1 4.12Å; I172-V189 PolarHBondContact N-O 2.93Å; I172-V189 PolarHBondContact O-N 3.01Å; I172-V189 VanDerWaalsContact O-N 3.11Å; F186-V189 HydrophobicContact CE2-CG1 4.16Å; F186-V189 HydrophobicContact CZ-CG1 4.01Å; K187-V189 PolarHBondContact O-N 2.78Å; V189-I191 HydrophobicContact CG2-CG1 4.07Å; V189-V197 HydrophobicContact CG2-CB 4.04Å; V189-V197 HydrophobicContact CG2-CG1 3.6Å; V189-V197 HydrophobicContact CG2-CG2 4.17Å
190	M	89.2	Confident	80.8	Confident	55 Å²	55	60.6 Å²	60.6	27%	0.271	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	127.2	170.2	-178.8	-176.5	74.1	0	0	108.1	L101 K131 F133 Y169 L170	L101-M190 HydrophobicContact CD2-CE 3.31Å; L101-M190 HydrophobicContact CD2-SD 4.17Å; K131-M190 HydrophobicContact CD-SD 3.68Å; K131-M190 VanDerWaalsContact CE-SD 3.59Å; F133-M190 HydrophobicContact CE1-SD 4.09Å; F133-M190 HydrophobicContact CZ-SD 4.24Å; Y169-M190 HydrophobicContact CD1-CE 3.96Å; Y169-M190 HydrophobicContact CD1-CG 3.97Å; Y169-M190 HydrophobicContact CD1-SD 3.92Å; Y169-M190 HydrophobicContact CE1-CE 4.08Å; L170-M190 CarbonylContact O-C 3.53Å; L170-M190 WeakPolarHBondContact O-CA 3.43Å
191	I	94.2	Very high	81.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	113.9	-173.4	-48.2	169	0	0	0	106.6	L151 L162 N164 L170 I172 V189 S195 V197	L151-I191 HydrophobicContact CD1-CD1 3.57Å; L162-I191 HydrophobicContact CB-CD1 3.51Å; L162-I191 HydrophobicContact CD1-CD1 4Å; L162-I191 HydrophobicContact CG-CD1 4.41Å; N164-I191 HydrophobicContact CB-CB 4.11Å; N164-I191 HydrophobicContact CB-CG2 3.41Å; N164-I191 VanDerWaalsContact CB-CG2 3.41Å; N164-I191 PolarHBondContact ND2-O 3.03Å; N164-I191 VanDerWaalsContact ND2-O 3.11Å; L170-I191 PolarHBondContact N-O 3.24Å; L170-I191 PolarHBondContact O-N 2.86Å; I172-I191 HydrophobicContact CG1-CD1 3.98Å; V189-I191 HydrophobicContact CG2-CG1 4.07Å; I191-S195 WeakPolarHBondContact CG2-OG 3.18Å; I191-V197 HydrophobicContact CG1-CB 4.45Å; I191-V197 HydrophobicContact CG1-CG2 4.22Å; I191-V197 HydrophobicContact CG2-CG2 4.18Å
192	A	96.6	Very high	82.5	Confident	29 Å²	29	53 Å²	53	24%	0.24	31%	0.314	C	S	.	.			trans	-62.9	158.4	179.7	0	0	0	0	0	111.7	N164 Y169 F194 S195	N164-A192 PolarHBondContact ND2-O 2.99Å; Y169-A192 HydrophobicContact CD1-CB 4.16Å; Y169-A192 HydrophobicContact CE1-CB 3.67Å; A192-F194 PolarHBondContact O-N 2.77Å; A192-S195 WeakPolarHBondContact CA-OG 3.27Å; A192-S195 PolarHBondContact N-OG 2.83Å; A192-S195 WeakPolarHBondContact O-CB 3.47Å; A192-S195 PolarHBondContact O-N 2.8Å; A192-S195 VanDerWaalsContact O-N 3.14Å; A192-S195 PolarHBondContact O-OG 2.69Å
193	P	97.4	Very high	82.7	Confident	14 Å²	14	54.5 Å²	54.5	9%	0.091	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	133.9	173.6	-28.7	35.2	0	0	0	112	R98 T166 A167 Y169 S195	R98-P193 HydrophobicContact CB-CB 3.91Å; R98-P193 HydrophobicContact CB-CG 4.13Å; T166-P193 VanDerWaalsContact O-CA 3.28Å; T166-P193 WeakPolarHBondContact O-CA 3.49Å; A167-P193 WeakPolarHBondContact O-CG 3.39Å; Y169-P193 HydrophobicContact CD2-CG 3.99Å; Y169-P193 HydrophobicContact CE2-CG 4.01Å; P193-S195 PolarHBondContact O-N 3.46Å
194	F	97.2	Very high	82.9	Confident	104 Å²	104	55.5 Å²	55.5	46%	0.456	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	19.4	177.7	-44.4	-62.1	0	0	0	115.5	R98 N164 P165 T166 A167 A192	R98-F194 HydrophobicContact CB-CE2 4.11Å; N164-F194 CarbonylContact O-C 3.59Å; N164-F194 WeakPolarHBondContact O-CA 3.44Å; N164-F194 PolarHBondContact O-N 2.81Å; P165-F194 WeakPolarHBondContact O-CD1 3.05Å; P165-F194 WeakPolarHBondContact O-CE1 3.42Å; T166-F194 PolarHBondContact O-N 2.78Å; T166-F194 VanDerWaalsContact O-N 3.09Å; A167-F194 HydrophobicContact CB-CE2 4.33Å; A167-F194 HydrophobicContact CB-CZ 3.79Å; A192-F194 PolarHBondContact O-N 2.77Å
195	S	97	Very high	83.6	Confident	33 Å²	33	55.1 Å²	55.1	23%	0.231	33%	0.332	C	S	.	.			trans	-105.3	168.6	-177.7	77.6	0	0	0	0	112.7	N164 I191 A192 P193	N164-S195 PolarHBondContact N-O 3.18Å; I191-S195 WeakPolarHBondContact CG2-OG 3.18Å; A192-S195 WeakPolarHBondContact CA-OG 3.27Å; A192-S195 PolarHBondContact N-OG 2.83Å; A192-S195 WeakPolarHBondContact O-CB 3.47Å; A192-S195 PolarHBondContact O-N 2.8Å; A192-S195 VanDerWaalsContact O-N 3.14Å; A192-S195 PolarHBondContact O-OG 2.69Å; P193-S195 PolarHBondContact O-N 3.46Å
196	T	96.2	Very high	84.2	Confident	75 Å²	75	53 Å²	53	46%	0.46	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	135	177.1	-61.3	0	0	0	0	109.1	T161 L162 K163	T161-T196 HydrophobicContact CG2-CG2 3.34Å; L162-T196 WeakPolarHBondContact O-CA 3.47Å; K163-T196 HydrophobicContact CB-CG2 4.32Å
197	V	92.2	Very high	84.4	Confident	44 Å²	44	55.4 Å²	55.4	27%	0.267	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	136.6	175	179.9	0	0	0	0	109.6	L162 V189 I191	L162-V197 PolarHBondContact N-O 2.71Å; L162-V197 PolarHBondContact O-N 3.11Å; V189-V197 HydrophobicContact CG2-CB 4.04Å; V189-V197 HydrophobicContact CG2-CG1 3.6Å; V189-V197 HydrophobicContact CG2-CG2 4.17Å; I191-V197 HydrophobicContact CG1-CB 4.45Å; I191-V197 HydrophobicContact CG1-CG2 4.22Å; I191-V197 HydrophobicContact CG2-CG2 4.18Å
198	N	90	Very high	84.8	Confident	91 Å²	91	52.3 Å²	52.3	49%	0.487	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	131.2	171.6	-66.5	-32.3	0	0	0	109.8	Q159 L160 T161	Q159-N198 HydrophobicContact CG-CB 4.3Å; L160-N198 CarbonylContact O-C 3.57Å; L160-N198 WeakPolarHBondContact O-CA 3.4Å; T161-N198 WeakPolarHBondContact CB-OD1 3.41Å; T161-N198 WeakPolarHBondContact CG2-OD1 3.32Å; T161-N198 PolarHBondContact OG1-OD1 2.81Å
199	T	81	Confident	84.9	Confident	25 Å²	25	48.3 Å²	48.3	15%	0.153	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	176.7	173.3	-168.4	0	0	0	0	109.8	L160 L162 F186	L160-T199 HydrophobicContact CB-CG2 3.91Å; L160-T199 HydrophobicContact CD2-CG2 4.17Å; L160-T199 HydrophobicContact CG-CG2 4.49Å; L160-T199 PolarHBondContact N-O 2.95Å; L160-T199 PolarHBondContact O-N 2.93Å; L162-T199 HydrophobicContact CD1-CG2 4.04Å; L162-T199 HydrophobicContact CG-CG2 4.32Å; F186-T199 HydrophobicContact CD2-CG2 4.16Å; F186-T199 HydrophobicContact CE2-CG2 4.13Å
200	N	77.5	Confident	84.5	Confident	63 Å²	63	49 Å²	49	34%	0.337	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	142.2	-178.5	-167.2	-46.1	0	0	0	110.1	N158 G202	N158-N200 PolarHBondContact ND2-ND2 2.77Å; N158-N200 WeakPolarHBondContact O-CA 3.33Å; N158-N200 VanDerWaalsContact O-CG 3.29Å; N158-N200 PolarHBondContact O-OD1 3.04Å; N158-N200 VanDerWaalsContact O-OD1 3.1Å; N200-G202 WeakPolarHBondContact OD1-CA 3.42Å; N200-G202 PolarHBondContact OD1-N 2.79Å; N200-G202 PolarHBondContact OD1-O 3.12Å
201	T	73.9	Confident	83.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	28%	0.282	C	S	.	.			trans	-99.9	17.1	179.8	49.6	0	0	0	0	112.6	Q155 N158 L160 L175 F183 S203 Y204 F209	Q155-T201 PolarHBondContact NE2-OG1 3.16Å; N158-T201 PolarHBondContact O-N 2.73Å; N158-T201 VanDerWaalsContact O-N 3.12Å; N158-T201 PolarHBondContact O-OG1 3.28Å; L160-T201 HydrophobicContact CB-CG2 3.92Å; L160-T201 HydrophobicContact CD1-CG2 4.48Å; L160-T201 HydrophobicContact CD2-CG2 4.06Å; L160-T201 HydrophobicContact CG-CG2 4.41Å; L175-T201 HydrophobicContact CD2-CG2 3.96Å; F183-T201 HydrophobicContact CD2-CG2 4.17Å; F183-T201 HydrophobicContact CE2-CG2 4.4Å; T201-S203 PolarHBondContact O-N 3.41Å; T201-Y204 WeakPolarHBondContact CB-O 3.29Å; T201-Y204 WeakPolarHBondContact O-CB 3.26Å; T201-Y204 PolarHBondContact O-N 3.29Å; T201-Y204 VanDerWaalsContact O-N 3.12Å; T201-Y204 PolarHBondContact OG1-O 3.42Å; T201-F209 HydrophobicContact CG2-CD1 4.48Å; T201-F209 HydrophobicContact CG2-CE1 3.8Å
202	G	76.1	Confident	83.1	Confident	22 Å²	22	46.7 Å²	46.7	23%	0.227	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	-119.8	-172.4	0	0	0	0	0	110.9	N158 N200	N158-G202 VanDerWaalsContact CB-O 3.23Å; N158-G202 WeakPolarHBondContact CB-O 3.47Å; N200-G202 WeakPolarHBondContact OD1-CA 3.42Å; N200-G202 PolarHBondContact OD1-N 2.79Å; N200-G202 PolarHBondContact OD1-O 3.12Å
203	S	74.9	Confident	82.4	Confident	114 Å²	114	46.3 Å²	46.3	80%	0.797	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	0.2	176.3	54	0	0	0	0	113.6	T201	T201-S203 PolarHBondContact O-N 3.41Å
204	Y	77.3	Confident	81.3	Confident	34 Å²	34	47.9 Å²	47.9	13%	0.133	28%	0.281	C	S	.	.			trans	-82.1	123.6	-177.9	-177.2	-107.4	0	0	0	111.5	Q155 R177 F183 T201 G206 Q208 F209	Q155-Y204 PolarHBondContact NE2-O 2.83Å; R177-Y204 HydrophobicContact CG-CD2 4.16Å; R177-Y204 HydrophobicContact CG-CE2 3.89Å; F183-Y204 HydrophobicContact CD1-CD1 4.44Å; F183-Y204 HydrophobicContact CD1-CG 4.19Å; F183-Y204 AromaticContact CE1-CD1 3.45Å; F183-Y204 HydrophobicContact CE1-CD1 3.45Å; F183-Y204 VanDerWaalsContact CE1-CD1 3.45Å; F183-Y204 AromaticContact CE1-CD2 3.97Å; F183-Y204 HydrophobicContact CE1-CD2 3.97Å; F183-Y204 HydrophobicContact CE1-CE1 4.21Å; F183-Y204 AromaticContact CE1-CG 3.29Å; F183-Y204 HydrophobicContact CE1-CG 3.29Å; F183-Y204 AromaticContact CE2-CD1 3.99Å; F183-Y204 HydrophobicContact CE2-CD1 3.99Å; F183-Y204 HydrophobicContact CE2-CE1 4.45Å; F183-Y204 AromaticContact CZ-CD1 3.17Å; F183-Y204 HydrophobicContact CZ-CD1 3.17Å; F183-Y204 HydrophobicContact CZ-CD2 4.32Å; F183-Y204 AromaticContact CZ-CE1 3.61Å; F183-Y204 HydrophobicContact CZ-CE1 3.61Å; F183-Y204 AromaticContact CZ-CG 3.57Å; F183-Y204 HydrophobicContact CZ-CG 3.57Å; T201-Y204 WeakPolarHBondContact CB-O 3.29Å; T201-Y204 WeakPolarHBondContact O-CB 3.26Å; T201-Y204 PolarHBondContact O-N 3.29Å; T201-Y204 VanDerWaalsContact O-N 3.12Å; T201-Y204 PolarHBondContact OG1-O 3.42Å; Y204-G206 WeakPolarHBondContact CE1-O 3.43Å; Y204-G206 VanDerWaalsContact CZ-CA 3.46Å; Y204-G206 WeakPolarHBondContact OH-CA 3.37Å; Y204-Q208 VanDerWaalsContact CE1-O 3.3Å; Y204-Q208 WeakPolarHBondContact CE1-O 3.43Å; Y204-Q208 PolarHBondContact OH-O 2.84Å; Y204-F209 HydrophobicContact CD1-CD1 4.34Å; Y204-F209 AromaticContact CD1-CE1 3.73Å; Y204-F209 HydrophobicContact CD1-CE1 3.73Å; Y204-F209 HydrophobicContact CD1-CZ 4.39Å; Y204-F209 HydrophobicContact CE1-CD1 4.03Å; Y204-F209 AromaticContact CE1-CE1 3.59Å; Y204-F209 HydrophobicContact CE1-CE1 3.59Å; Y204-F209 HydrophobicContact CE1-CZ 4.02Å
205	S	77	Confident	80.3	Confident	93 Å²	93	44.7 Å²	44.7	65%	0.65	27%	0.268	S	S	*	.			trans	-124.4	25.7	178.5	65.4	0	0	0	0	112.8
206	G	76.3	Confident	79.2	Confident	22 Å²	22	44.5 Å²	44.5	23%	0.227	27%	0.265	C	S	.	.			trans	-85.1	161.6	-179.9	0	0	0	0	0	112.4	Q155 Y204 Q208 F209	Q155-G206 PolarHBondContact OE1-O 2.63Å; Y204-G206 WeakPolarHBondContact CE1-O 3.43Å; Y204-G206 VanDerWaalsContact CZ-CA 3.46Å; Y204-G206 WeakPolarHBondContact OH-CA 3.37Å; G206-Q208 VanDerWaalsContact C-N 3.34Å; G206-Q208 PolarHBondContact O-N 2.64Å; G206-F209 WeakPolarHBondContact O-CE2 3.3Å; G206-F209 WeakPolarHBondContact O-CZ 3.35Å
207	S	76.1	Confident	77.7	Confident	70 Å²	70	49 Å²	49	49%	0.49	27%	0.274	S	S	.	.	S	Bend	trans	-83.8	-3.7	-177.2	55.5	0	0	0	0	114.3	S226 A227	S207-S226 CarbonylContact O-C 3.58Å; S207-S226 VanDerWaalsContact O-CA 3.22Å; S207-S226 WeakPolarHBondContact O-CA 3.24Å; S207-S226 PolarHBondContact O-OG 3.27Å; S207-A227 PolarHBondContact O-N 2.85Å
208	Q	79.3	Confident	76	Confident	104 Å²	104	47.7 Å²	47.7	49%	0.486	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	135.8	-174.9	-64.2	-134.5	-38.3	0	0	112.2	Y204 G206 M225	Y204-Q208 VanDerWaalsContact CE1-O 3.3Å; Y204-Q208 WeakPolarHBondContact CE1-O 3.43Å; Y204-Q208 PolarHBondContact OH-O 2.84Å; G206-Q208 VanDerWaalsContact C-N 3.34Å; G206-Q208 PolarHBondContact O-N 2.64Å; Q208-M225 WeakPolarHBondContact CA-O 3.41Å
209	F	77	Confident	74.1	Confident	3 Å²	3	44.8 Å²	44.8	1%	0.013	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.8	-174.6	-55.6	-89.7	0	0	0	108.7	Q155 L160 L175 G176 F183 T201 Y204 G206 E224 M225 A227	Q155-F209 HydrophobicContact CB-CZ 4.26Å; Q155-F209 HydrophobicContact CG-CZ 4.42Å; L160-F209 HydrophobicContact CD1-CE1 3.92Å; L160-F209 HydrophobicContact CD1-CE2 4.17Å; L160-F209 HydrophobicContact CD1-CZ 3.71Å; L160-F209 HydrophobicContact CD2-CD1 4.47Å; L160-F209 HydrophobicContact CD2-CE1 4.43Å; L175-F209 HydrophobicContact CD1-CB 4.06Å; L175-F209 HydrophobicContact CD1-CD1 4.23Å; L175-F209 HydrophobicContact CD1-CG 4.47Å; G176-F209 CarbonylContact O-C 3.39Å; G176-F209 WeakPolarHBondContact O-CA 3.2Å; F183-F209 AromaticContact CE2-CD1 3.82Å; F183-F209 HydrophobicContact CE2-CD1 3.82Å; F183-F209 HydrophobicContact CE2-CE1 4.3Å; F183-F209 HydrophobicContact CZ-CD1 4.31Å; T201-F209 HydrophobicContact CG2-CD1 4.48Å; T201-F209 HydrophobicContact CG2-CE1 3.8Å; Y204-F209 HydrophobicContact CD1-CD1 4.34Å; Y204-F209 AromaticContact CD1-CE1 3.73Å; Y204-F209 HydrophobicContact CD1-CE1 3.73Å; Y204-F209 HydrophobicContact CD1-CZ 4.39Å; Y204-F209 HydrophobicContact CE1-CD1 4.03Å; Y204-F209 AromaticContact CE1-CE1 3.59Å; Y204-F209 HydrophobicContact CE1-CE1 3.59Å; Y204-F209 HydrophobicContact CE1-CZ 4.02Å; G206-F209 WeakPolarHBondContact O-CE2 3.3Å; G206-F209 WeakPolarHBondContact O-CZ 3.35Å; F209-E224 CarbonylContact O-C 3.55Å; F209-E224 WeakPolarHBondContact O-CA 3.31Å; F209-M225 PolarHBondContact N-O 2.85Å; F209-M225 PolarHBondContact O-N 2.9Å; F209-A227 HydrophobicContact CD2-CB 4.38Å; F209-A227 HydrophobicContact CE2-CB 3.64Å
210	Y	78.4	Confident	72.9	Confident	35 Å²	35	52.8 Å²	52.8	14%	0.137	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120.6	163	-167.5	-106.5	0	0	0	108.1	Y174 G176 E179 G222 E223 E224	Y174-Y210 AromaticContact CE2-CD1 3.47Å; Y174-Y210 HydrophobicContact CE2-CD1 3.47Å; Y174-Y210 VanDerWaalsContact CE2-CD1 3.47Å; Y174-Y210 AromaticContact CE2-CE1 3.65Å; Y174-Y210 HydrophobicContact CE2-CE1 3.65Å; Y174-Y210 AromaticContact CZ-CE1 3.76Å; Y174-Y210 WeakPolarHBondContact OH-CE1 3.42Å; G176-Y210 PolarHBondContact N-O 3.11Å; G176-Y210 PolarHBondContact O-N 2.84Å; E179-Y210 HydrophobicContact CB-CD1 3.81Å; E179-Y210 HydrophobicContact CB-CE1 3.24Å; Y210-G222 WeakPolarHBondContact OH-CA 3.39Å; Y210-E223 WeakPolarHBondContact CD2-O 3.39Å; Y210-E224 HydrophobicContact CD2-CB 4.45Å; Y210-E224 HydrophobicContact CD2-CG 3.65Å; Y210-E224 HydrophobicContact CE2-CG 4.25Å
211	L	77.3	Confident	71.5	Confident	6 Å²	6	50.6 Å²	50.6	3%	0.031	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.4	-175.1	-176.9	142.2	0	0	0	109.8	L151 I172 L175 Y213 G222 E223 M225	L151-L211 HydrophobicContact CD2-CD1 3.62Å; I172-L211 HydrophobicContact CD1-CD1 4.02Å; I172-L211 HydrophobicContact CD1-CD2 3.78Å; I172-L211 HydrophobicContact CD1-CG 4.34Å; I172-L211 HydrophobicContact CG1-CD1 4.24Å; I172-L211 HydrophobicContact CG2-CD1 3.55Å; I172-L211 HydrophobicContact CG2-CD2 4.02Å; I172-L211 HydrophobicContact CG2-CG 3.57Å; L175-L211 HydrophobicContact CD1-CB 4.43Å; L175-L211 HydrophobicContact CD1-CD1 4.29Å; L211-Y213 HydrophobicContact CD2-CD1 4.32Å; L211-G222 WeakPolarHBondContact O-CA 3.49Å; L211-E223 PolarHBondContact N-O 3.42Å; L211-E223 PolarHBondContact O-N 2.81Å; L211-M225 HydrophobicContact CB-SD 4.19Å; L211-M225 HydrophobicContact CD1-SD 4.26Å
212	G	77.5	Confident	70.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	123.6	170.7	0	0	0	0	0	111.2	I172 A173 Y174 G221	I172-G212 CarbonylContact C-O 3.48Å; I172-G212 WeakPolarHBondContact CA-O 3.19Å; A173-G212 PolarHBondContact N-O 3.28Å; Y174-G212 VanDerWaalsContact CE2-CA 3.43Å; Y174-G212 PolarHBondContact N-O 2.74Å; Y174-G212 PolarHBondContact O-N 3.13Å; Y174-G212 WeakPolarHBondContact OH-CA 3.09Å; G212-G221 CarbonylContact C-O 3.47Å; G212-G221 VanDerWaalsContact CA-O 3.26Å; G212-G221 WeakPolarHBondContact CA-O 3.27Å
213	Y	81.7	Confident	69.7	Low	20 Å²	20	54 Å²	54	8%	0.078	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	157.1	175.4	63.1	-95.1	0	0	0	111.3	E148 L149 T171 L211 R220 G221	E148-Y213 HydrophobicContact CB-CD1 4.27Å; E148-Y213 HydrophobicContact CB-CD2 3.68Å; E148-Y213 HydrophobicContact CB-CE2 4.11Å; E148-Y213 HydrophobicContact CB-CG 3.76Å; E148-Y213 HydrophobicContact CG-CD2 3.62Å; E148-Y213 HydrophobicContact CG-CE2 4.15Å; E148-Y213 HydrophobicContact CG-CG 4.12Å; L149-Y213 HydrophobicContact CD2-CE1 3.99Å; T171-Y213 WeakPolarHBondContact O-CA 3.31Å; L211-Y213 HydrophobicContact CD2-CD1 4.32Å; Y213-R220 WeakPolarHBondContact O-CA 3.3Å; Y213-G221 PolarHBondContact N-O 2.75Å; Y213-G221 PolarHBondContact O-N 2.88Å
214	M	73.6	Confident	68.8	Low	48 Å²	48	55.2 Å²	55.2	24%	0.236	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	119.6	172.1	-54.1	-177.1	91.9	0	0	109.6	R25 T171 A173 A219	R25-M214 PolarHBondContact NH1-O 2.55Å; T171-M214 HydrophobicContact CG2-CB 4.46Å; T171-M214 HydrophobicContact CG2-CG 4.01Å; T171-M214 HydrophobicContact CG2-SD 3.59Å; T171-M214 VanDerWaalsContact CG2-SD 3.59Å; T171-M214 PolarHBondContact O-N 2.99Å; A173-M214 HydrophobicContact CB-CG 3.88Å; A173-M214 HydrophobicContact CB-SD 4.41Å; M214-A219 WeakPolarHBondContact CA-O 3.2Å
215	D	76.7	Confident	68	Low	36 Å²	36	55.3 Å²	55.3	19%	0.193	29%	0.29	C	S	.	.			trans	-75.2	175.6	175.2	76.2	8.7	0	0	0	112.1	R25 Y217 G218 A219	R25-D215 WeakPolarHBondContact CD-O 3.4Å; R25-D215 PolarHBondContact NE-O 2.75Å; R25-D215 PolarHBondContact NH1-O 3.34Å; D215-Y217 PolarHBondContact O-N 2.85Å; D215-Y217 WeakPolarHBondContact OD1-CA 3.42Å; D215-Y217 PolarHBondContact OD1-N 3.5Å; D215-G218 PolarHBondContact O-N 3.13Å; D215-G218 PolarHBondContact OD1-N 2.99Å; D215-A219 PolarHBondContact N-O 2.53Å; D215-A219 PolarHBondContact OD1-N 2.87Å
216	D	73.7	Confident	67	Low	30 Å²	30	54.3 Å²	54.3	16%	0.16	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-22.1	-177.3	-74.8	-12.7	0	0	0	115.1	R25 V27 R135 K141	R25-D216 WeakPolarHBondContact CD-O 3.11Å; R25-D216 VanDerWaalsContact CZ-CA 3.48Å; R25-D216 PolarHBondContact NE-O 2.63Å; R25-D216 IonicContact NH2-OD1 2.66Å; R25-D216 PolarHBondContact NH2-OD1 2.94Å; V27-D216 HydrophobicContact CG2-CB 4.05Å; R135-D216 IonicContact CZ-OD1 3.15Å; R135-D216 IonicContact CZ-OD2 2.83Å; R135-D216 VanDerWaalsContact CZ-OD2 3.29Å; R135-D216 IonicContact NH1-OD1 2.99Å; R135-D216 IonicContact NH1-OD2 3.24Å; R135-D216 PolarHBondContact NH1-OD2 3.29Å; R135-D216 IonicContact NH2-OD1 3.16Å; R135-D216 PolarHBondContact NH2-OD1 3.36Å; R135-D216 IonicContact NH2-OD2 2.76Å; R135-D216 PolarHBondContact NH2-OD2 2.93Å; K141-D216 WeakPolarHBondContact CD-OD2 3.43Å; K141-D216 IonicContact NZ-OD1 3.91Å; K141-D216 PolarHBondContact NZ-OD1 2.91Å; K141-D216 IonicContact NZ-OD2 2.79Å; K141-D216 PolarHBondContact NZ-OD2 3.02Å
217	Y	64.3	Low	65.9	Low	168 Å²	168	54.4 Å²	54.4	66%	0.659	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-5.4	-179.1	-57.2	-78.8	0	0	0	112.7	D215 A219	D215-Y217 PolarHBondContact O-N 2.85Å; D215-Y217 WeakPolarHBondContact OD1-CA 3.42Å; D215-Y217 PolarHBondContact OD1-N 3.5Å; Y217-A219 VanDerWaalsContact C-N 3.31Å
218	G	56.5	Low	64.7	Low	17 Å²	17	53.5 Å²	53.5	18%	0.175	28%	0.283	C	S	.	.	S	Bend	trans	87	5.4	-178.5	0	0	0	0	0	112.6	D215	D215-G218 PolarHBondContact O-N 3.13Å; D215-G218 PolarHBondContact OD1-N 2.99Å
219	A	49.6	Very low	62.6	Low	30 Å²	30	58.5 Å²	58.5	25%	0.248	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-72.3	148.1	172.3	0	0	0	0	0	109.8	M214 D215 Y217	M214-A219 WeakPolarHBondContact CA-O 3.2Å; D215-A219 PolarHBondContact N-O 2.53Å; D215-A219 PolarHBondContact OD1-N 2.87Å; Y217-A219 VanDerWaalsContact C-N 3.31Å
220	R	56.1	Low	60.5	Low	194 Å²	194	62.2 Å²	62.2	73%	0.732	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	119.6	177.7	-70.4	-177	-105.7	-167.9	-2.8	108.9	Y213	Y213-R220 WeakPolarHBondContact O-CA 3.3Å
221	G	48.8	Very low	58.3	Low	16 Å²	16	66.6 Å²	66.6	17%	0.165	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	155	162.5	0	0	0	0	0	109.9	G212 Y213	G212-G221 CarbonylContact C-O 3.47Å; G212-G221 VanDerWaalsContact CA-O 3.26Å; G212-G221 WeakPolarHBondContact CA-O 3.27Å; Y213-G221 PolarHBondContact N-O 2.75Å; Y213-G221 PolarHBondContact O-N 2.88Å
222	G	51.5	Low	56	Low	26 Å²	26	73.5 Å²	73.5	27%	0.268	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	138.8	177.6	0	0	0	0	0	111.1	Y174 Y210 L211	Y174-G222 WeakPolarHBondContact OH-CA 3.19Å; Y210-G222 WeakPolarHBondContact OH-CA 3.39Å; L211-G222 WeakPolarHBondContact O-CA 3.49Å
223	E	60.5	Low	54	Low	69 Å²	69	80.7 Å²	80.7	32%	0.322	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	147.3	178.3	-141.2	139.9	157.6	0	0	111.3	K146 L149 Y210 L211	K146-E223 IonicContact NZ-OE1 3.65Å; K146-E223 IonicContact NZ-OE2 3.01Å; K146-E223 PolarHBondContact NZ-OE2 2.79Å; L149-E223 WeakPolarHBondContact CD1-OE1 2.92Å; L149-E223 HydrophobicContact CD2-CB 3.9Å; L149-E223 HydrophobicContact CD2-CG 4.16Å; L149-E223 WeakPolarHBondContact CD2-OE2 3.26Å; Y210-E223 WeakPolarHBondContact CD2-O 3.39Å; L211-E223 PolarHBondContact N-O 3.42Å; L211-E223 PolarHBondContact O-N 2.81Å
224	E	56.5	Low	51.6	Low	139 Å²	139	84.8 Å²	84.8	65%	0.65	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	135.7	172.8	-73.9	-176.4	172.4	0	0	110.6	F209 Y210	F209-E224 CarbonylContact O-C 3.55Å; F209-E224 WeakPolarHBondContact O-CA 3.31Å; Y210-E224 HydrophobicContact CD2-CB 4.45Å; Y210-E224 HydrophobicContact CD2-CG 3.65Å; Y210-E224 HydrophobicContact CE2-CG 4.25Å
225	M	60.7	Low	49.9	Very low	35 Å²	35	88.8 Å²	88.8	17%	0.172	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	144.7	-179.1	-65.9	-167	71.8	0	0	111.1	L151 V153 Q208 F209 L211	L151-M225 VanDerWaalsContact O-CE 3.3Å; L151-M225 WeakPolarHBondContact O-CE 3.43Å; V153-M225 HydrophobicContact CB-CE 4.47Å; V153-M225 HydrophobicContact CG2-CE 3.72Å; V153-M225 HydrophobicContact CG2-SD 4.04Å; Q208-M225 WeakPolarHBondContact CA-O 3.41Å; F209-M225 PolarHBondContact N-O 2.85Å; F209-M225 PolarHBondContact O-N 2.9Å; L211-M225 HydrophobicContact CB-SD 4.19Å; L211-M225 HydrophobicContact CD1-SD 4.26Å
226	S	55.7	Low	47.8	Very low	73 Å²	73	91.9 Å²	91.9	51%	0.51	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130	174.5	-169.3	0	0	0	0	111	S207 G228	S207-S226 CarbonylContact O-C 3.58Å; S207-S226 VanDerWaalsContact O-CA 3.22Å; S207-S226 WeakPolarHBondContact O-CA 3.24Å; S207-S226 PolarHBondContact O-OG 3.27Å; S226-G228 PolarHBondContact O-N 2.95Å
227	A	52.2	Low	45.8	Very low	23 Å²	23	98.2 Å²	98.2	19%	0.19	55%	0.551	C	S	.	*			trans	-73.3	111.6	170.9	0	0	0	0	0	109.9	Q155 S207 F209	Q155-A227 HydrophobicContact CB-CB 4.43Å; S207-A227 PolarHBondContact O-N 2.85Å; F209-A227 HydrophobicContact CD2-CB 4.38Å; F209-A227 HydrophobicContact CE2-CB 3.64Å
228	G	52	Low	44.4	Very low	51 Å²	51	96.7 Å²	96.7	53%	0.526	55%	0.554	S	S	.	*			trans	-172.7	138.1	-179.2	0	0	0	0	0	111.7	S226 G230	S226-G228 PolarHBondContact O-N 2.95Å; G228-G230 PolarHBondContact O-N 3.32Å
229	K	33.5	Very low	43.3	Very low	209 Å²	209	106 Å²	106	91%	0.909	59%	0.59	S	S	*	*	S	Bend	trans	-52.6	109.8	-174	-68.7	177.1	176.4	179.1	0	111.5
230	G	33.4	Very low	42.3	Very low	82 Å²	82	112 Å²	112	85%	0.845	62%	0.617	S	S	*	*			trans	43.9	75.2	161.5	0	0	0	0	0	115.1	G228	G228-G230 PolarHBondContact O-N 3.32Å
231	V	33.5	Very low	41	Very low	126 Å²	126	108.1 Å²	108.1	76%	0.764	62%	0.617	S	S	*	*			trans	-120.7	112.8	169.4	-178.2	0	0	0	0	108.9	L233	V231-L233 PolarHBondContact O-N 2.84Å
232	L	29.1	Very low	40.3	Very low	151 Å²	151	115.6 Å²	115.6	79%	0.791	65%	0.652	S	S	*	*			trans	-49.3	115.8	163.5	-153.2	87.2	0	0	0	107.8	V234	L232-V234 HydrophobicContact CD2-CG2 4.07Å; L232-V234 PolarHBondContact O-N 2.84Å
233	L	34.1	Very low	39.5	Very low	152 Å²	152	123.7 Å²	123.7	80%	0.796	68%	0.68	S	S	*	*			trans	-75.2	83.4	176.5	-142.1	158.2	0	0	0	107.8	V231 I235	V231-L233 PolarHBondContact O-N 2.84Å; L233-I235 HydrophobicContact CD2-CG1 4.3Å; L233-I235 PolarHBondContact O-N 2.94Å; L233-I235 VanDerWaalsContact O-N 3.16Å
234	V	32.3	Very low	38.4	Very low	105 Å²	105	125.6 Å²	125.6	64%	0.636	70%	0.701	S	S	*	*			trans	-68.3	104.9	165	176.2	0	0	0	0	105.9	L232 C236	L232-V234 HydrophobicContact CD2-CG2 4.07Å; L232-V234 PolarHBondContact O-N 2.84Å; V234-C236 VanDerWaalsContact C-N 3.34Å; V234-C236 PolarHBondContact O-N 2.66Å
235	I	38.3	Very low	37.9	Very low	132 Å²	132	121.7 Å²	121.7	68%	0.677	69%	0.692	S	S	*	*			trans	-61.9	100.2	168.7	-63.7	172.5	0	0	0	106.4	L233 L237	L233-I235 HydrophobicContact CD2-CG1 4.3Å; L233-I235 PolarHBondContact O-N 2.94Å; L233-I235 VanDerWaalsContact O-N 3.16Å; I235-L237 VanDerWaalsContact C-N 3.3Å; I235-L237 HydrophobicContact CG2-CG 4.46Å; I235-L237 PolarHBondContact O-N 3.5Å
236	C	31.2	Very low	37.5	Very low	101 Å²	101	124.8 Å²	124.8	68%	0.682	71%	0.709	S	S	*	*			trans	-64.6	99	159.7	-84.7	0	0	0	0	107.1	V234 L238	V234-C236 VanDerWaalsContact C-N 3.34Å; V234-C236 PolarHBondContact O-N 2.66Å; C236-L238 HydrophobicContact CB-CD1 4.32Å; C236-L238 HydrophobicContact CB-CG 4.38Å; C236-L238 PolarHBondContact O-N 3.36Å
237	L	31.7	Very low	38	Very low	164 Å²	164	122 Å²	122	86%	0.859	69%	0.69	S	S	*	*			trans	-60.9	80.4	158.2	-79.5	156.9	0	0	0	108	I235	I235-L237 VanDerWaalsContact C-N 3.3Å; I235-L237 HydrophobicContact CG2-CG 4.46Å; I235-L237 PolarHBondContact O-N 3.5Å
238	L	35.4	Very low	39.8	Very low	135 Å²	135	120.9 Å²	120.9	71%	0.707	68%	0.681	S	S	*	*			trans	-107.3	113.8	164.5	-75.7	169.4	0	0	0	106.7	C236 L240	C236-L238 HydrophobicContact CB-CD1 4.32Å; C236-L238 HydrophobicContact CB-CG 4.38Å; C236-L238 PolarHBondContact O-N 3.36Å; L238-L240 PolarHBondContact O-N 3.49Å
239	F	32.3	Very low	41.8	Very low	213 Å²	213	119.3 Å²	119.3	93%	0.934	66%	0.661	S	S	*	*			trans	-25.9	89.5	170.6	-73.3	-98	0	0	0	113.2
240	L	30.1	Very low	44.8	Very low	155 Å²	155	109.3 Å²	109.3	81%	0.812	62%	0.617	S	S	*	*			trans	-88.7	131.7	159.5	-82.5	158.8	0	0	0	106.6	L238 L242	L238-L240 PolarHBondContact O-N 3.49Å; L240-L242 PolarHBondContact O-N 3.07Å
241	P	29	Very low	47.8	Very low	113 Å²	113	106.1 Å²	106.1	73%	0.734	58%	0.58	S	S	*	*			trans	-56.1	131.6	173.8	24.6	-31.8	0	0	0	108.3	K243	P241-K243 PolarHBondContact O-N 2.86Å
242	L	33.2	Very low	50.7	Low	173 Å²	173	103.3 Å²	103.3	91%	0.906	56%	0.558	S	S	*	*			trans	-45.4	110.7	176.2	-78.4	117.5	0	0	0	108.8	L240 S244	L240-L242 PolarHBondContact O-N 3.07Å; L242-S244 PolarHBondContact O-N 2.72Å; L242-S244 VanDerWaalsContact O-N 3.08Å
243	K	34	Very low	53.7	Low	197 Å²	197	97.4 Å²	97.4	86%	0.857	53%	0.533	S	S	*	.			trans	-60.1	117.1	162.3	-75.1	-173.6	177.2	-177.6	0	105.1	P241 A245	P241-K243 PolarHBondContact O-N 2.86Å; K243-A245 PolarHBondContact O-N 2.86Å
244	S	37.6	Very low	56.4	Low	108 Å²	108	93.6 Å²	93.6	76%	0.755	52%	0.519	S	S	*	.			trans	-40.2	118.4	171.3	-42.5	0	0	0	0	107.7	L242 L246	L242-S244 PolarHBondContact O-N 2.72Å; L242-S244 VanDerWaalsContact O-N 3.08Å; S244-L246 PolarHBondContact O-N 3.15Å; S244-L246 VanDerWaalsContact O-N 3.1Å
245	A	45.8	Very low	59.4	Low	58 Å²	58	91.8 Å²	91.8	48%	0.479	51%	0.511	S	S	.	.			trans	-48.6	124.1	-179.2	0	0	0	0	0	107.9	K243 A247	K243-A245 PolarHBondContact O-N 2.86Å; A245-A247 PolarHBondContact O-N 2.72Å
246	L	54.2	Low	61.8	Low	99 Å²	99	88.4 Å²	88.4	52%	0.518	51%	0.509	S	S	.	.			trans	-60.9	98.9	167.3	-63.2	169.1	0	0	0	104.6	S244 N297	S244-L246 PolarHBondContact O-N 3.15Å; S244-L246 VanDerWaalsContact O-N 3.1Å; L246-N297 HydrophobicContact CD2-CB 4.28Å
247	A	65.9	Low	64.8	Low	15 Å²	15	84.7 Å²	84.7	12%	0.124	49%	0.488	C	S	.	.			trans	-127	116.1	-172.4	0	0	0	0	0	107.3	A245 T296	A245-A247 PolarHBondContact O-N 2.72Å; A247-T296 PolarHBondContact O-OG1 2.84Å
248	L	89.6	Confident	67.7	Low	0 Å²	0	80 Å²	80	0%	0	47%	0.468	C	S	.	.			trans	-70.7	165.5	151	61.9	79.7	0	0	0	109.1	C250 C292 D293 E303 V305 I346 N426	L248-C250 WeakPolarHBondContact CD1-SG 3.28Å; L248-C292 HydrophobicContact CD1-CB 4.31Å; L248-D293 WeakPolarHBondContact CA-O 3.32Å; L248-D293 WeakPolarHBondContact CB-O 3.3Å; L248-E303 HydrophobicContact CD2-CB 4.32Å; L248-E303 HydrophobicContact CD2-CG 3.88Å; L248-V305 HydrophobicContact CD2-CG2 3.82Å; L248-I346 HydrophobicContact CD2-CG1 4.35Å; L248-N426 PolarHBondContact O-OD1 2.82Å
249	N	94	Very high	70.4	Confident	17 Å²	17	75.2 Å²	75.2	9%	0.091	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	147.3	170.6	-58.8	-30.2	0	0	0	109.7	Y251 C292 D293 N294 Q425	N249-Y251 HydrophobicContact CB-CD2 4.45Å; N249-Y251 HydrophobicContact CB-CE2 3.55Å; N249-Y251 WeakPolarHBondContact CB-OH 3.42Å; N249-Y251 PolarHBondContact ND2-OH 2.92Å; N249-C292 CarbonylContact O-C 3.59Å; N249-C292 WeakPolarHBondContact O-CA 3.39Å; N249-C292 VanDerWaalsContact O-CB 3.22Å; N249-C292 WeakPolarHBondContact O-CB 3.44Å; N249-D293 WeakPolarHBondContact CB-OD1 3.24Å; N249-D293 PolarHBondContact N-O 2.87Å; N249-D293 PolarHBondContact O-N 2.97Å; N249-N294 WeakPolarHBondContact ND2-CB 3.32Å; N249-N294 PolarHBondContact ND2-ND2 2.99Å; N249-Q425 CarbonylContact C-O 3.52Å; N249-Q425 WeakPolarHBondContact CA-O 3.42Å; N249-Q425 HydrophobicContact CB-CB 3.86Å; N249-Q425 VanDerWaalsContact CG-OE1 3.3Å; N249-Q425 PolarHBondContact ND2-OE1 2.91Å
250	C	95.7	Very high	73.3	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	138.1	169.7	-70.6	0	0	0	0	111	L248 V290 Y291 C292 F412 Q425 N426 L427	L248-C250 WeakPolarHBondContact CD1-SG 3.28Å; C250-V290 HydrophobicContact CB-CG1 4.41Å; C250-Y291 CarbonylContact C-O 3.53Å; C250-Y291 VanDerWaalsContact CA-O 3.24Å; C250-Y291 WeakPolarHBondContact CA-O 3.15Å; C250-C292 HydrophobicContact CB-CB 4.18Å; C250-C292 WeakPolarHBondContact CB-SG 3.32Å; C250-C292 WeakPolarHBondContact SG-CB 3.16Å; C250-C292 CovalentContact SG-SG 2.05Å; C250-C292 PolarHBondContact SG-SG 3.44Å; C250-F412 HydrophobicContact CB-CB 3.88Å; C250-Q425 PolarHBondContact N-O 2.89Å; C250-Q425 CarbonylContact O-C 3.48Å; C250-Q425 VanDerWaalsContact O-O 3.09Å; C250-N426 CarbonylContact O-C 3.51Å; C250-L427 HydrophobicContact CB-CB 4.26Å; C250-L427 PolarHBondContact O-N 2.98Å
251	Y	96	Very high	76.2	Confident	14 Å²	14	64.8 Å²	64.8	6%	0.055	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	161.9	-176.8	-45	-98	0	0	0	110.8	N249 G253 S254 G257 V259 Y291 Q425	N249-Y251 HydrophobicContact CB-CD2 4.45Å; N249-Y251 HydrophobicContact CB-CE2 3.55Å; N249-Y251 WeakPolarHBondContact CB-OH 3.42Å; N249-Y251 PolarHBondContact ND2-OH 2.92Å; Y251-G253 PolarHBondContact O-N 3.43Å; Y251-S254 WeakPolarHBondContact CB-O 3.29Å; Y251-G257 VanDerWaalsContact CD1-O 3.29Å; Y251-G257 WeakPolarHBondContact CD1-O 3.45Å; Y251-V259 HydrophobicContact CD1-CG1 3.61Å; Y251-V259 HydrophobicContact CE1-CG1 4.07Å; Y251-V259 HydrophobicContact CG-CG1 4.5Å; Y251-Y291 AromaticContact CD2-CD1 3.88Å; Y251-Y291 HydrophobicContact CD2-CD1 3.88Å; Y251-Y291 HydrophobicContact CD2-CE1 4.45Å; Y251-Y291 HydrophobicContact CE2-CD1 4.42Å; Y251-Y291 PolarHBondContact N-O 2.75Å; Y251-Y291 PolarHBondContact O-N 3.08Å; Y251-Q425 HydrophobicContact CE1-CB 3.74Å; Y251-Q425 HydrophobicContact CE1-CG 4.08Å; Y251-Q425 PolarHBondContact OH-OE1 2.97Å
252	F	94.9	Very high	79.1	Confident	68 Å²	68	62.6 Å²	62.6	30%	0.298	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	122.3	170.8	-175.6	-104.6	0	0	0	111.1	S254 S258 K261 I288 P289 L427	F252-S254 VanDerWaalsContact C-N 3.33Å; F252-S254 PolarHBondContact O-N 2.75Å; F252-S258 WeakPolarHBondContact CB-O 3.39Å; F252-S258 PolarHBondContact N-O 3.09Å; F252-K261 HydrophobicContact CE2-CD 4.42Å; F252-I288 HydrophobicContact CD2-CB 4.38Å; F252-I288 HydrophobicContact CE2-CB 4.01Å; F252-I288 HydrophobicContact CE2-CG2 4.02Å; F252-P289 HydrophobicContact CE2-CG 4.18Å; F252-P289 HydrophobicContact CZ-CG 4.27Å; F252-L427 HydrophobicContact CB-CD1 3.88Å; F252-L427 HydrophobicContact CB-CD2 4.37Å
253	G	91.5	Very high	81.6	Confident	27 Å²	27	56.9 Å²	56.9	28%	0.278	35%	0.35	S	S	.	.	S	Bend	trans	81.6	-61.7	171.7	0	0	0	0	0	115.3	Y251 P289	Y251-G253 PolarHBondContact O-N 3.43Å; G253-P289 PolarHBondContact N-O 2.89Å
254	S	92.8	Very high	84.3	Confident	72 Å²	72	51.7 Å²	51.7	50%	0.503	33%	0.334	S	S	.	.	S	Bend	trans	-147.9	169.1	-170.3	61.2	0	0	0	0	112.7	Y251 F252 G256 G257 Y291	Y251-S254 WeakPolarHBondContact CB-O 3.29Å; F252-S254 VanDerWaalsContact C-N 3.33Å; F252-S254 PolarHBondContact O-N 2.75Å; S254-G256 PolarHBondContact O-N 2.79Å; S254-G257 PolarHBondContact O-N 2.79Å; S254-Y291 VanDerWaalsContact C-CG 3.48Å
255	S	93.6	Very high	86.6	Confident	66 Å²	66	46.7 Å²	46.7	46%	0.462	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	132.2	172.7	-168.1	0	0	0	0	110.8	G257 Y291 D293	S255-G257 PolarHBondContact O-N 2.94Å; S255-Y291 VanDerWaalsContact CA-CD1 3.44Å; S255-Y291 VanDerWaalsContact N-CD1 3.25Å; S255-D293 PolarHBondContact OG-OD2 3.4Å; S255-D293 VanDerWaalsContact OG-OD2 3.12Å
256	G	90.4	Very high	88.6	Confident	61 Å²	61	50.1 Å²	50.1	63%	0.629	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	12.2	-176.6	0	0	0	0	0	115.2	S254	S254-G256 PolarHBondContact O-N 2.79Å
257	G	93	Very high	90.4	Very high	23 Å²	23	48.7 Å²	48.7	24%	0.237	30%	0.302	C	S	.	.			trans	-65	-178.3	172.8	0	0	0	0	0	113	Y251 S254 S255 V259	Y251-G257 VanDerWaalsContact CD1-O 3.29Å; Y251-G257 WeakPolarHBondContact CD1-O 3.45Å; S254-G257 PolarHBondContact O-N 2.79Å; S255-G257 PolarHBondContact O-N 2.94Å; G257-V259 PolarHBondContact O-N 3.01Å
258	S	92.5	Very high	91.6	Very high	65 Å²	65	48 Å²	48	46%	0.455	30%	0.296	S	S	.	.			trans	-63.3	137.6	175.1	-169.8	0	0	0	0	110.6	F252 E260	F252-S258 WeakPolarHBondContact CB-O 3.39Å; F252-S258 PolarHBondContact N-O 3.09Å; S258-E260 VanDerWaalsContact C-N 3.33Å; S258-E260 WeakPolarHBondContact CB-O 3.26Å; S258-E260 PolarHBondContact OG-N 3.14Å; S258-E260 VanDerWaalsContact OG-N 3.13Å; S258-E260 PolarHBondContact OG-O 2.82Å
259	V	93.1	Very high	91.8	Very high	35 Å²	35	48 Å²	48	21%	0.212	30%	0.296	C	S	.	.	S	Bend	trans	-91	-5.2	168.5	-58.9	0	0	0	0	111.7	Y251 G257 Q425 L427 K428	Y251-V259 HydrophobicContact CD1-CG1 3.61Å; Y251-V259 HydrophobicContact CE1-CG1 4.07Å; Y251-V259 HydrophobicContact CG-CG1 4.5Å; G257-V259 PolarHBondContact O-N 3.01Å; V259-Q425 HydrophobicContact CG1-CB 4.16Å; V259-L427 CarbonylContact O-C 3.51Å; V259-L427 VanDerWaalsContact O-CA 3.3Å; V259-L427 WeakPolarHBondContact O-CA 3.44Å; V259-K428 PolarHBondContact O-N 2.82Å
260	E	92.2	Very high	91.8	Very high	75 Å²	75	47.2 Å²	47.2	35%	0.35	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	127.7	178.3	-54.7	-60.2	173	0	0	109.5	S258 K428 H430	S258-E260 VanDerWaalsContact C-N 3.33Å; S258-E260 WeakPolarHBondContact CB-O 3.26Å; S258-E260 PolarHBondContact OG-N 3.14Å; S258-E260 VanDerWaalsContact OG-N 3.13Å; S258-E260 PolarHBondContact OG-O 2.82Å; E260-K428 IonicContact OE1-NZ 3.03Å; E260-K428 WeakPolarHBondContact OE2-CB 3.46Å; E260-H430 IonicContact OE2-CD2 2.69Å; E260-H430 PolarHBondContact OE2-CD2 3.42Å; E260-H430 IonicContact OE2-CE1 3.82Å; E260-H430 IonicContact OE2-NE2 3.33Å; E260-H430 PolarHBondContact OE2-NE2 3.47Å
261	K	92.3	Very high	91.6	Very high	75 Å²	75	47.7 Å²	47.7	33%	0.326	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	124.9	171.6	-179.1	60.1	177.6	166	0	108.6	F252 L427 K428 Y429 H430	F252-K261 HydrophobicContact CE2-CD 4.42Å; K261-L427 HydrophobicContact CB-CD1 4.23Å; K261-K428 PolarHBondContact N-O 2.44Å; K261-Y429 HydrophobicContact CB-CD2 4.03Å; K261-Y429 HydrophobicContact CB-CE2 4.29Å; K261-Y429 HydrophobicContact CG-CD2 3.76Å; K261-Y429 HydrophobicContact CG-CE2 3.51Å; K261-Y429 CarbonylContact O-C 3.55Å; K261-Y429 WeakPolarHBondContact O-CA 3.35Å; K261-H430 PolarHBondContact O-N 3.27Å
262	S	88.4	Confident	91.3	Very high	67 Å²	67	48.8 Å²	48.8	47%	0.469	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	148.6	179.8	-46.5	0	0	0	0	111.6	H430	S262-H430 WeakPolarHBondContact CA-O 2.98Å
263	E	86.7	Confident	90.9	Very high	53 Å²	53	49.1 Å²	49.1	25%	0.248	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	129.7	169.8	-172.8	170.7	-177.9	0	0	109.8	I286 Y429 H430 I431 T432	E263-I286 WeakPolarHBondContact OE2-CD1 2.89Å; E263-Y429 HydrophobicContact CB-CE1 3.98Å; E263-Y429 PolarHBondContact OE2-OH 2.87Å; E263-H430 PolarHBondContact N-O 3.32Å; E263-I431 WeakPolarHBondContact O-CA 3.19Å; E263-T432 PolarHBondContact O-N 2.78Å; E263-T432 VanDerWaalsContact O-N 3.09Å
264	V	89.3	Confident	90.9	Very high	87 Å²	87	48.3 Å²	48.3	53%	0.527	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	114.9	175.3	-173.7	0	0	0	0	107.7	Q266 T432	V264-Q266 PolarHBondContact O-N 2.84Å; V264-T432 WeakPolarHBondContact CG2-OG1 3.3Å
265	I	87.1	Confident	90.8	Very high	3 Å²	3	51.7 Å²	51.7	2%	0.015	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-64.2	121.6	172.3	-66.1	176	0	0	0	107.7	F268 W281 I431 T432 L434	I265-F268 HydrophobicContact CG2-CD1 3.77Å; I265-F268 HydrophobicContact CG2-CE1 3.86Å; I265-W281 HydrophobicContact CB-CH2 4.4Å; I265-W281 HydrophobicContact CB-CZ2 4.46Å; I265-W281 HydrophobicContact CD1-CH2 4.13Å; I265-W281 HydrophobicContact CD1-CZ3 4.07Å; I265-W281 HydrophobicContact CG1-CH2 3.8Å; I265-W281 HydrophobicContact CG1-CZ2 4.34Å; I265-W281 HydrophobicContact CG1-CZ3 4.26Å; I265-W281 HydrophobicContact CG2-CD2 4.45Å; I265-W281 HydrophobicContact CG2-CH2 3.97Å; I265-W281 HydrophobicContact CG2-CZ2 3.72Å; I265-W281 HydrophobicContact CG2-CZ3 4.45Å; I265-I431 HydrophobicContact CD1-CB 4.05Å; I265-I431 HydrophobicContact CD1-CD1 3.96Å; I265-I431 HydrophobicContact CD1-CG1 4.33Å; I265-I431 HydrophobicContact CG1-CB 4.45Å; I265-T432 WeakPolarHBondContact CB-O 3.48Å; I265-T432 PolarHBondContact N-O 3.01Å; I265-L434 HydrophobicContact CD1-CD2 3.63Å; I265-L434 HydrophobicContact CD1-CG 4.29Å
266	Q	88.6	Confident	90.7	Very high	130 Å²	130	53 Å²	53	61%	0.607	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-63.6	146.3	174.5	-65.2	-57.9	-58.4	0	0	109.8	V264 F268	V264-Q266 PolarHBondContact O-N 2.84Å; Q266-F268 PolarHBondContact O-N 3.29Å
267	P	90.3	Very high	90.7	Very high	69 Å²	69	52.2 Å²	52.2	45%	0.448	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-50.5	128	176.8	-25.7	33.8	0	0	0	110.7	N436	P267-N436 HydrophobicContact CB-CB 4.12Å; P267-N436 HydrophobicContact CG-CB 4Å
268	F	92.7	Very high	90.5	Very high	1 Å²	1	54.5 Å²	54.5	0%	0.004	32%	0.318	C	S	.	.			trans	-134.7	166.9	176.2	77	-96.4	0	0	0	109.8	I265 Q266 I280 W281 V390 I437 R438 Y576	I265-F268 HydrophobicContact CG2-CD1 3.77Å; I265-F268 HydrophobicContact CG2-CE1 3.86Å; Q266-F268 PolarHBondContact O-N 3.29Å; F268-I280 HydrophobicContact CE2-CD1 4.08Å; F268-I280 HydrophobicContact CE2-CG1 4.28Å; F268-W281 VanDerWaalsContact CB-CD1 3.41Å; F268-W281 HydrophobicContact CB-CG 4.28Å; F268-W281 HydrophobicContact CD1-CB 4.03Å; F268-W281 AromaticContact CD1-CD1 3.44Å; F268-W281 VanDerWaalsContact CD1-CD1 3.44Å; F268-W281 HydrophobicContact CD1-CD2 4.08Å; F268-W281 AromaticContact CD1-CG 3.6Å; F268-W281 HydrophobicContact CD1-CG 3.6Å; F268-W281 AromaticContact CD1-NE1 3.8Å; F268-W281 HydrophobicContact CD2-CB 3.6Å; F268-W281 AromaticContact CD2-CD1 3.87Å; F268-W281 AromaticContact CD2-CG 3.95Å; F268-W281 HydrophobicContact CD2-CG 3.95Å; F268-W281 HydrophobicContact CE1-CB 3.9Å; F268-W281 HydrophobicContact CE1-CD2 4.09Å; F268-W281 AromaticContact CE1-CG 3.77Å; F268-W281 HydrophobicContact CE1-CG 3.77Å; F268-W281 HydrophobicContact CE2-CB 3.48Å; F268-W281 VanDerWaalsContact CE2-CB 3.48Å; F268-W281 HydrophobicContact CE2-CG 4.14Å; F268-W281 HydrophobicContact CG-CB 3.88Å; F268-W281 AromaticContact CG-CD1 3.3Å; F268-W281 AromaticContact CG-CG 3.68Å; F268-W281 HydrophobicContact CG-CG 3.68Å; F268-W281 HydrophobicContact CZ-CB 3.63Å; F268-W281 HydrophobicContact CZ-CG 4.05Å; F268-V390 HydrophobicContact CE1-CG2 4.11Å; F268-V390 HydrophobicContact CZ-CB 3.98Å; F268-V390 HydrophobicContact CZ-CG1 4.26Å; F268-V390 HydrophobicContact CZ-CG2 3.82Å; F268-I437 HydrophobicContact CD1-CG1 4.05Å; F268-I437 HydrophobicContact CD2-CG2 4.29Å; F268-I437 HydrophobicContact CE1-CD1 3.6Å; F268-I437 HydrophobicContact CE1-CG1 3.47Å; F268-I437 VanDerWaalsContact CE1-CG1 3.47Å; F268-I437 HydrophobicContact CE2-CD1 4.27Å; F268-I437 HydrophobicContact CE2-CG1 4.17Å; F268-I437 HydrophobicContact CE2-CG2 3.82Å; F268-I437 HydrophobicContact CZ-CB 4.42Å; F268-I437 HydrophobicContact CZ-CD1 3.37Å; F268-I437 HydrophobicContact CZ-CG1 3.53Å; F268-I437 HydrophobicContact CZ-CG2 4Å; F268-I437 WeakPolarHBondContact O-CA 3.47Å; F268-R438 PolarHBondContact O-N 2.86Å; F268-R438 VanDerWaalsContact O-N 3.13Å; F268-Y576 CarbonylContact C-O 3.55Å; F268-Y576 WeakPolarHBondContact CA-O 3.35Å; F268-Y576 WeakPolarHBondContact CB-O 3.41Å
269	A	93.4	Very high	90.5	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	146.2	-174.6	0	0	0	0	0	112.3	R438 L440 Y576	A269-R438 CarbonylContact C-O 3.43Å; A269-R438 WeakPolarHBondContact CA-O 3.01Å; A269-R438 HydrophobicContact CB-CG 3.6Å; A269-L440 HydrophobicContact CB-CD1 3.59Å; A269-L440 HydrophobicContact CB-CD2 3.94Å; A269-L440 HydrophobicContact CB-CG 3.64Å; A269-Y576 PolarHBondContact N-O 3.1Å; A269-Y576 WeakPolarHBondContact O-CB 3.28Å
270	V	93.7	Very high	90.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	120.3	172.9	-170.9	0	0	0	0	107.9	A274 I280 Y320 I392 M395 I437 R438 V439 L440	V270-A274 HydrophobicContact CG1-CB 3.98Å; V270-I280 HydrophobicContact CG1-CD1 4.23Å; V270-I280 HydrophobicContact CG1-CG2 4.22Å; V270-I280 HydrophobicContact CG2-CD1 3.75Å; V270-Y320 HydrophobicContact CG2-CE1 4.06Å; V270-I392 HydrophobicContact CG1-CD1 3.73Å; V270-M395 HydrophobicContact CG1-CE 4.5Å; V270-M395 HydrophobicContact CG1-SD 4.22Å; V270-I437 HydrophobicContact CG2-CG2 3.64Å; V270-R438 PolarHBondContact N-O 3.22Å; V270-V439 HydrophobicContact CB-CG1 4.46Å; V270-V439 HydrophobicContact CB-CG2 4.36Å; V270-V439 HydrophobicContact CG2-CG2 4.36Å; V270-L440 PolarHBondContact O-N 3.37Å
271	P	92.1	Very high	90.6	Very high	10 Å²	10	51 Å²	51	7%	0.065	29%	0.29	C	S	.	.			trans	-72.8	147.4	179.8	30.9	-35	0	0	0	111.3	N273 A274 C442 Y576	P271-N273 WeakPolarHBondContact CB-OD1 3.22Å; P271-N273 PolarHBondContact O-N 3.25Å; P271-A274 HydrophobicContact CG-CB 4.11Å; P271-A274 VanDerWaalsContact O-CB 3.29Å; P271-A274 WeakPolarHBondContact O-CB 3.4Å; P271-A274 PolarHBondContact O-N 3.15Å; P271-C442 WeakPolarHBondContact CA-O 3.48Å; P271-Y576 HydrophobicContact CB-CD1 4.11Å; P271-Y576 HydrophobicContact CB-CD2 3.97Å; P271-Y576 HydrophobicContact CB-CE1 3.74Å; P271-Y576 HydrophobicContact CB-CE2 3.61Å; P271-Y576 HydrophobicContact CB-CG 4.22Å; P271-Y576 VanDerWaalsContact CB-CZ 3.46Å; P271-Y576 HydrophobicContact CG-CD2 3.88Å; P271-Y576 HydrophobicContact CG-CE2 3.59Å
272	G	88.4	Confident	90.6	Very high	37 Å²	37	47.8 Å²	47.8	38%	0.381	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-10	-176.6	0	0	0	0	0	114.8	L440 C442	G272-L440 WeakPolarHBondContact CA-O 3.26Å; G272-L440 PolarHBondContact N-O 2.97Å; G272-C442 PolarHBondContact N-O 3.11Å
273	N	86.9	Confident	90.9	Very high	76 Å²	76	44.8 Å²	44.8	41%	0.406	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	6.3	175.8	72.1	-16.7	0	0	0	114.1	P271 S443	P271-N273 WeakPolarHBondContact CB-OD1 3.22Å; P271-N273 PolarHBondContact O-N 3.25Å; N273-S443 WeakPolarHBondContact ND2-CB 3.24Å; N273-S443 VanDerWaalsContact OD1-CB 3.27Å; N273-S443 WeakPolarHBondContact OD1-CB 3.48Å
274	A	91	Very high	91.1	Very high	10 Å²	10	45 Å²	45	8%	0.083	26%	0.258	C	S	.	.			trans	-61.5	145	177.2	0	0	0	0	0	111.6	V270 P271 I280 I392 M395	V270-A274 HydrophobicContact CG1-CB 3.98Å; P271-A274 HydrophobicContact CG-CB 4.11Å; P271-A274 VanDerWaalsContact O-CB 3.29Å; P271-A274 WeakPolarHBondContact O-CB 3.4Å; P271-A274 PolarHBondContact O-N 3.15Å; A274-I280 HydrophobicContact CB-CG2 3.9Å; A274-I392 HydrophobicContact CB-CD1 3.85Å; A274-I392 HydrophobicContact CB-CG2 4.44Å; A274-M395 HydrophobicContact CB-SD 3.93Å
275	K	90.5	Very high	91.1	Very high	142 Å²	142	42.1 Å²	42.1	62%	0.617	24%	0.24	S	C	*	.			trans	-124.3	146.8	-179.2	-62.1	175.2	-174.5	174.5	0	110.8	G277 D278 I392	K275-G277 PolarHBondContact O-N 2.65Å; K275-D278 PolarHBondContact N-OD2 2.64Å; K275-D278 VanDerWaalsContact O-CB 3.26Å; K275-D278 WeakPolarHBondContact O-CB 3.49Å; K275-D278 PolarHBondContact O-N 2.89Å; K275-I392 VanDerWaalsContact C-CG2 3.42Å; K275-I392 WeakPolarHBondContact O-CG2 3.46Å
276	P	91.8	Very high	91.2	Very high	93 Å²	93	42.7 Å²	42.7	60%	0.604	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-44.6	123.5	174.2	-32	37.6	0	0	0	113.2	I392 R393	P276-I392 CarbonylContact C-O 3.51Å; P276-I392 WeakPolarHBondContact CA-O 3.36Å; P276-R393 WeakPolarHBondContact CB-O 3.39Å
277	G	90	Very high	91.2	Very high	46 Å²	46	40.5 Å²	40.5	47%	0.474	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.9	-16	-176.8	0	0	0	0	0	115.2	K275 I392	K275-G277 PolarHBondContact O-N 2.65Å; G277-I392 PolarHBondContact N-O 3.08Å
278	D	90	Very high	91.3	Very high	71 Å²	71	37.5 Å²	37.5	38%	0.38	21%	0.211	S	C	.	.			trans	-64.1	136.2	175.1	-69.6	-16.4	0	0	0	110.3	K275 I280 K391 I392	K275-D278 PolarHBondContact N-OD2 2.64Å; K275-D278 VanDerWaalsContact O-CB 3.26Å; K275-D278 WeakPolarHBondContact O-CB 3.49Å; K275-D278 PolarHBondContact O-N 2.89Å; D278-I280 HydrophobicContact CB-CG2 4.47Å; D278-I280 PolarHBondContact O-N 3.11Å; D278-K391 CarbonylContact O-C 3.43Å; D278-K391 WeakPolarHBondContact O-CA 3.25Å; D278-I392 HydrophobicContact CB-CG2 4.16Å; D278-I392 PolarHBondContact O-N 2.96Å
279	K	91.4	Very high	91.3	Very high	71 Å²	71	39.5 Å²	39.5	31%	0.309	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	105.8	164.5	-70.1	-170.8	-176.1	-170.6	0	107.7	E282 T325 D330 Y389 V390 K391	K279-E282 IonicContact NZ-OE2 3.78Å; K279-E282 PolarHBondContact NZ-OE2 3.03Å; K279-T325 PolarHBondContact NZ-OG1 3.33Å; K279-D330 WeakPolarHBondContact CE-OD2 3.44Å; K279-D330 IonicContact NZ-OD1 2.91Å; K279-D330 PolarHBondContact NZ-OD1 3.19Å; K279-D330 IonicContact NZ-OD2 2.8Å; K279-D330 PolarHBondContact NZ-OD2 2.81Å; K279-Y389 HydrophobicContact CD-CD1 4.35Å; K279-Y389 HydrophobicContact CD-CD2 4.14Å; K279-Y389 HydrophobicContact CD-CG 3.93Å; K279-Y389 HydrophobicContact CG-CD2 4.12Å; K279-Y389 HydrophobicContact CG-CG 4.37Å; K279-V390 CarbonylContact C-O 3.42Å; K279-V390 WeakPolarHBondContact CA-O 3.36Å; K279-K391 HydrophobicContact CB-CG 4.44Å; K279-K391 HydrophobicContact CG-CD 4.37Å; K279-K391 HydrophobicContact CG-CG 3.71Å
280	I	93	Very high	91.5	Very high	10 Å²	10	39.5 Å²	39.5	5%	0.051	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-17.3	-177.2	51.9	167.8	0	0	0	112.5	F268 V270 A274 D278 Y320 V390 I392	F268-I280 HydrophobicContact CE2-CD1 4.08Å; F268-I280 HydrophobicContact CE2-CG1 4.28Å; V270-I280 HydrophobicContact CG1-CD1 4.23Å; V270-I280 HydrophobicContact CG1-CG2 4.22Å; V270-I280 HydrophobicContact CG2-CD1 3.75Å; A274-I280 HydrophobicContact CB-CG2 3.9Å; D278-I280 HydrophobicContact CB-CG2 4.47Å; D278-I280 PolarHBondContact O-N 3.11Å; I280-Y320 HydrophobicContact CD1-CD1 3.94Å; I280-Y320 HydrophobicContact CD1-CE1 3.93Å; I280-V390 HydrophobicContact CD1-CG1 3.99Å; I280-V390 HydrophobicContact CG1-CB 4.18Å; I280-V390 HydrophobicContact CG1-CG1 4.13Å; I280-V390 WeakPolarHBondContact CG1-O 3.42Å; I280-V390 PolarHBondContact N-O 2.96Å; I280-I392 HydrophobicContact CD1-CB 4.25Å; I280-I392 HydrophobicContact CG2-CB 3.96Å; I280-I392 HydrophobicContact CG2-CG2 4.08Å
281	W	94.6	Very high	91.6	Very high	19 Å²	19	41 Å²	41	7%	0.072	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	144.6	174.7	179.1	92.3	0	0	0	110.7	I265 F268 L388 Y389 V390 N575	I265-W281 HydrophobicContact CB-CH2 4.4Å; I265-W281 HydrophobicContact CB-CZ2 4.46Å; I265-W281 HydrophobicContact CD1-CH2 4.13Å; I265-W281 HydrophobicContact CD1-CZ3 4.07Å; I265-W281 HydrophobicContact CG1-CH2 3.8Å; I265-W281 HydrophobicContact CG1-CZ2 4.34Å; I265-W281 HydrophobicContact CG1-CZ3 4.26Å; I265-W281 HydrophobicContact CG2-CD2 4.45Å; I265-W281 HydrophobicContact CG2-CH2 3.97Å; I265-W281 HydrophobicContact CG2-CZ2 3.72Å; I265-W281 HydrophobicContact CG2-CZ3 4.45Å; F268-W281 VanDerWaalsContact CB-CD1 3.41Å; F268-W281 HydrophobicContact CB-CG 4.28Å; F268-W281 HydrophobicContact CD1-CB 4.03Å; F268-W281 AromaticContact CD1-CD1 3.44Å; F268-W281 VanDerWaalsContact CD1-CD1 3.44Å; F268-W281 HydrophobicContact CD1-CD2 4.08Å; F268-W281 AromaticContact CD1-CG 3.6Å; F268-W281 HydrophobicContact CD1-CG 3.6Å; F268-W281 AromaticContact CD1-NE1 3.8Å; F268-W281 HydrophobicContact CD2-CB 3.6Å; F268-W281 AromaticContact CD2-CD1 3.87Å; F268-W281 AromaticContact CD2-CG 3.95Å; F268-W281 HydrophobicContact CD2-CG 3.95Å; F268-W281 HydrophobicContact CE1-CB 3.9Å; F268-W281 HydrophobicContact CE1-CD2 4.09Å; F268-W281 AromaticContact CE1-CG 3.77Å; F268-W281 HydrophobicContact CE1-CG 3.77Å; F268-W281 HydrophobicContact CE2-CB 3.48Å; F268-W281 VanDerWaalsContact CE2-CB 3.48Å; F268-W281 HydrophobicContact CE2-CG 4.14Å; F268-W281 HydrophobicContact CG-CB 3.88Å; F268-W281 AromaticContact CG-CD1 3.3Å; F268-W281 AromaticContact CG-CG 3.68Å; F268-W281 HydrophobicContact CG-CG 3.68Å; F268-W281 HydrophobicContact CZ-CB 3.63Å; F268-W281 HydrophobicContact CZ-CG 4.05Å; W281-L388 HydrophobicContact CH2-CB 4.3Å; W281-L388 HydrophobicContact CZ3-CB 3.84Å; W281-Y389 CarbonylContact O-C 3.6Å; W281-Y389 WeakPolarHBondContact O-CA 3.39Å; W281-Y389 VanDerWaalsContact O-CB 3.3Å; W281-Y389 WeakPolarHBondContact O-CB 3.43Å; W281-V390 HydrophobicContact CB-CB 4.39Å; W281-V390 HydrophobicContact CE3-CG2 3.93Å; W281-V390 PolarHBondContact N-O 2.94Å; W281-V390 PolarHBondContact O-N 2.79Å; W281-N575 WeakPolarHBondContact CA-OD1 3.23Å
282	E	93.6	Very high	91.8	Very high	8 Å²	8	40.5 Å²	40.5	4%	0.037	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	143.1	168.2	-172	172.8	75.1	0	0	109.8	K279 T325 R387 L388 Y532 K573 N575	K279-E282 IonicContact NZ-OE2 3.78Å; K279-E282 PolarHBondContact NZ-OE2 3.03Å; E282-T325 PolarHBondContact OE2-OG1 2.84Å; E282-R387 HydrophobicContact CG-CB 3.97Å; E282-R387 HydrophobicContact CG-CG 4.48Å; E282-R387 IonicContact OE1-NH1 3.92Å; E282-R387 PolarHBondContact OE1-NH1 3.28Å; E282-R387 IonicContact OE2-NH1 2.77Å; E282-R387 PolarHBondContact OE2-NH1 3.33Å; E282-L388 CarbonylContact C-O 3.56Å; E282-L388 VanDerWaalsContact CA-O 3.23Å; E282-L388 WeakPolarHBondContact CA-O 3.31Å; E282-L388 WeakPolarHBondContact CG-O 3.34Å; E282-Y532 HydrophobicContact CB-CE2 4.46Å; E282-Y532 WeakPolarHBondContact O-CE2 3.49Å; E282-K573 IonicContact OE1-NZ 2.64Å; E282-K573 PolarHBondContact OE1-NZ 3.04Å; E282-K573 IonicContact OE2-NZ 3.46Å; E282-N575 PolarHBondContact N-OD1 3.33Å; E282-N575 PolarHBondContact O-ND2 2.75Å
283	S	93.5	Very high	92.1	Very high	5 Å²	5	39.8 Å²	39.8	4%	0.035	21%	0.214	C	C	.	.			trans	-74	171.4	177	73.1	0	0	0	0	112.8	I286 R387 L388	S283-I286 WeakPolarHBondContact OG-CD1 3.46Å; S283-R387 WeakPolarHBondContact OG-CA 3.12Å; S283-L388 PolarHBondContact N-O 2.7Å; S283-L388 PolarHBondContact OG-N 2.88Å
284	D	92.3	Very high	92.4	Very high	58 Å²	58	38.9 Å²	38.9	31%	0.31	21%	0.21	S	C	.	.			trans	-59.2	163.9	159.1	-70.6	-11.1	0	0	0	111.4	I286 R387 Y532	D284-I286 PolarHBondContact O-N 2.79Å; D284-I286 VanDerWaalsContact O-N 3.14Å; D284-R387 WeakPolarHBondContact O-CG 3.39Å; D284-Y532 WeakPolarHBondContact OD1-CB 3.36Å; D284-Y532 WeakPolarHBondContact OD1-CD2 3.43Å; D284-Y532 PolarHBondContact OD1-N 2.94Å
285	D	88.4	Confident	92.4	Very high	26 Å²	26	38.4 Å²	38.4	14%	0.139	21%	0.206	C	C	.	.			trans	-64	110.9	172.5	-154.1	58.3	0	0	0	111.3	K287 R385 R387 N530	D285-K287 WeakPolarHBondContact OD2-CE 3.41Å; D285-R385 VanDerWaalsContact CG-NE 3.27Å; D285-R385 IonicContact OD1-CZ 3.41Å; D285-R385 VanDerWaalsContact OD1-CZ 3.3Å; D285-R385 IonicContact OD1-NE 3.77Å; D285-R385 PolarHBondContact OD1-NE 3.27Å; D285-R385 IonicContact OD1-NH2 2.7Å; D285-R385 PolarHBondContact OD1-NH2 3.28Å; D285-R385 IonicContact OD2-CZ 3.95Å; D285-R385 IonicContact OD2-NE 3.17Å; D285-R385 PolarHBondContact OD2-NE 3.18Å; D285-R385 IonicContact OD2-NH2 2.84Å; D285-R385 PolarHBondContact OD2-NH2 2.95Å; D285-R387 IonicContact OD1-NE 2.99Å; D285-N530 HydrophobicContact CB-CB 4.01Å; D285-N530 PolarHBondContact N-O 2.78Å
286	I	90.1	Very high	92.1	Very high	14 Å²	14	33.8 Å²	33.8	7%	0.072	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.3	179.3	-63.3	152.8	0	0	0	108.2	E263 S283 D284 I288 R385 M386 L388 Y429	E263-I286 WeakPolarHBondContact OE2-CD1 2.89Å; S283-I286 WeakPolarHBondContact OG-CD1 3.46Å; D284-I286 PolarHBondContact O-N 2.79Å; D284-I286 VanDerWaalsContact O-N 3.14Å; I286-I288 HydrophobicContact CG2-CG2 3.82Å; I286-R385 WeakPolarHBondContact O-CA 3.4Å; I286-M386 WeakPolarHBondContact CA-O 3.32Å; I286-M386 HydrophobicContact CB-CG 4.1Å; I286-M386 WeakPolarHBondContact CB-O 3.25Å; I286-M386 HydrophobicContact CG2-CG 4.22Å; I286-M386 PolarHBondContact N-O 3.09Å; I286-M386 PolarHBondContact O-N 2.74Å; I286-L388 HydrophobicContact CD1-CD1 3.85Å; I286-L388 HydrophobicContact CD1-CG 3.67Å; I286-Y429 HydrophobicContact CD1-CE1 4.48Å; I286-Y429 HydrophobicContact CG2-CE2 4.17Å; I286-Y429 WeakPolarHBondContact CG2-OH 3.1Å
287	K	88.1	Confident	91.5	Very high	85 Å²	85	30.1 Å²	30.1	37%	0.37	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	104.7	177.2	-65	172.1	-175.1	171.8	0	108.1	D285 L383 R385 D506	D285-K287 WeakPolarHBondContact OD2-CE 3.41Å; K287-L383 HydrophobicContact CB-CD1 4.13Å; K287-L383 HydrophobicContact CB-CD2 4.08Å; K287-L383 HydrophobicContact CB-CG 4.17Å; K287-L383 HydrophobicContact CD-CD2 4.42Å; K287-L383 HydrophobicContact CG-CD2 4.35Å; K287-R385 HydrophobicContact CG-CG 4.43Å; K287-D506 IonicContact NZ-OD1 2.85Å; K287-D506 PolarHBondContact NZ-OD1 2.85Å; K287-D506 IonicContact NZ-OD2 3.23Å; K287-D506 PolarHBondContact NZ-OD2 3.4Å
288	I	91.6	Very high	90.9	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.026	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	128.9	178.6	60.6	177.9	0	0	0	111.6	F252 I286 V290 L383 A384 M386 F412 L427 Y429	F252-I288 HydrophobicContact CD2-CB 4.38Å; F252-I288 HydrophobicContact CE2-CB 4.01Å; F252-I288 HydrophobicContact CE2-CG2 4.02Å; I286-I288 HydrophobicContact CG2-CG2 3.82Å; I288-V290 HydrophobicContact CD1-CG2 4.14Å; I288-V290 HydrophobicContact CG1-CG2 3.98Å; I288-V290 PolarHBondContact O-N 3.08Å; I288-L383 WeakPolarHBondContact O-CA 3.45Å; I288-A384 HydrophobicContact CD1-CB 4.42Å; I288-A384 HydrophobicContact CG1-CB 3.83Å; I288-A384 PolarHBondContact N-O 3.23Å; I288-A384 PolarHBondContact O-N 3.07Å; I288-M386 HydrophobicContact CD1-CE 3.55Å; I288-M386 HydrophobicContact CG1-CE 4.02Å; I288-F412 HydrophobicContact CD1-CE2 3.7Å; I288-F412 HydrophobicContact CD1-CZ 4.06Å; I288-L427 HydrophobicContact CD1-CD2 4.38Å; I288-Y429 HydrophobicContact CD1-CD2 3.92Å; I288-Y429 HydrophobicContact CD1-CE2 4.33Å; I288-Y429 HydrophobicContact CG2-CD2 4.42Å; I288-Y429 HydrophobicContact CG2-CE2 3.82Å
289	P	94.1	Very high	90.6	Very high	43 Å²	43	32.2 Å²	32.2	28%	0.279	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	122.5	168.1	29.8	-33.2	0	0	0	109.1	F252 G253	F252-P289 HydrophobicContact CE2-CG 4.18Å; F252-P289 HydrophobicContact CZ-CG 4.27Å; G253-P289 PolarHBondContact N-O 2.89Å
290	V	95.9	Very high	90.4	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	122	176.4	-174.1	0	0	0	0	107.9	C250 I288 T381 F382 A384 F412 L427	C250-V290 HydrophobicContact CB-CG1 4.41Å; I288-V290 HydrophobicContact CD1-CG2 4.14Å; I288-V290 HydrophobicContact CG1-CG2 3.98Å; I288-V290 PolarHBondContact O-N 3.08Å; V290-T381 VanDerWaalsContact O-CA 3.31Å; V290-T381 WeakPolarHBondContact O-CA 3.43Å; V290-F382 HydrophobicContact CB-CD1 4.12Å; V290-F382 HydrophobicContact CB-CE1 3.67Å; V290-F382 HydrophobicContact CB-CE2 4.1Å; V290-F382 HydrophobicContact CB-CZ 3.66Å; V290-F382 HydrophobicContact CG1-CE1 3.69Å; V290-F382 HydrophobicContact CG1-CZ 3.71Å; V290-F382 HydrophobicContact CG2-CE2 4.3Å; V290-F382 HydrophobicContact CG2-CZ 4.2Å; V290-F382 PolarHBondContact N-O 3.25Å; V290-F382 WeakPolarHBondContact O-CD1 3.29Å; V290-F382 PolarHBondContact O-N 3.01Å; V290-A384 HydrophobicContact CG2-CB 3.88Å; V290-F412 HydrophobicContact CG1-CB 4.11Å; V290-F412 HydrophobicContact CG1-CD1 4.03Å; V290-F412 HydrophobicContact CG1-CD2 4.28Å; V290-F412 HydrophobicContact CG1-CG 3.87Å; V290-F412 HydrophobicContact CG2-CD1 4.23Å; V290-F412 HydrophobicContact CG2-CD2 4.15Å; V290-F412 HydrophobicContact CG2-CE1 3.94Å; V290-F412 HydrophobicContact CG2-CE2 3.9Å; V290-F412 HydrophobicContact CG2-CG 4.32Å; V290-F412 HydrophobicContact CG2-CZ 3.78Å; V290-L427 HydrophobicContact CB-CD2 4.41Å; V290-L427 HydrophobicContact CG1-CD2 4.12Å; V290-L427 HydrophobicContact CG2-CD2 3.92Å
291	Y	97.1	Very high	90.2	Very high	32 Å²	32	33.2 Å²	33.2	13%	0.125	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	127.5	173.2	175.6	-82.1	0	0	0	108.7	C250 Y251 S254 S255 D293 S379 R380 T381	C250-Y291 CarbonylContact C-O 3.53Å; C250-Y291 VanDerWaalsContact CA-O 3.24Å; C250-Y291 WeakPolarHBondContact CA-O 3.15Å; Y251-Y291 AromaticContact CD2-CD1 3.88Å; Y251-Y291 HydrophobicContact CD2-CD1 3.88Å; Y251-Y291 HydrophobicContact CD2-CE1 4.45Å; Y251-Y291 HydrophobicContact CE2-CD1 4.42Å; Y251-Y291 PolarHBondContact N-O 2.75Å; Y251-Y291 PolarHBondContact O-N 3.08Å; S254-Y291 VanDerWaalsContact C-CG 3.48Å; S255-Y291 VanDerWaalsContact CA-CD1 3.44Å; S255-Y291 VanDerWaalsContact N-CD1 3.25Å; Y291-D293 HydrophobicContact CE1-CB 3.64Å; Y291-D293 WeakPolarHBondContact CE1-OD2 3.47Å; Y291-D293 PolarHBondContact OH-OD2 3.45Å; Y291-S379 WeakPolarHBondContact OH-CB 3.38Å; Y291-S379 PolarHBondContact OH-OG 3.41Å; Y291-R380 CarbonylContact C-O 3.57Å; Y291-R380 WeakPolarHBondContact CA-O 3.28Å; Y291-T381 VanDerWaalsContact CD2-OG1 3.29Å; Y291-T381 WeakPolarHBondContact CD2-OG1 3.43Å
292	C	96.1	Very high	90.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	143	174.4	-54	0	0	0	0	112	L248 N249 C250 V305 I346 S379 R380	L248-C292 HydrophobicContact CD1-CB 4.31Å; N249-C292 CarbonylContact O-C 3.59Å; N249-C292 WeakPolarHBondContact O-CA 3.39Å; N249-C292 VanDerWaalsContact O-CB 3.22Å; N249-C292 WeakPolarHBondContact O-CB 3.44Å; C250-C292 HydrophobicContact CB-CB 4.18Å; C250-C292 WeakPolarHBondContact CB-SG 3.32Å; C250-C292 WeakPolarHBondContact SG-CB 3.16Å; C250-C292 CovalentContact SG-SG 2.05Å; C250-C292 PolarHBondContact SG-SG 3.44Å; C292-V305 HydrophobicContact CB-CG2 3.91Å; C292-I346 HydrophobicContact CB-CD1 4.34Å; C292-I346 HydrophobicContact CB-CG1 4.46Å; C292-I346 WeakPolarHBondContact O-CD1 3.45Å; C292-S379 CarbonylContact O-C 3.54Å; C292-S379 WeakPolarHBondContact O-CA 3.06Å; C292-S379 WeakPolarHBondContact O-CB 3.32Å; C292-R380 PolarHBondContact N-O 3.12Å; C292-R380 PolarHBondContact O-N 3.46Å
293	D	94.6	Very high	89.9	Confident	21 Å²	21	34 Å²	34	11%	0.112	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	-168.4	-177.9	72	0.4	0	0	0	112.3	L248 N249 S255 Y291 N295	L248-D293 WeakPolarHBondContact CA-O 3.32Å; L248-D293 WeakPolarHBondContact CB-O 3.3Å; N249-D293 WeakPolarHBondContact CB-OD1 3.24Å; N249-D293 PolarHBondContact N-O 2.87Å; N249-D293 PolarHBondContact O-N 2.97Å; S255-D293 PolarHBondContact OG-OD2 3.4Å; S255-D293 VanDerWaalsContact OG-OD2 3.12Å; Y291-D293 HydrophobicContact CE1-CB 3.64Å; Y291-D293 WeakPolarHBondContact CE1-OD2 3.47Å; Y291-D293 PolarHBondContact OH-OD2 3.45Å; D293-N295 PolarHBondContact O-N 3.26Å
294	N	92	Very high	89.8	Confident	57 Å²	57	37.4 Å²	37.4	31%	0.305	20%	0.204	S	C	.	.			trans	56.1	42.1	167.3	-170.2	39.2	0	0	0	114.9	N249 T296	N249-N294 WeakPolarHBondContact ND2-CB 3.32Å; N249-N294 PolarHBondContact ND2-ND2 2.99Å; N294-T296 VanDerWaalsContact O-CG2 3.25Å; N294-T296 WeakPolarHBondContact O-CG2 3.43Å; N294-T296 PolarHBondContact O-N 3.05Å; N294-T296 WeakPolarHBondContact OD1-CG2 3.44Å
295	N	91.3	Very high	89.8	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.19	C	C	.	.			trans	-61.3	107.4	167	171.7	5.7	0	0	0	109.3	D293 N297 E301 E303 I346 S348 K349	D293-N295 PolarHBondContact O-N 3.26Å; N295-N297 VanDerWaalsContact C-N 3.33Å; N295-N297 WeakPolarHBondContact OD1-CB 3.38Å; N295-N297 PolarHBondContact OD1-N 2.95Å; N295-E301 PolarHBondContact ND2-O 2.86Å; N295-E303 PolarHBondContact ND2-N 3.14Å; N295-E303 VanDerWaalsContact ND2-N 3.2Å; N295-I346 HydrophobicContact CB-CB 4.07Å; N295-I346 HydrophobicContact CB-CG2 3.7Å; N295-I346 PolarHBondContact ND2-O 2.98Å; N295-S348 PolarHBondContact ND2-N 2.8Å; N295-K349 WeakPolarHBondContact O-CG 3.42Å; N295-K349 PolarHBondContact O-N 2.65Å
296	T	85.3	Confident	90	Very high	44 Å²	44	34.8 Å²	34.8	27%	0.27	19%	0.189	S	C	.	.			trans	-90.6	9.7	-175	59.5	0	0	0	0	114.1	A247 N294 G298 K349	A247-T296 PolarHBondContact O-OG1 2.84Å; N294-T296 VanDerWaalsContact O-CG2 3.25Å; N294-T296 WeakPolarHBondContact O-CG2 3.43Å; N294-T296 PolarHBondContact O-N 3.05Å; N294-T296 WeakPolarHBondContact OD1-CG2 3.44Å; T296-G298 PolarHBondContact O-N 2.91Å; T296-G298 VanDerWaalsContact O-N 3.08Å; T296-K349 HydrophobicContact CG2-CD 4.06Å; T296-K349 VanDerWaalsContact CG2-NZ 3.32Å
297	N	79.5	Confident	90.1	Very high	17 Å²	17	34.1 Å²	34.1	9%	0.091	19%	0.185	C	C	.	.			trans	-54.9	116.2	-175	-170.7	-35.9	0	0	0	112.3	L246 N295 N299 F300 S348 N350	L246-N297 HydrophobicContact CD2-CB 4.28Å; N295-N297 VanDerWaalsContact C-N 3.33Å; N295-N297 WeakPolarHBondContact OD1-CB 3.38Å; N295-N297 PolarHBondContact OD1-N 2.95Å; N297-N299 PolarHBondContact O-N 2.91Å; N297-N299 WeakPolarHBondContact OD1-CB 3.11Å; N297-N299 PolarHBondContact OD1-N 3.47Å; N297-F300 PolarHBondContact O-N 3.22Å; N297-S348 PolarHBondContact O-OG 2.91Å; N297-N350 PolarHBondContact O-ND2 3.1Å
298	G	76.7	Confident	90.3	Very high	48 Å²	48	31.2 Å²	31.2	50%	0.495	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-18.2	-177.1	0	0	0	0	0	114.9	T296 F300	T296-G298 PolarHBondContact O-N 2.91Å; T296-G298 VanDerWaalsContact O-N 3.08Å; G298-F300 VanDerWaalsContact C-N 3.34Å
299	N	83.8	Confident	90.3	Very high	112 Å²	112	31 Å²	31	60%	0.599	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.5	13.2	-177.2	-66.9	-25.9	0	0	0	113.4	N297 E301 K367	N297-N299 PolarHBondContact O-N 2.91Å; N297-N299 WeakPolarHBondContact OD1-CB 3.11Å; N297-N299 PolarHBondContact OD1-N 3.47Å; N299-E301 HydrophobicContact CB-CG 4.01Å; N299-E301 PolarHBondContact O-N 2.05Å; N299-E301 VanDerWaalsContact O-N 3.15Å; N299-K367 PolarHBondContact O-NZ 3.47Å
300	F	87.9	Confident	90	Very high	46 Å²	46	28.9 Å²	28.9	20%	0.202	16%	0.157	C	C	.	.			trans	63.7	9.6	-176.8	-46.5	-89.2	0	0	0	114.1	N297 G298 N350 Y354 W364 K367	N297-F300 PolarHBondContact O-N 3.22Å; G298-F300 VanDerWaalsContact C-N 3.34Å; F300-N350 HydrophobicContact CD1-CB 3.53Å; F300-N350 WeakPolarHBondContact CD1-O 3.37Å; F300-N350 HydrophobicContact CE1-CB 3.58Å; F300-N350 VanDerWaalsContact CE1-O 3.32Å; F300-N350 WeakPolarHBondContact CE1-O 3.47Å; F300-N350 HydrophobicContact CG-CB 4.48Å; F300-Y354 HydrophobicContact CD1-CE2 4.11Å; F300-Y354 AromaticContact CE1-CE2 3.67Å; F300-Y354 HydrophobicContact CE1-CE2 3.67Å; F300-Y354 HydrophobicContact CZ-CE2 4.47Å; F300-W364 HydrophobicContact CB-CZ3 4.48Å; F300-W364 HydrophobicContact CD1-CH2 4.4Å; F300-W364 AromaticContact CD1-CZ3 3.91Å; F300-W364 HydrophobicContact CD1-CZ3 3.91Å; F300-W364 AromaticContact CD2-CH2 3.93Å; F300-W364 HydrophobicContact CD2-CH2 3.93Å; F300-W364 HydrophobicContact CD2-CZ2 4.49Å; F300-W364 HydrophobicContact CD2-CZ3 4.11Å; F300-W364 HydrophobicContact CE1-CH2 4.34Å; F300-W364 HydrophobicContact CE1-CZ3 4.13Å; F300-W364 AromaticContact CE2-CH2 3.87Å; F300-W364 HydrophobicContact CE2-CH2 3.87Å; F300-W364 HydrophobicContact CE2-CZ3 4.34Å; F300-W364 HydrophobicContact CG-CE3 4.46Å; F300-W364 HydrophobicContact CG-CH2 4.21Å; F300-W364 AromaticContact CG-CZ3 3.91Å; F300-W364 HydrophobicContact CG-CZ3 3.91Å; F300-W364 HydrophobicContact CZ-CH2 4.09Å; F300-W364 HydrophobicContact CZ-CZ3 4.35Å; F300-K367 HydrophobicContact CB-CD 4.06Å
301	E	88.8	Confident	89.6	Confident	56 Å²	56	28.9 Å²	28.9	26%	0.262	16%	0.157	S	C	.	.			trans	-77.4	136.6	-179.1	-57	-64.9	157.3	0	0	110.1	N295 N299 K367	N295-E301 PolarHBondContact ND2-O 2.86Å; N299-E301 HydrophobicContact CB-CG 4.01Å; N299-E301 PolarHBondContact O-N 2.05Å; N299-E301 VanDerWaalsContact O-N 3.15Å; E301-K367 IonicContact OE1-NZ 3Å; E301-K367 PolarHBondContact OE1-NZ 3.05Å
302	S	90.8	Very high	89	Confident	32 Å²	32	29.9 Å²	29.9	22%	0.224	16%	0.161	C	C	.	.			trans	-64.7	159.5	168.7	61.5	0	0	0	0	112	C345 I346 D347 K367 C369	S302-C345 VanDerWaalsContact CB-SG 3.58Å; S302-I346 CarbonylContact C-O 3.58Å; S302-I346 WeakPolarHBondContact CA-O 3.29Å; S302-D347 WeakPolarHBondContact CB-OD1 3.37Å; S302-K367 VanDerWaalsContact CB-O 3.27Å; S302-K367 WeakPolarHBondContact CB-O 3.38Å; S302-K367 PolarHBondContact N-O 3.31Å; S302-K367 VanDerWaalsContact N-O 3.1Å; S302-K367 PolarHBondContact OG-O 2.86Å; S302-C369 WeakPolarHBondContact CB-SG 3.37Å
303	E	90.6	Very high	88.2	Confident	13 Å²	13	31.6 Å²	31.6	6%	0.061	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	129.9	-179.9	-173.9	164.4	-155.1	0	0	110.7	L248 N295 C345 I346 G414 A415	L248-E303 HydrophobicContact CD2-CB 4.32Å; L248-E303 HydrophobicContact CD2-CG 3.88Å; N295-E303 PolarHBondContact ND2-N 3.14Å; N295-E303 VanDerWaalsContact ND2-N 3.2Å; E303-C345 CarbonylContact O-C 3.56Å; E303-C345 WeakPolarHBondContact O-CA 3.26Å; E303-I346 PolarHBondContact N-O 2.93Å; E303-I346 PolarHBondContact O-N 3.08Å; E303-G414 WeakPolarHBondContact OE1-CA 3.24Å; E303-A415 HydrophobicContact CG-CB 4.48Å; E303-A415 PolarHBondContact OE1-N 2.81Å
304	H	91.6	Very high	87.1	Confident	75 Å²	75	34.4 Å²	34.4	35%	0.347	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	140	174.7	-78.3	-110.5	0	0	0	110.8	Y306 Q344 A415	H304-Y306 HydrophobicContact CB-CD2 4.24Å; H304-Y306 HydrophobicContact CB-CE2 3.54Å; H304-Y306 WeakPolarHBondContact O-CD2 3.11Å; H304-Q344 WeakPolarHBondContact CA-O 3.3Å; H304-A415 PolarHBondContact O-N 3.03Å
305	V	91.7	Very high	86.2	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	130.5	173.9	-177.5	0	0	0	0	108.9	L248 C292 T342 Q344 I346 F382	L248-V305 HydrophobicContact CD2-CG2 3.82Å; C292-V305 HydrophobicContact CB-CG2 3.91Å; V305-T342 HydrophobicContact CG1-CG2 4.34Å; V305-T342 WeakPolarHBondContact O-CB 3.31Å; V305-T342 WeakPolarHBondContact O-CG2 3.33Å; V305-T342 PolarHBondContact O-N 2.98Å; V305-T342 PolarHBondContact O-OG1 2.89Å; V305-Q344 HydrophobicContact CB-CB 4.14Å; V305-Q344 HydrophobicContact CG2-CB 4.18Å; V305-Q344 PolarHBondContact N-O 3.17Å; V305-I346 HydrophobicContact CG2-CD1 4.41Å; V305-I346 HydrophobicContact CG2-CG1 3.91Å; V305-F382 HydrophobicContact CG1-CE1 4.19Å; V305-F382 HydrophobicContact CG1-CZ 4.11Å
306	Y	92.5	Very high	85.7	Confident	30 Å²	30	37.7 Å²	37.7	12%	0.118	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	144.3	177.5	-71.6	-86.2	0	0	0	111.1	H304 R339 I340 D341 F412 D413 A415	H304-Y306 HydrophobicContact CB-CD2 4.24Å; H304-Y306 HydrophobicContact CB-CE2 3.54Å; H304-Y306 WeakPolarHBondContact O-CD2 3.11Å; Y306-R339 VanDerWaalsContact CD1-CD 3.46Å; Y306-R339 HydrophobicContact CD1-CG 3.25Å; Y306-R339 HydrophobicContact CD2-CG 4.47Å; Y306-R339 HydrophobicContact CE1-CG 3.96Å; Y306-R339 HydrophobicContact CG-CG 3.56Å; Y306-I340 CarbonylContact C-O 3.59Å; Y306-I340 VanDerWaalsContact CA-O 3.29Å; Y306-I340 WeakPolarHBondContact CA-O 3.3Å; Y306-I340 WeakPolarHBondContact CD1-O 3.4Å; Y306-D341 VanDerWaalsContact CD1-CA 3.49Å; Y306-D341 HydrophobicContact CD1-CB 4.11Å; Y306-D341 HydrophobicContact CE1-CB 3.64Å; Y306-D341 PolarHBondContact OH-OD2 2.88Å; Y306-F412 WeakPolarHBondContact O-CA 3.44Å; Y306-D413 PolarHBondContact N-O 2.94Å; Y306-D413 PolarHBondContact O-N 2.95Å; Y306-A415 HydrophobicContact CD2-CB 3.92Å; Y306-A415 HydrophobicContact CE2-CB 3.5Å; Y306-A415 VanDerWaalsContact CE2-CB 3.5Å
307	A	92.9	Very high	85.8	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	116.2	163.5	0	0	0	0	0	108.3	Y326 I340 T342 V410 F412	A307-Y326 HydrophobicContact CB-CD2 4.37Å; A307-Y326 HydrophobicContact CB-CE2 3.85Å; A307-I340 HydrophobicContact CB-CB 4.21Å; A307-I340 PolarHBondContact N-O 3.36Å; A307-I340 WeakPolarHBondContact O-CB 3.08Å; A307-I340 PolarHBondContact O-N 3.45Å; A307-T342 HydrophobicContact CB-CG2 4.22Å; A307-V410 HydrophobicContact CB-CG1 3.96Å; A307-F412 HydrophobicContact CB-CD1 3.95Å; A307-F412 HydrophobicContact CB-CE1 3.63Å; A307-F412 HydrophobicContact CB-CZ 4.22Å
308	W	92.1	Very high	86.3	Confident	23 Å²	23	43.2 Å²	43.2	9%	0.087	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	106	178.9	-66.5	90.8	0	0	0	109.5	P311 K337 S338 R339 V410 Q411 G414 V418	W308-P311 WeakPolarHBondContact O-CD 3.49Å; W308-K337 HydrophobicContact CE3-CB 3.94Å; W308-K337 HydrophobicContact CZ3-CB 4.32Å; W308-S338 CarbonylContact C-O 3.55Å; W308-S338 WeakPolarHBondContact CA-O 3.24Å; W308-R339 HydrophobicContact CD2-CB 4.25Å; W308-R339 HydrophobicContact CD2-CG 4.11Å; W308-R339 HydrophobicContact CE3-CB 3.79Å; W308-R339 HydrophobicContact CE3-CG 4.12Å; W308-R339 HydrophobicContact CH2-CB 4.06Å; W308-R339 HydrophobicContact CH2-CG 3.94Å; W308-R339 HydrophobicContact CZ2-CB 4.45Å; W308-R339 VanDerWaalsContact CZ2-CD 3.49Å; W308-R339 HydrophobicContact CZ2-CG 3.88Å; W308-R339 HydrophobicContact CZ3-CB 3.69Å; W308-R339 HydrophobicContact CZ3-CG 4.04Å; W308-V410 CarbonylContact O-C 3.52Å; W308-V410 VanDerWaalsContact O-CA 3.3Å; W308-V410 WeakPolarHBondContact O-CA 3.08Å; W308-Q411 WeakPolarHBondContact CB-O 3.34Å; W308-Q411 PolarHBondContact N-O 2.66Å; W308-Q411 PolarHBondContact O-N 3.44Å; W308-G414 PolarHBondContact NE1-O 2.91Å; W308-G414 VanDerWaalsContact NE1-O 3.08Å; W308-V418 HydrophobicContact CB-CG2 3.43Å; W308-V418 VanDerWaalsContact CB-CG2 3.43Å; W308-V418 HydrophobicContact CD2-CG2 3.58Å; W308-V418 HydrophobicContact CE3-CG2 3.93Å; W308-V418 HydrophobicContact CG-CG2 3.38Å
309	V	91.2	Very high	87.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	135.9	174.3	175.8	0	0	0	0	109.8	V324 Y331 K337 S338 I340 V409 V410	V309-V324 HydrophobicContact CG1-CB 4.41Å; V309-V324 HydrophobicContact CG1-CG2 4.06Å; V309-V324 HydrophobicContact CG2-CB 4.09Å; V309-V324 HydrophobicContact CG2-CG2 4.18Å; V309-Y331 HydrophobicContact CG2-CG 4.47Å; V309-K337 CarbonylContact O-C 3.57Å; V309-K337 WeakPolarHBondContact O-CA 3.03Å; V309-S338 PolarHBondContact N-O 3.15Å; V309-S338 PolarHBondContact O-N 3.28Å; V309-I340 HydrophobicContact CG2-CD1 3.5Å; V309-I340 VanDerWaalsContact CG2-CD1 3.5Å; V309-I340 HydrophobicContact CG2-CG1 4.33Å; V309-V409 VanDerWaalsContact CA-O 3.31Å; V309-V409 WeakPolarHBondContact CA-O 3.34Å; V309-V410 HydrophobicContact CG2-CG2 4.19Å
310	N	88	Confident	87.5	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	50.2	63.1	-169	-167.9	4.1	0	0	0	113.1	Y312 P313 A333 N334 K337 Y407 V409	N310-Y312 PolarHBondContact O-N 3.32Å; N310-Y312 VanDerWaalsContact OD1-C 3.29Å; N310-Y312 PolarHBondContact OD1-O 2.82Å; N310-P313 WeakPolarHBondContact ND2-CA 3.47Å; N310-P313 VanDerWaalsContact OD1-CA 3.29Å; N310-P313 WeakPolarHBondContact OD1-CA 3.35Å; N310-A333 HydrophobicContact CB-CB 3.73Å; N310-N334 PolarHBondContact ND2-O 3.08Å; N310-K337 WeakPolarHBondContact O-CA 3.39Å; N310-K337 WeakPolarHBondContact O-CG 3.46Å; N310-Y407 WeakPolarHBondContact CB-OH 3.49Å; N310-Y407 PolarHBondContact ND2-OH 3.02Å; N310-Y407 PolarHBondContact OD1-OH 3.31Å; N310-V409 PolarHBondContact N-O 2.97Å
311	P	86.7	Confident	87.6	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	-62.9	-19.3	180	22.5	-28.5	0	0	0	113.4	W308 K337 I408 Q411 V418	W308-P311 WeakPolarHBondContact O-CD 3.49Å; P311-K337 VanDerWaalsContact O-CD 3.26Å; P311-K337 WeakPolarHBondContact O-CD 3.18Å; P311-K337 WeakPolarHBondContact O-CE 3.19Å; P311-K337 PolarHBondContact O-NZ 2.85Å; P311-I408 WeakPolarHBondContact CD-O 3.49Å; P311-I408 HydrophobicContact CG-CB 4.2Å; P311-I408 HydrophobicContact CG-CG2 3.51Å; P311-Q411 HydrophobicContact CB-CB 3.87Å; P311-Q411 HydrophobicContact CG-CB 3.79Å; P311-V418 HydrophobicContact CB-CB 4.31Å; P311-V418 HydrophobicContact CB-CG1 3.62Å; P311-V418 HydrophobicContact CB-CG2 3.74Å
312	Y	85	Confident	87.8	Confident	52 Å²	52	33.3 Å²	33.3	20%	0.204	18%	0.177	C	C	.	.			trans	-128.6	72.9	-177.9	-53.3	-88.1	0	0	0	111.7	N310 G314 V315 I408 Q411 E420	N310-Y312 PolarHBondContact O-N 3.32Å; N310-Y312 VanDerWaalsContact OD1-C 3.29Å; N310-Y312 PolarHBondContact OD1-O 2.82Å; Y312-G314 PolarHBondContact O-N 2.82Å; Y312-V315 PolarHBondContact O-N 3.09Å; Y312-I408 HydrophobicContact CD2-CB 3.93Å; Y312-I408 HydrophobicContact CD2-CD1 3.68Å; Y312-I408 HydrophobicContact CD2-CG1 4.34Å; Y312-I408 HydrophobicContact CD2-CG2 4.27Å; Y312-I408 HydrophobicContact CE2-CB 4.1Å; Y312-I408 HydrophobicContact CE2-CD1 3.35Å; Y312-I408 HydrophobicContact CE2-CG1 4.31Å; Y312-I408 HydrophobicContact CE2-CG2 4.06Å; Y312-Q411 PolarHBondContact OH-OE1 3.27Å; Y312-E420 HydrophobicContact CD1-CG 4.26Å; Y312-E420 HydrophobicContact CE1-CB 3.93Å; Y312-E420 HydrophobicContact CE1-CG 3.64Å
313	P	78.5	Confident	87.8	Confident	36 Å²	36	31.8 Å²	31.8	23%	0.234	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-2.9	-166.8	26.8	-35.6	0	0	0	116.5	N310 V315 Q316 K337	N310-P313 WeakPolarHBondContact ND2-CA 3.47Å; N310-P313 VanDerWaalsContact OD1-CA 3.29Å; N310-P313 WeakPolarHBondContact OD1-CA 3.35Å; P313-V315 VanDerWaalsContact C-N 3.3Å; P313-Q316 PolarHBondContact O-NE2 2.79Å; P313-Q316 VanDerWaalsContact O-NE2 3.12Å; P313-K337 HydrophobicContact CG-CG 4.24Å
314	G	71.6	Confident	87.8	Confident	80 Å²	80	31.2 Å²	31.2	83%	0.825	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-18	178.1	0	0	0	0	0	114.4	Y312	Y312-G314 PolarHBondContact O-N 2.82Å
315	V	73.8	Confident	87.7	Confident	72 Å²	72	27.7 Å²	27.7	44%	0.436	15%	0.147	S	C	.	.			trans	-101.1	115.2	179.6	-161.7	0	0	0	0	108.7	Y312 P313 L404 Y407	Y312-V315 PolarHBondContact O-N 3.09Å; P313-V315 VanDerWaalsContact C-N 3.3Å; V315-L404 HydrophobicContact CB-CD2 4.46Å; V315-L404 HydrophobicContact CG1-CD2 3.34Å; V315-Y407 HydrophobicContact CB-CD2 4.48Å; V315-Y407 WeakPolarHBondContact O-CE2 3.49Å
316	Q	80.1	Confident	87.4	Confident	56 Å²	56	28 Å²	28	26%	0.262	15%	0.148	S	C	.	.			trans	-142	148	177.4	-65.6	-171.3	27.6	0	0	111.2	P313 Q335	P313-Q316 PolarHBondContact O-NE2 2.79Å; P313-Q316 VanDerWaalsContact O-NE2 3.12Å; Q316-Q335 VanDerWaalsContact NE2-CA 3.32Å
317	D	88.5	Confident	86.7	Confident	7 Å²	7	30.7 Å²	30.7	4%	0.037	17%	0.165	C	C	.	.			trans	-82.3	148.4	167.9	-165.7	-79.9	0	0	0	110.2	Y319 Y320 Y400 S402 L404	D317-Y319 PolarHBondContact OD1-N 2.87Å; D317-Y320 HydrophobicContact CB-CD2 4.46Å; D317-Y320 PolarHBondContact OD1-N 2.78Å; D317-Y400 VanDerWaalsContact CG-OH 3.27Å; D317-Y400 PolarHBondContact OD1-OH 3.35Å; D317-Y400 PolarHBondContact OD2-OH 3.16Å; D317-S402 WeakPolarHBondContact OD2-CA 3.39Å; D317-S402 WeakPolarHBondContact OD2-CB 3.41Å; D317-S402 PolarHBondContact OD2-OG 3.44Å; D317-L404 HydrophobicContact CB-CD1 3.67Å; D317-L404 HydrophobicContact CB-CG 4.03Å
318	R	90.1	Very high	85.8	Confident	170 Å²	170	31.9 Å²	31.9	64%	0.642	18%	0.178	S	C	*	.	S	Bend	trans	-69.5	-42.2	178.3	177.8	175.4	176.1	174.5	-2.1	111.8
319	Y	93.4	Very high	85.1	Confident	19 Å²	19	32.9 Å²	32.9	8%	0.075	19%	0.186	C	C	.	.	S	Bend	trans	-102.7	-23.3	-171.9	-60.2	-78.1	0	0	0	112.4	D317 R393 E394 P396 P397 Y400	D317-Y319 PolarHBondContact OD1-N 2.87Å; Y319-R393 WeakPolarHBondContact O-CB 3.17Å; Y319-R393 PolarHBondContact O-N 3.34Å; Y319-E394 HydrophobicContact CD1-CB 4.02Å; Y319-E394 HydrophobicContact CD1-CG 4.35Å; Y319-E394 HydrophobicContact CE1-CB 4.48Å; Y319-E394 HydrophobicContact CE1-CG 4.38Å; Y319-P396 HydrophobicContact CD1-CB 4.04Å; Y319-P396 HydrophobicContact CD1-CG 4.47Å; Y319-P396 HydrophobicContact CD2-CB 4Å; Y319-P396 HydrophobicContact CE2-CB 4.47Å; Y319-P396 HydrophobicContact CG-CB 3.75Å; Y319-P396 HydrophobicContact CG-CG 4.12Å; Y319-P397 WeakPolarHBondContact OH-CD 3.45Å; Y319-Y400 AromaticContact CD2-CD1 3.71Å; Y319-Y400 HydrophobicContact CD2-CD1 3.71Å; Y319-Y400 AromaticContact CD2-CD2 3.79Å; Y319-Y400 HydrophobicContact CD2-CD2 3.79Å; Y319-Y400 AromaticContact CD2-CE1 3.51Å; Y319-Y400 HydrophobicContact CD2-CE1 3.51Å; Y319-Y400 AromaticContact CD2-CE2 3.62Å; Y319-Y400 HydrophobicContact CD2-CE2 3.62Å; Y319-Y400 AromaticContact CD2-CG 3.84Å; Y319-Y400 HydrophobicContact CD2-CG 3.84Å; Y319-Y400 AromaticContact CD2-CZ 3.47Å; Y319-Y400 VanDerWaalsContact CD2-CZ 3.47Å; Y319-Y400 HydrophobicContact CE2-CD1 4.32Å; Y319-Y400 AromaticContact CE2-CD2 3.59Å; Y319-Y400 HydrophobicContact CE2-CD2 3.59Å; Y319-Y400 HydrophobicContact CE2-CE1 4.3Å; Y319-Y400 AromaticContact CE2-CE2 3.6Å; Y319-Y400 HydrophobicContact CE2-CE2 3.6Å; Y319-Y400 AromaticContact CE2-CG 3.97Å; Y319-Y400 HydrophobicContact CE2-CG 3.97Å; Y319-Y400 AromaticContact CE2-CZ 3.97Å; Y319-Y400 HydrophobicContact CG-CD1 4.46Å; Y319-Y400 HydrophobicContact CG-CE1 4.35Å
320	Y	91.9	Very high	84.9	Confident	4 Å²	4	36.3 Å²	36.3	2%	0.016	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	142.7	-177.6	-53.5	-45.5	0	0	0	113.2	V270 I280 D317 V390 K391 R393 P396 Y400 I437	V270-Y320 HydrophobicContact CG2-CE1 4.06Å; I280-Y320 HydrophobicContact CD1-CD1 3.94Å; I280-Y320 HydrophobicContact CD1-CE1 3.93Å; D317-Y320 HydrophobicContact CB-CD2 4.46Å; D317-Y320 PolarHBondContact OD1-N 2.78Å; Y320-V390 HydrophobicContact CD1-CG1 4.04Å; Y320-V390 HydrophobicContact CG-CG1 4Å; Y320-K391 CarbonylContact C-O 3.46Å; Y320-R393 WeakPolarHBondContact O-CD 3.36Å; Y320-R393 PolarHBondContact O-NE 2.8Å; Y320-P396 HydrophobicContact CE1-CG 3.8Å; Y320-P396 WeakPolarHBondContact OH-CG 3.2Å; Y320-Y400 HydrophobicContact CD2-CE1 4.27Å; Y320-Y400 HydrophobicContact CE2-CD1 4.03Å; Y320-Y400 AromaticContact CE2-CE1 3.76Å; Y320-Y400 HydrophobicContact CE2-CE1 3.76Å; Y320-I437 HydrophobicContact CD2-CD1 3.82Å; Y320-I437 HydrophobicContact CE1-CG2 4.35Å; Y320-I437 HydrophobicContact CE2-CB 4.21Å; Y320-I437 HydrophobicContact CE2-CD1 3.56Å; Y320-I437 HydrophobicContact CE2-CG1 4.48Å; Y320-I437 HydrophobicContact CE2-CG2 4.24Å; Y320-I437 HydrophobicContact CG-CD1 4.46Å; Y320-I437 VanDerWaalsContact OH-CG2 3.23Å; Y320-I437 WeakPolarHBondContact OH-CG2 3.4Å
321	Q	90.7	Very high	84.9	Confident	23 Å²	23	38.7 Å²	38.7	11%	0.107	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	109.3	168.6	170.1	162.1	62	0	0	108.5	D332 N334 K391 R393	Q321-D332 HydrophobicContact CG-CB 4.4Å; Q321-N334 PolarHBondContact NE2-OD1 2.99Å; Q321-K391 HydrophobicContact CB-CB 4.08Å; Q321-K391 HydrophobicContact CG-CB 4.47Å; Q321-K391 PolarHBondContact N-O 2.84Å; Q321-K391 PolarHBondContact O-N 3.34Å; Q321-R393 HydrophobicContact CB-CG 3.89Å
322	L	91.8	Very high	85	Confident	7 Å²	7	40.4 Å²	40.4	4%	0.037	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	161.7	174.5	-56.2	171.8	0	0	0	110.3	A333 Y389 V390 L404 Y407 I431 L434	L322-A333 HydrophobicContact CB-CB 4.14Å; L322-A333 WeakPolarHBondContact O-CA 3.29Å; L322-A333 WeakPolarHBondContact O-CB 3.29Å; L322-A333 PolarHBondContact O-N 2.93Å; L322-Y389 CarbonylContact C-O 3.6Å; L322-V390 HydrophobicContact CD2-CG1 4.43Å; L322-V390 HydrophobicContact CD2-CG2 3.83Å; L322-L404 HydrophobicContact CD1-CD1 3.74Å; L322-Y407 HydrophobicContact CB-CE1 4.22Å; L322-Y407 HydrophobicContact CD1-CD1 3.32Å; L322-Y407 HydrophobicContact CD1-CD2 3.9Å; L322-Y407 HydrophobicContact CD1-CE1 3.53Å; L322-Y407 HydrophobicContact CD1-CE2 4.11Å; L322-Y407 HydrophobicContact CD1-CG 3.5Å; L322-Y407 VanDerWaalsContact CD1-CG 3.5Å; L322-I431 HydrophobicContact CD1-CD1 3.64Å; L322-I431 HydrophobicContact CD2-CD1 3.82Å; L322-I431 HydrophobicContact CG-CD1 4.19Å; L322-L434 HydrophobicContact CD1-CD1 3.92Å; L322-L434 HydrophobicContact CD2-CD1 3.95Å; L322-L434 HydrophobicContact CD2-CD2 3.89Å; L322-L434 HydrophobicContact CG-CD1 4.49Å
323	G	91	Very high	85	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174	175.5	173.4	0	0	0	0	0	112.5	Y331 Y389	G323-Y331 VanDerWaalsContact CA-O 3.24Å; G323-Y331 WeakPolarHBondContact CA-O 3.41Å; G323-Y389 PolarHBondContact N-O 3.33Å; G323-Y389 PolarHBondContact O-N 2.71Å
324	V	91.8	Very high	84.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	126.9	-176	-175.2	0	0	0	0	109.4	V309 Y326 Y331 M386 R387 L388 Y389 V409 V410	V309-V324 HydrophobicContact CG1-CB 4.41Å; V309-V324 HydrophobicContact CG1-CG2 4.06Å; V309-V324 HydrophobicContact CG2-CB 4.09Å; V309-V324 HydrophobicContact CG2-CG2 4.18Å; V324-Y326 PolarHBondContact O-N 2.85Å; V324-Y331 PolarHBondContact N-O 2.69Å; V324-Y331 PolarHBondContact O-N 3.03Å; V324-M386 HydrophobicContact CG1-CB 3.65Å; V324-M386 HydrophobicContact CG1-CG 4.29Å; V324-M386 HydrophobicContact CG1-SD 4.13Å; V324-R387 CarbonylContact C-O 3.57Å; V324-R387 VanDerWaalsContact CA-O 3.27Å; V324-R387 WeakPolarHBondContact CA-O 3.4Å; V324-L388 HydrophobicContact CG2-CD2 4.23Å; V324-Y389 VanDerWaalsContact C-CE1 3.41Å; V324-V409 HydrophobicContact CG2-CB 4.39Å; V324-V409 HydrophobicContact CG2-CG1 4.31Å; V324-V409 HydrophobicContact CG2-CG2 3.36Å; V324-V410 HydrophobicContact CB-CG2 4.48Å; V324-V410 HydrophobicContact CG1-CG2 4.25Å; V324-V410 HydrophobicContact CG2-CG2 3.72Å
325	T	89.1	Confident	84.6	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	96.9	164.5	-47.7	0	0	0	0	107.4	K279 E282 V329 D330 M386 R387 Y389	K279-T325 PolarHBondContact NZ-OG1 3.33Å; E282-T325 PolarHBondContact OE2-OG1 2.84Å; T325-V329 CarbonylContact C-O 3.52Å; T325-V329 VanDerWaalsContact CA-O 3.28Å; T325-V329 WeakPolarHBondContact CA-O 3.43Å; T325-D330 WeakPolarHBondContact CG2-OD1 3.49Å; T325-D330 PolarHBondContact OG1-OD1 3.05Å; T325-D330 VanDerWaalsContact OG1-OD1 3.04Å; T325-M386 CarbonylContact O-C 3.59Å; T325-M386 WeakPolarHBondContact O-CA 3.47Å; T325-R387 VanDerWaalsContact CG2-NH2 3.34Å; T325-R387 PolarHBondContact N-O 3.01Å; T325-R387 PolarHBondContact O-N 3.23Å; T325-Y389 WeakPolarHBondContact OG1-CD1 3.49Å
326	Y	84.5	Confident	84.5	Confident	6 Å²	6	41.6 Å²	41.6	2%	0.024	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	122.2	-179.3	-168.1	-80.5	0	0	0	109.6	A307 V324 G328 V329 I340 A384 M386 F412	A307-Y326 HydrophobicContact CB-CD2 4.37Å; A307-Y326 HydrophobicContact CB-CE2 3.85Å; V324-Y326 PolarHBondContact O-N 2.85Å; Y326-G328 PolarHBondContact O-N 3.01Å; Y326-G328 VanDerWaalsContact O-N 3.14Å; Y326-V329 PolarHBondContact N-O 2.85Å; Y326-V329 PolarHBondContact O-N 2.82Å; Y326-I340 HydrophobicContact CD1-CD1 4.36Å; Y326-I340 HydrophobicContact CD1-CG2 3.67Å; Y326-I340 HydrophobicContact CD2-CD1 4.24Å; Y326-I340 HydrophobicContact CE1-CG2 3.96Å; Y326-I340 HydrophobicContact CG-CD1 3.84Å; Y326-I340 HydrophobicContact CG-CG2 4.23Å; Y326-A384 HydrophobicContact CE2-CB 3.99Å; Y326-M386 HydrophobicContact CD2-CB 4.19Å; Y326-M386 HydrophobicContact CD2-CE 4.4Å; Y326-M386 HydrophobicContact CE2-CE 4.25Å; Y326-F412 HydrophobicContact CE2-CE1 4.28Å; Y326-F412 HydrophobicContact CE2-CZ 4.31Å
327	N	78.3	Confident	84.6	Confident	87 Å²	87	41.6 Å²	41.6	47%	0.465	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.5	41.6	-175	-69	-19.3	0	0	0	113.7	V329 R385	N327-V329 VanDerWaalsContact C-N 3.33Å; N327-V329 PolarHBondContact O-N 2.92Å; N327-R385 PolarHBondContact N-O 3.4Å; N327-R385 VanDerWaalsContact N-O 3.09Å; N327-R385 PolarHBondContact OD1-O 2.67Å
328	G	74.9	Confident	84.4	Confident	26 Å²	26	42.1 Å²	42.1	27%	0.268	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	5	177.8	0	0	0	0	0	116	Y326 E499	Y326-G328 PolarHBondContact O-N 3.01Å; Y326-G328 VanDerWaalsContact O-N 3.14Å; G328-E499 WeakPolarHBondContact CA-OE1 3.29Å
329	V	77.1	Confident	84.2	Confident	43 Å²	43	38.2 Å²	38.2	26%	0.261	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	130	176.7	-177.3	0	0	0	0	110.2	T325 Y326 N327 Y331	T325-V329 CarbonylContact C-O 3.52Å; T325-V329 VanDerWaalsContact CA-O 3.28Å; T325-V329 WeakPolarHBondContact CA-O 3.43Å; Y326-V329 PolarHBondContact N-O 2.85Å; Y326-V329 PolarHBondContact O-N 2.82Å; N327-V329 VanDerWaalsContact C-N 3.33Å; N327-V329 PolarHBondContact O-N 2.92Å; V329-Y331 HydrophobicContact CB-CE2 3.7Å; V329-Y331 HydrophobicContact CG1-CD2 4.42Å; V329-Y331 HydrophobicContact CG1-CE1 4.49Å; V329-Y331 HydrophobicContact CG1-CE2 3.68Å; V329-Y331 WeakPolarHBondContact O-CD2 3.45Å; V329-Y331 VanDerWaalsContact O-CE2 3.26Å; V329-Y331 WeakPolarHBondContact O-CE2 3.47Å
330	D	86	Confident	84	Confident	72 Å²	72	37.7 Å²	37.7	39%	0.385	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	132.6	178.5	-71.4	-2.8	0	0	0	112.2	K279 T325 Y389	K279-D330 WeakPolarHBondContact CE-OD2 3.44Å; K279-D330 IonicContact NZ-OD1 2.91Å; K279-D330 PolarHBondContact NZ-OD1 3.19Å; K279-D330 IonicContact NZ-OD2 2.8Å; K279-D330 PolarHBondContact NZ-OD2 2.81Å; T325-D330 WeakPolarHBondContact CG2-OD1 3.49Å; T325-D330 PolarHBondContact OG1-OD1 3.05Å; T325-D330 VanDerWaalsContact OG1-OD1 3.04Å; D330-Y389 HydrophobicContact CB-CE1 4.17Å
331	Y	88.6	Confident	83.8	Confident	51 Å²	51	40.3 Å²	40.3	20%	0.2	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	101.3	173.6	-62.2	-90.1	0	0	0	109.5	V309 G323 V324 V329 I340 Y389	V309-Y331 HydrophobicContact CG2-CG 4.47Å; G323-Y331 VanDerWaalsContact CA-O 3.24Å; G323-Y331 WeakPolarHBondContact CA-O 3.41Å; V324-Y331 PolarHBondContact N-O 2.69Å; V324-Y331 PolarHBondContact O-N 3.03Å; V329-Y331 HydrophobicContact CB-CE2 3.7Å; V329-Y331 HydrophobicContact CG1-CD2 4.42Å; V329-Y331 HydrophobicContact CG1-CE1 4.49Å; V329-Y331 HydrophobicContact CG1-CE2 3.68Å; V329-Y331 WeakPolarHBondContact O-CD2 3.45Å; V329-Y331 VanDerWaalsContact O-CE2 3.26Å; V329-Y331 WeakPolarHBondContact O-CE2 3.47Å; Y331-I340 HydrophobicContact CD1-CD1 3.99Å; Y331-I340 HydrophobicContact CD1-CG1 3.92Å; Y331-I340 HydrophobicContact CD2-CD1 3.38Å; Y331-I340 HydrophobicContact CD2-CG1 4.13Å; Y331-I340 HydrophobicContact CE1-CD1 4.05Å; Y331-I340 HydrophobicContact CE1-CG1 3.68Å; Y331-I340 HydrophobicContact CE2-CD1 3.45Å; Y331-I340 VanDerWaalsContact CE2-CD1 3.45Å; Y331-I340 HydrophobicContact CE2-CG1 3.91Å; Y331-I340 HydrophobicContact CE2-CG2 4.41Å; Y331-I340 HydrophobicContact CG-CD1 3.67Å; Y331-I340 HydrophobicContact CG-CG1 4.13Å; Y331-Y389 PolarHBondContact N-OH 2.88Å; Y331-Y389 PolarHBondContact O-OH 3.45Å
332	D	88.7	Confident	83.6	Confident	36 Å²	36	39.7 Å²	39.7	19%	0.193	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	133	178	-69.3	-26.7	0	0	0	111	Q321 N334 Y389 K391	Q321-D332 HydrophobicContact CG-CB 4.4Å; D332-N334 VanDerWaalsContact CB-ND2 3.26Å; D332-N334 WeakPolarHBondContact CB-ND2 3.12Å; D332-N334 PolarHBondContact O-N 3.12Å; D332-N334 PolarHBondContact O-ND2 3.14Å; D332-N334 VanDerWaalsContact O-ND2 3.11Å; D332-Y389 WeakPolarHBondContact CA-OH 3.22Å; D332-Y389 PolarHBondContact N-OH 3.01Å; D332-Y389 VanDerWaalsContact N-OH 3.13Å; D332-Y389 WeakPolarHBondContact OD1-CE2 3.21Å; D332-Y389 VanDerWaalsContact OD1-CZ 3.27Å; D332-Y389 PolarHBondContact OD1-OH 2.72Å; D332-K391 VanDerWaalsContact CG-NZ 3.26Å; D332-K391 WeakPolarHBondContact OD1-CE 3.38Å; D332-K391 IonicContact OD1-NZ 3.6Å; D332-K391 PolarHBondContact OD1-NZ 3.19Å; D332-K391 IonicContact OD2-NZ 3.39Å; D332-K391 PolarHBondContact OD2-NZ 2.78Å
333	A	84.9	Confident	83.5	Confident	3 Å²	3	45.3 Å²	45.3	3%	0.025	23%	0.228	C	C	.	.			trans	-71.3	78.7	168	0	0	0	0	0	110.3	N310 L322 Y407	N310-A333 HydrophobicContact CB-CB 3.73Å; L322-A333 HydrophobicContact CB-CB 4.14Å; L322-A333 WeakPolarHBondContact O-CA 3.29Å; L322-A333 WeakPolarHBondContact O-CB 3.29Å; L322-A333 PolarHBondContact O-N 2.93Å; A333-Y407 VanDerWaalsContact CB-OH 3.22Å; A333-Y407 WeakPolarHBondContact CB-OH 3.44Å
334	N	75.6	Confident	83.6	Confident	40 Å²	40	47.1 Å²	47.1	21%	0.214	24%	0.237	C	C	.	.			trans	-83	-173.4	173.8	-68.9	-71.3	0	0	0	110.5	N310 Q321 D332 R336	N310-N334 PolarHBondContact ND2-O 3.08Å; Q321-N334 PolarHBondContact NE2-OD1 2.99Å; D332-N334 VanDerWaalsContact CB-ND2 3.26Å; D332-N334 WeakPolarHBondContact CB-ND2 3.12Å; D332-N334 PolarHBondContact O-N 3.12Å; D332-N334 PolarHBondContact O-ND2 3.14Å; D332-N334 VanDerWaalsContact O-ND2 3.11Å; N334-R336 PolarHBondContact O-N 2.97Å
335	Q	66	Low	83.7	Confident	143 Å²	143	47.4 Å²	47.4	67%	0.668	24%	0.238	S	C	*	.	S	Bend	trans	-64.5	22.8	169.5	-66	177.1	-10.5	0	0	114.7	A143 Q316	A143-Q335 VanDerWaalsContact CB-O 3.3Å; A143-Q335 WeakPolarHBondContact CB-O 3.02Å; Q316-Q335 VanDerWaalsContact NE2-CA 3.32Å
336	R	71.8	Confident	83.9	Confident	79 Å²	79	47.3 Å²	47.3	30%	0.298	24%	0.238	S	C	.	.	S	Bend	trans	-138.3	149.8	-177.9	-69	-175	-164.7	-126.8	13.6	110.5	K141 K142 A143 N334	K141-R336 VanDerWaalsContact CB-NH2 3.28Å; K141-R336 PolarHBondContact O-NH2 3.44Å; K142-R336 PolarHBondContact O-NH1 3.31Å; K142-R336 VanDerWaalsContact O-NH1 3.09Å; K142-R336 PolarHBondContact O-NH2 3.49Å; A143-R336 HydrophobicContact CB-CB 4.45Å; A143-R336 HydrophobicContact CB-CG 3.23Å; N334-R336 PolarHBondContact O-N 2.97Å
337	K	81.8	Confident	84.4	Confident	56 Å²	56	47.1 Å²	47.1	24%	0.243	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-72.6	126.1	160	-39.2	-170.2	-173.7	-157.3	0	108.5	W308 V309 N310 P311 P313 V418 E420	W308-K337 HydrophobicContact CE3-CB 3.94Å; W308-K337 HydrophobicContact CZ3-CB 4.32Å; V309-K337 CarbonylContact O-C 3.57Å; V309-K337 WeakPolarHBondContact O-CA 3.03Å; N310-K337 WeakPolarHBondContact O-CA 3.39Å; N310-K337 WeakPolarHBondContact O-CG 3.46Å; P311-K337 VanDerWaalsContact O-CD 3.26Å; P311-K337 WeakPolarHBondContact O-CD 3.18Å; P311-K337 WeakPolarHBondContact O-CE 3.19Å; P311-K337 PolarHBondContact O-NZ 2.85Å; P313-K337 HydrophobicContact CG-CG 4.24Å; K337-V418 HydrophobicContact CD-CB 4.14Å; K337-V418 HydrophobicContact CD-CG2 3.73Å; K337-E420 IonicContact NZ-OE1 2.76Å; K337-E420 PolarHBondContact NZ-OE1 2.79Å
338	S	84.3	Confident	85.1	Confident	17 Å²	17	43 Å²	43	12%	0.119	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.9	172.1	-83.4	0	0	0	0	108.5	W308 V309	W308-S338 CarbonylContact C-O 3.55Å; W308-S338 WeakPolarHBondContact CA-O 3.24Å; V309-S338 PolarHBondContact N-O 3.15Å; V309-S338 PolarHBondContact O-N 3.28Å
339	R	87.2	Confident	85.8	Confident	89 Å²	89	46.3 Å²	46.3	34%	0.336	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	125.7	-179.2	-172.7	-179.5	66.4	-173.6	-2.4	110.5	Y306 W308 A415	Y306-R339 VanDerWaalsContact CD1-CD 3.46Å; Y306-R339 HydrophobicContact CD1-CG 3.25Å; Y306-R339 HydrophobicContact CD2-CG 4.47Å; Y306-R339 HydrophobicContact CE1-CG 3.96Å; Y306-R339 HydrophobicContact CG-CG 3.56Å; W308-R339 HydrophobicContact CD2-CB 4.25Å; W308-R339 HydrophobicContact CD2-CG 4.11Å; W308-R339 HydrophobicContact CE3-CB 3.79Å; W308-R339 HydrophobicContact CE3-CG 4.12Å; W308-R339 HydrophobicContact CH2-CB 4.06Å; W308-R339 HydrophobicContact CH2-CG 3.94Å; W308-R339 HydrophobicContact CZ2-CB 4.45Å; W308-R339 VanDerWaalsContact CZ2-CD 3.49Å; W308-R339 HydrophobicContact CZ2-CG 3.88Å; W308-R339 HydrophobicContact CZ3-CB 3.69Å; W308-R339 HydrophobicContact CZ3-CG 4.04Å; R339-A415 PolarHBondContact NH1-O 3.01Å; R339-A415 VanDerWaalsContact NH1-O 3.11Å
340	I	87.7	Confident	86.5	Confident	8 Å²	8	46.7 Å²	46.7	4%	0.041	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	121.6	179.9	-49.8	174.7	0	0	0	109.1	Y306 A307 V309 Y326 Y331 T342	Y306-I340 CarbonylContact C-O 3.59Å; Y306-I340 VanDerWaalsContact CA-O 3.29Å; Y306-I340 WeakPolarHBondContact CA-O 3.3Å; Y306-I340 WeakPolarHBondContact CD1-O 3.4Å; A307-I340 HydrophobicContact CB-CB 4.21Å; A307-I340 PolarHBondContact N-O 3.36Å; A307-I340 WeakPolarHBondContact O-CB 3.08Å; A307-I340 PolarHBondContact O-N 3.45Å; V309-I340 HydrophobicContact CG2-CD1 3.5Å; V309-I340 VanDerWaalsContact CG2-CD1 3.5Å; V309-I340 HydrophobicContact CG2-CG1 4.33Å; Y326-I340 HydrophobicContact CD1-CD1 4.36Å; Y326-I340 HydrophobicContact CD1-CG2 3.67Å; Y326-I340 HydrophobicContact CD2-CD1 4.24Å; Y326-I340 HydrophobicContact CE1-CG2 3.96Å; Y326-I340 HydrophobicContact CG-CD1 3.84Å; Y326-I340 HydrophobicContact CG-CG2 4.23Å; Y331-I340 HydrophobicContact CD1-CD1 3.99Å; Y331-I340 HydrophobicContact CD1-CG1 3.92Å; Y331-I340 HydrophobicContact CD2-CD1 3.38Å; Y331-I340 HydrophobicContact CD2-CG1 4.13Å; Y331-I340 HydrophobicContact CE1-CD1 4.05Å; Y331-I340 HydrophobicContact CE1-CG1 3.68Å; Y331-I340 HydrophobicContact CE2-CD1 3.45Å; Y331-I340 VanDerWaalsContact CE2-CD1 3.45Å; Y331-I340 HydrophobicContact CE2-CG1 3.91Å; Y331-I340 HydrophobicContact CE2-CG2 4.41Å; Y331-I340 HydrophobicContact CG-CD1 3.67Å; Y331-I340 HydrophobicContact CG-CG1 4.13Å; I340-T342 PolarHBondContact O-N 3.25Å
341	D	87.8	Confident	86.7	Confident	59 Å²	59	43.2 Å²	43.2	32%	0.316	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	121.2	175.8	-159.3	-33.3	0	0	0	110	Y306 N343	Y306-D341 VanDerWaalsContact CD1-CA 3.49Å; Y306-D341 HydrophobicContact CD1-CB 4.11Å; Y306-D341 HydrophobicContact CE1-CB 3.64Å; Y306-D341 PolarHBondContact OH-OD2 2.88Å; D341-N343 PolarHBondContact O-N 2.88Å; D341-N343 WeakPolarHBondContact OD1-CA 3.45Å; D341-N343 PolarHBondContact OD1-N 3.04Å
342	T	87.5	Confident	86.6	Confident	10 Å²	10	45.9 Å²	45.9	6%	0.061	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-5.5	176.9	69.2	0	0	0	0	112.3	V305 A307 I340 Q344 F382 F412	V305-T342 HydrophobicContact CG1-CG2 4.34Å; V305-T342 WeakPolarHBondContact O-CB 3.31Å; V305-T342 WeakPolarHBondContact O-CG2 3.33Å; V305-T342 PolarHBondContact O-N 2.98Å; V305-T342 PolarHBondContact O-OG1 2.89Å; A307-T342 HydrophobicContact CB-CG2 4.22Å; I340-T342 PolarHBondContact O-N 3.25Å; T342-Q344 PolarHBondContact O-N 3.49Å; T342-Q344 PolarHBondContact O-NE2 3.34Å; T342-Q344 WeakPolarHBondContact OG1-CB 3.11Å; T342-Q344 PolarHBondContact OG1-N 3.36Å; T342-F382 HydrophobicContact CG2-CE2 3.81Å; T342-F382 HydrophobicContact CG2-CZ 3.82Å; T342-F412 HydrophobicContact CG2-CD1 4.31Å; T342-F412 HydrophobicContact CG2-CE1 4.33Å
343	N	89.4	Confident	86.7	Confident	124 Å²	124	50.3 Å²	50.3	66%	0.663	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	57.4	20.4	-168.6	-57.1	-68	0	0	0	113.5	D341	D341-N343 PolarHBondContact O-N 2.88Å; D341-N343 WeakPolarHBondContact OD1-CA 3.45Å; D341-N343 PolarHBondContact OD1-N 3.04Å
344	Q	93.2	Very high	87.1	Confident	39 Å²	39	52.9 Å²	52.9	18%	0.182	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	146.5	171.1	-52.4	-48.6	-50.5	0	0	110.3	H304 V305 T342 R380 F382	H304-Q344 WeakPolarHBondContact CA-O 3.3Å; V305-Q344 HydrophobicContact CB-CB 4.14Å; V305-Q344 HydrophobicContact CG2-CB 4.18Å; V305-Q344 PolarHBondContact N-O 3.17Å; T342-Q344 PolarHBondContact O-N 3.49Å; T342-Q344 PolarHBondContact O-NE2 3.34Å; T342-Q344 WeakPolarHBondContact OG1-CB 3.11Å; T342-Q344 PolarHBondContact OG1-N 3.36Å; Q344-R380 HydrophobicContact CB-CB 4.27Å; Q344-R380 HydrophobicContact CB-CG 4.27Å; Q344-F382 HydrophobicContact CB-CD1 4.34Å; Q344-F382 HydrophobicContact CB-CE1 4.4Å; Q344-F382 HydrophobicContact CG-CB 3.97Å; Q344-F382 HydrophobicContact CG-CD1 3.45Å; Q344-F382 VanDerWaalsContact CG-CD1 3.45Å; Q344-F382 HydrophobicContact CG-CD2 4.15Å; Q344-F382 HydrophobicContact CG-CE1 3.84Å; Q344-F382 HydrophobicContact CG-CG 3.59Å; Q344-F382 HydrophobicContact CG-CZ 4.35Å
345	C	93.2	Very high	88	Confident	6 Å²	6	54 Å²	54	4%	0.041	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	139.5	-177.7	175.6	0	0	0	0	108.8	S302 E303 C369 R380	S302-C345 VanDerWaalsContact CB-SG 3.58Å; E303-C345 CarbonylContact O-C 3.56Å; E303-C345 WeakPolarHBondContact O-CA 3.26Å; C345-C369 VanDerWaalsContact CA-SG 3.58Å; C345-C369 HydrophobicContact CB-CB 3.6Å; C345-C369 WeakPolarHBondContact CB-SG 3.37Å; C345-C369 PolarHBondContact O-SG 2.76Å; C345-C369 VanDerWaalsContact SG-CA 3.51Å; C345-C369 WeakPolarHBondContact SG-CB 3.16Å; C345-C369 CovalentContact SG-SG 2.03Å; C345-C369 PolarHBondContact SG-SG 2.96Å; C345-R380 WeakPolarHBondContact O-CG 3.3Å; C345-R380 PolarHBondContact O-NH1 2.93Å
346	I	93.9	Very high	89.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	123.9	179.5	-50.2	-60.6	0	0	0	108.4	L248 C292 N295 S302 E303 V305 C369 H377 R380	L248-I346 HydrophobicContact CD2-CG1 4.35Å; C292-I346 HydrophobicContact CB-CD1 4.34Å; C292-I346 HydrophobicContact CB-CG1 4.46Å; C292-I346 WeakPolarHBondContact O-CD1 3.45Å; N295-I346 HydrophobicContact CB-CB 4.07Å; N295-I346 HydrophobicContact CB-CG2 3.7Å; N295-I346 PolarHBondContact ND2-O 2.98Å; S302-I346 CarbonylContact C-O 3.58Å; S302-I346 WeakPolarHBondContact CA-O 3.29Å; E303-I346 PolarHBondContact N-O 2.93Å; E303-I346 PolarHBondContact O-N 3.08Å; V305-I346 HydrophobicContact CG2-CD1 4.41Å; V305-I346 HydrophobicContact CG2-CG1 3.91Å; I346-C369 VanDerWaalsContact C-SG 3.56Å; I346-C369 PolarHBondContact N-SG 2.83Å; I346-C369 VanDerWaalsContact N-SG 3.35Å; I346-H377 WeakPolarHBondContact CA-O 3.37Å; I346-R380 HydrophobicContact CD1-CB 3.7Å; I346-R380 HydrophobicContact CD1-CG 3.53Å
347	D	94.2	Very high	90.5	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	26%	0.259	C	S	.	.			trans	-71.9	147.7	175.4	-71	-42.4	0	0	0	111.1	S302 K349 I351 I368 C369 I376 H377 M378	S302-D347 WeakPolarHBondContact CB-OD1 3.37Å; D347-K349 PolarHBondContact O-N 3.27Å; D347-I351 HydrophobicContact CB-CG2 4.29Å; D347-I368 WeakPolarHBondContact OD1-CA 3.5Å; D347-I368 VanDerWaalsContact OD2-CG2 3.29Å; D347-I368 WeakPolarHBondContact OD2-CG2 3.32Å; D347-C369 PolarHBondContact OD1-N 3.15Å; D347-C369 PolarHBondContact OD1-SG 3.24Å; D347-I376 HydrophobicContact CB-CG2 3.97Å; D347-H377 PolarHBondContact N-O 2.99Å; D347-H377 PolarHBondContact OD2-N 2.83Å; D347-M378 HydrophobicContact CB-CE 3.48Å; D347-M378 VanDerWaalsContact CB-CE 3.48Å
348	S	92.5	Very high	91.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.267	C	S	.	.			trans	-61.1	132.6	179.1	173.2	0	0	0	0	110.4	N295 N297 N350 I351	N295-S348 PolarHBondContact ND2-N 2.8Å; N297-S348 PolarHBondContact O-OG 2.91Å; S348-N350 PolarHBondContact O-N 2.85Å; S348-N350 PolarHBondContact OG-N 3.37Å; S348-I351 WeakPolarHBondContact O-CB 3.45Å; S348-I351 WeakPolarHBondContact O-CG2 3.36Å; S348-I351 PolarHBondContact O-N 2.89Å
349	K	91	Very high	91.6	Very high	96 Å²	96	52.4 Å²	52.4	42%	0.417	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-55.3	-25.2	173.9	72.4	-177.5	-177.3	-179	0	113.2	N295 T296 D347 I351 D352	N295-K349 WeakPolarHBondContact O-CG 3.42Å; N295-K349 PolarHBondContact O-N 2.65Å; T296-K349 HydrophobicContact CG2-CD 4.06Å; T296-K349 VanDerWaalsContact CG2-NZ 3.32Å; D347-K349 PolarHBondContact O-N 3.27Å; K349-I351 PolarHBondContact O-N 3.26Å; K349-D352 WeakPolarHBondContact O-CB 3.42Å; K349-D352 PolarHBondContact O-N 3.25Å
350	N	90.5	Very high	91.9	Very high	51 Å²	51	52.6 Å²	52.6	27%	0.273	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-71.4	-13.3	179.2	-61.5	-38.1	0	0	0	112.1	N297 F300 S348 Y354	N297-N350 PolarHBondContact O-ND2 3.1Å; F300-N350 HydrophobicContact CD1-CB 3.53Å; F300-N350 WeakPolarHBondContact CD1-O 3.37Å; F300-N350 HydrophobicContact CE1-CB 3.58Å; F300-N350 VanDerWaalsContact CE1-O 3.32Å; F300-N350 WeakPolarHBondContact CE1-O 3.47Å; F300-N350 HydrophobicContact CG-CB 4.48Å; S348-N350 PolarHBondContact O-N 2.85Å; S348-N350 PolarHBondContact OG-N 3.37Å; N350-Y354 WeakPolarHBondContact O-CE2 3.29Å
351	I	90.7	Very high	92.3	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-82.6	-21.5	176.8	-142.7	176	0	0	0	112.9	D347 S348 K349 I353 Y354 I359 I368 I376 M378	D347-I351 HydrophobicContact CB-CG2 4.29Å; S348-I351 WeakPolarHBondContact O-CB 3.45Å; S348-I351 WeakPolarHBondContact O-CG2 3.36Å; S348-I351 PolarHBondContact O-N 2.89Å; K349-I351 PolarHBondContact O-N 3.26Å; I351-I353 PolarHBondContact O-N 3.49Å; I351-I353 VanDerWaalsContact O-N 3.11Å; I351-Y354 WeakPolarHBondContact O-CD2 3.28Å; I351-Y354 PolarHBondContact O-N 3.28Å; I351-I359 HydrophobicContact CD1-CD1 4.35Å; I351-I359 HydrophobicContact CG1-CD1 4.25Å; I351-I359 HydrophobicContact CG1-CG1 4.4Å; I351-I368 HydrophobicContact CD1-CD1 3.6Å; I351-I368 HydrophobicContact CD1-CG1 3.38Å; I351-I376 HydrophobicContact CG2-CD1 4.43Å; I351-I376 HydrophobicContact CG2-CG2 3.98Å; I351-M378 HydrophobicContact CG2-CE 3.67Å
352	D	87.1	Confident	92.5	Very high	107 Å²	107	57 Å²	57	57%	0.572	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-19	-172.2	-166.1	43	0	0	0	113.5	K349 Y354 M378	K349-D352 WeakPolarHBondContact O-CB 3.42Å; K349-D352 PolarHBondContact O-N 3.25Å; D352-Y354 VanDerWaalsContact C-N 3.28Å; D352-Y354 PolarHBondContact O-N 3.01Å; D352-M378 HydrophobicContact CB-SD 4.03Å
353	I	91	Very high	92.8	Very high	128 Å²	128	58.4 Å²	58.4	66%	0.656	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-7.9	177.4	67.4	175	0	0	0	113.7	I351	I351-I353 PolarHBondContact O-N 3.49Å; I351-I353 VanDerWaalsContact O-N 3.11Å
354	Y	93.1	Very high	92.9	Very high	58 Å²	58	55 Å²	55	23%	0.227	30%	0.297	C	S	.	.	S	Bend	trans	-105.3	137.6	-176	-60.3	-81.6	0	0	0	111.7	F300 N350 I351 D352 Q358 M362 W364	F300-Y354 HydrophobicContact CD1-CE2 4.11Å; F300-Y354 AromaticContact CE1-CE2 3.67Å; F300-Y354 HydrophobicContact CE1-CE2 3.67Å; F300-Y354 HydrophobicContact CZ-CE2 4.47Å; N350-Y354 WeakPolarHBondContact O-CE2 3.29Å; I351-Y354 WeakPolarHBondContact O-CD2 3.28Å; I351-Y354 PolarHBondContact O-N 3.28Å; D352-Y354 VanDerWaalsContact C-N 3.28Å; D352-Y354 PolarHBondContact O-N 3.01Å; Y354-Q358 HydrophobicContact CD1-CB 4.34Å; Y354-M362 HydrophobicContact CD1-CE 3.43Å; Y354-M362 VanDerWaalsContact CD1-CE 3.43Å; Y354-M362 HydrophobicContact CD1-SD 4.31Å; Y354-M362 HydrophobicContact CD2-CE 4.35Å; Y354-M362 HydrophobicContact CE1-CE 3.75Å; Y354-M362 HydrophobicContact CE1-SD 4.09Å; Y354-M362 HydrophobicContact CG-CE 3.75Å; Y354-W364 HydrophobicContact CD2-CZ3 4.11Å; Y354-W364 HydrophobicContact CE1-CZ3 4.39Å; Y354-W364 HydrophobicContact CE2-CH2 4.37Å; Y354-W364 AromaticContact CE2-CZ3 3.66Å; Y354-W364 HydrophobicContact CE2-CZ3 3.66Å; Y354-W364 AromaticContact CZ-CZ3 3.8Å
355	T	95	Very high	92.9	Very high	62 Å²	62	56.1 Å²	56.1	38%	0.38	30%	0.302	S	S	.	.			trans	-72.2	158	172.1	81.5	0	0	0	0	111	E357 Q358 I359	T355-E357 VanDerWaalsContact CB-OE2 3.27Å; T355-E357 WeakPolarHBondContact CB-OE2 3.3Å; T355-E357 PolarHBondContact O-N 3.47Å; T355-E357 PolarHBondContact OG1-N 2.7Å; T355-E357 PolarHBondContact OG1-OE2 2.64Å; T355-Q358 WeakPolarHBondContact O-CB 3.44Å; T355-Q358 PolarHBondContact O-N 2.85Å; T355-Q358 PolarHBondContact OG1-N 2.66Å; T355-I359 PolarHBondContact O-N 2.78Å
356	P	94.1	Very high	92.8	Very high	46 Å²	46	62.2 Å²	62.2	30%	0.299	33%	0.334	S	S	.	.	H	α-helix	trans	-50.4	-40.2	173.6	-29.2	36.3	0	0	0	113.1	Q358 I359 I360 P373	P356-Q358 PolarHBondContact O-N 2.94Å; P356-I359 PolarHBondContact O-N 2.85Å; P356-I360 VanDerWaalsContact O-CG1 3.24Å; P356-I360 WeakPolarHBondContact O-CG1 3.48Å; P356-I360 PolarHBondContact O-N 2.86Å; P356-P373 HydrophobicContact CB-CB 3.89Å; P356-P373 WeakPolarHBondContact CG-O 3.44Å
357	E	95.6	Very high	92.7	Very high	128 Å²	128	63.2 Å²	63.2	60%	0.598	34%	0.339	S	S	*	.	H	α-helix	trans	-65	-39.2	178	-58.3	71.9	-154.3	0	0	112.1	T355 I360 A361	T355-E357 VanDerWaalsContact CB-OE2 3.27Å; T355-E357 WeakPolarHBondContact CB-OE2 3.3Å; T355-E357 PolarHBondContact O-N 3.47Å; T355-E357 PolarHBondContact OG1-N 2.7Å; T355-E357 PolarHBondContact OG1-OE2 2.64Å; E357-I360 PolarHBondContact O-N 3.42Å; E357-A361 WeakPolarHBondContact O-CB 3.43Å; E357-A361 PolarHBondContact O-N 2.99Å
358	Q	96	Very high	92.5	Very high	89 Å²	89	63.6 Å²	63.6	42%	0.416	34%	0.341	S	S	.	.	H	α-helix	trans	-67.4	-42.8	176.9	-69.6	175.8	-41.4	0	0	111.3	Y354 T355 P356 I360 A361 M362	Y354-Q358 HydrophobicContact CD1-CB 4.34Å; T355-Q358 WeakPolarHBondContact O-CB 3.44Å; T355-Q358 PolarHBondContact O-N 2.85Å; T355-Q358 PolarHBondContact OG1-N 2.66Å; P356-Q358 PolarHBondContact O-N 2.94Å; Q358-I360 VanDerWaalsContact C-N 3.32Å; Q358-I360 PolarHBondContact O-N 2.64Å; Q358-A361 PolarHBondContact O-N 3.11Å; Q358-M362 HydrophobicContact CB-CE 4.33Å; Q358-M362 WeakPolarHBondContact O-CE 3.39Å; Q358-M362 VanDerWaalsContact O-CG 3.29Å; Q358-M362 WeakPolarHBondContact O-CG 3.42Å; Q358-M362 PolarHBondContact O-N 3.42Å
359	I	92.7	Very high	92.5	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-60.3	-44	176.1	-67.3	162	0	0	0	110.5	I351 T355 P356 M362 G363 W364 I368 P373 I376	I351-I359 HydrophobicContact CD1-CD1 4.35Å; I351-I359 HydrophobicContact CG1-CD1 4.25Å; I351-I359 HydrophobicContact CG1-CG1 4.4Å; T355-I359 PolarHBondContact O-N 2.78Å; P356-I359 PolarHBondContact O-N 2.85Å; I359-M362 PolarHBondContact O-N 2.81Å; I359-G363 PolarHBondContact O-N 2.91Å; I359-G363 VanDerWaalsContact O-N 3.12Å; I359-W364 HydrophobicContact CG2-CB 4Å; I359-W364 PolarHBondContact O-N 2.95Å; I359-I368 HydrophobicContact CD1-CD1 3.96Å; I359-I368 HydrophobicContact CG2-CD1 3.62Å; I359-P373 HydrophobicContact CB-CB 4Å; I359-P373 HydrophobicContact CB-CG 4.21Å; I359-P373 HydrophobicContact CD1-CB 4.2Å; I359-P373 HydrophobicContact CG2-CB 3.84Å; I359-P373 HydrophobicContact CG2-CG 3.61Å; I359-I376 HydrophobicContact CD1-CD1 3.8Å
360	I	93.8	Very high	92.6	Very high	93 Å²	93	62.8 Å²	62.8	48%	0.477	35%	0.347	S	S	.	.	H	α-helix	trans	-61.7	-47.1	175.6	-67.7	167.2	0	0	0	110.6	P356 E357 Q358 M362 G363 P373	P356-I360 VanDerWaalsContact O-CG1 3.24Å; P356-I360 WeakPolarHBondContact O-CG1 3.48Å; P356-I360 PolarHBondContact O-N 2.86Å; E357-I360 PolarHBondContact O-N 3.42Å; Q358-I360 VanDerWaalsContact C-N 3.32Å; Q358-I360 PolarHBondContact O-N 2.64Å; I360-M362 VanDerWaalsContact C-N 3.25Å; I360-M362 PolarHBondContact O-N 3.44Å; I360-G363 PolarHBondContact O-N 3.05Å; I360-P373 HydrophobicContact CG1-CB 4.48Å; I360-P373 HydrophobicContact CG1-CG 3.89Å
361	A	95.5	Very high	92.6	Very high	89 Å²	89	62.2 Å²	62.2	74%	0.736	35%	0.353	S	S	*	.	H	α-helix	trans	-62.1	-32.5	-179.9	0	0	0	0	0	112.8	E357 Q358	E357-A361 WeakPolarHBondContact O-CB 3.43Å; E357-A361 PolarHBondContact O-N 2.99Å; Q358-A361 PolarHBondContact O-N 3.11Å
362	M	93.6	Very high	92.7	Very high	69 Å²	69	65.9 Å²	65.9	34%	0.34	37%	0.373	S	S	.	.	H	α-helix	trans	-82.7	-11	176.3	-66.9	-176.4	-67.2	0	0	113.7	Y354 Q358 I359 I360 W364	Y354-M362 HydrophobicContact CD1-CE 3.43Å; Y354-M362 VanDerWaalsContact CD1-CE 3.43Å; Y354-M362 HydrophobicContact CD1-SD 4.31Å; Y354-M362 HydrophobicContact CD2-CE 4.35Å; Y354-M362 HydrophobicContact CE1-CE 3.75Å; Y354-M362 HydrophobicContact CE1-SD 4.09Å; Y354-M362 HydrophobicContact CG-CE 3.75Å; Q358-M362 HydrophobicContact CB-CE 4.33Å; Q358-M362 WeakPolarHBondContact O-CE 3.39Å; Q358-M362 VanDerWaalsContact O-CG 3.29Å; Q358-M362 WeakPolarHBondContact O-CG 3.42Å; Q358-M362 PolarHBondContact O-N 3.42Å; I359-M362 PolarHBondContact O-N 2.81Å; I360-M362 VanDerWaalsContact C-N 3.25Å; I360-M362 PolarHBondContact O-N 3.44Å; M362-W364 VanDerWaalsContact C-N 3.33Å; M362-W364 HydrophobicContact CB-CB 4.42Å; M362-W364 HydrophobicContact CB-CD2 3.83Å; M362-W364 HydrophobicContact CB-CG 3.77Å; M362-W364 HydrophobicContact CE-CD2 3.85Å; M362-W364 HydrophobicContact CE-CE3 3.35Å; M362-W364 HydrophobicContact CE-CH2 4.02Å; M362-W364 HydrophobicContact CE-CZ2 4.46Å; M362-W364 HydrophobicContact CE-CZ3 3.45Å; M362-W364 VanDerWaalsContact CE-CZ3 3.45Å; M362-W364 VanDerWaalsContact O-CD1 3.24Å; M362-W364 HydrophobicContact SD-CD2 4Å; M362-W364 HydrophobicContact SD-CE3 3.89Å; M362-W364 HydrophobicContact SD-CH2 3.57Å; M362-W364 VanDerWaalsContact SD-CH2 3.57Å; M362-W364 HydrophobicContact SD-CZ2 3.69Å; M362-W364 HydrophobicContact SD-CZ3 3.68Å
363	G	92.2	Very high	93	Very high	41 Å²	41	61.3 Å²	61.3	42%	0.423	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	27.9	-175.2	0	0	0	0	0	113.3	I359 I360 N366	I359-G363 PolarHBondContact O-N 2.91Å; I359-G363 VanDerWaalsContact O-N 3.12Å; I360-G363 PolarHBondContact O-N 3.05Å; G363-N366 PolarHBondContact O-OD1 3.03Å
364	W	93	Very high	93	Very high	53 Å²	53	59 Å²	59	20%	0.201	35%	0.349	C	S	.	.			trans	-92.6	10.3	-172.8	-73.9	6	0	0	0	114.2	F300 Y354 I359 M362 N366 K367	F300-W364 HydrophobicContact CB-CZ3 4.48Å; F300-W364 HydrophobicContact CD1-CH2 4.4Å; F300-W364 AromaticContact CD1-CZ3 3.91Å; F300-W364 HydrophobicContact CD1-CZ3 3.91Å; F300-W364 AromaticContact CD2-CH2 3.93Å; F300-W364 HydrophobicContact CD2-CH2 3.93Å; F300-W364 HydrophobicContact CD2-CZ2 4.49Å; F300-W364 HydrophobicContact CD2-CZ3 4.11Å; F300-W364 HydrophobicContact CE1-CH2 4.34Å; F300-W364 HydrophobicContact CE1-CZ3 4.13Å; F300-W364 AromaticContact CE2-CH2 3.87Å; F300-W364 HydrophobicContact CE2-CH2 3.87Å; F300-W364 HydrophobicContact CE2-CZ3 4.34Å; F300-W364 HydrophobicContact CG-CE3 4.46Å; F300-W364 HydrophobicContact CG-CH2 4.21Å; F300-W364 AromaticContact CG-CZ3 3.91Å; F300-W364 HydrophobicContact CG-CZ3 3.91Å; F300-W364 HydrophobicContact CZ-CH2 4.09Å; F300-W364 HydrophobicContact CZ-CZ3 4.35Å; Y354-W364 HydrophobicContact CD2-CZ3 4.11Å; Y354-W364 HydrophobicContact CE1-CZ3 4.39Å; Y354-W364 HydrophobicContact CE2-CH2 4.37Å; Y354-W364 AromaticContact CE2-CZ3 3.66Å; Y354-W364 HydrophobicContact CE2-CZ3 3.66Å; Y354-W364 AromaticContact CZ-CZ3 3.8Å; I359-W364 HydrophobicContact CG2-CB 4Å; I359-W364 PolarHBondContact O-N 2.95Å; M362-W364 VanDerWaalsContact C-N 3.33Å; M362-W364 HydrophobicContact CB-CB 4.42Å; M362-W364 HydrophobicContact CB-CD2 3.83Å; M362-W364 HydrophobicContact CB-CG 3.77Å; M362-W364 HydrophobicContact CE-CD2 3.85Å; M362-W364 HydrophobicContact CE-CE3 3.35Å; M362-W364 HydrophobicContact CE-CH2 4.02Å; M362-W364 HydrophobicContact CE-CZ2 4.46Å; M362-W364 HydrophobicContact CE-CZ3 3.45Å; M362-W364 VanDerWaalsContact CE-CZ3 3.45Å; M362-W364 VanDerWaalsContact O-CD1 3.24Å; M362-W364 HydrophobicContact SD-CD2 4Å; M362-W364 HydrophobicContact SD-CE3 3.89Å; M362-W364 HydrophobicContact SD-CH2 3.57Å; M362-W364 VanDerWaalsContact SD-CH2 3.57Å; M362-W364 HydrophobicContact SD-CZ2 3.69Å; M362-W364 HydrophobicContact SD-CZ3 3.68Å; W364-N366 PolarHBondContact O-N 2.94Å; W364-K367 HydrophobicContact CB-CD 3.95Å; W364-K367 HydrophobicContact CB-CG 4.48Å; W364-K367 HydrophobicContact CD2-CD 4.03Å; W364-K367 HydrophobicContact CG-CD 3.73Å; W364-K367 WeakPolarHBondContact O-CB 3.48Å; W364-K367 PolarHBondContact O-N 3.23Å
365	Q	92.7	Very high	93	Very high	62 Å²	62	60 Å²	60	29%	0.29	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-56.7	-34.8	179.2	-60.6	93.9	-40	0	0	112.3	K367 I368 G371 P373	Q365-K367 PolarHBondContact O-N 2.64Å; Q365-I368 PolarHBondContact O-N 2.92Å; Q365-G371 WeakPolarHBondContact O-CA 3.31Å; Q365-P373 HydrophobicContact CG-CG 3.68Å
366	N	90.8	Very high	92.8	Very high	133 Å²	133	59.2 Å²	59.2	71%	0.711	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-73.7	-7.8	178.5	69.2	-31.2	0	0	0	114.6	G363 W364	G363-N366 PolarHBondContact O-OD1 3.03Å; W364-N366 PolarHBondContact O-N 2.94Å
367	K	90.8	Very high	92.8	Very high	22 Å²	22	58.6 Å²	58.6	10%	0.096	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-88.2	-8.8	172.9	-61.3	178.1	168.6	-83.1	0	112.5	N299 F300 E301 S302 W364 Q365	N299-K367 PolarHBondContact O-NZ 3.47Å; F300-K367 HydrophobicContact CB-CD 4.06Å; E301-K367 IonicContact OE1-NZ 3Å; E301-K367 PolarHBondContact OE1-NZ 3.05Å; S302-K367 VanDerWaalsContact CB-O 3.27Å; S302-K367 WeakPolarHBondContact CB-O 3.38Å; S302-K367 PolarHBondContact N-O 3.31Å; S302-K367 VanDerWaalsContact N-O 3.1Å; S302-K367 PolarHBondContact OG-O 2.86Å; W364-K367 HydrophobicContact CB-CD 3.95Å; W364-K367 HydrophobicContact CB-CG 4.48Å; W364-K367 HydrophobicContact CD2-CD 4.03Å; W364-K367 HydrophobicContact CG-CD 3.73Å; W364-K367 WeakPolarHBondContact O-CB 3.48Å; W364-K367 PolarHBondContact O-N 3.23Å; Q365-K367 PolarHBondContact O-N 2.64Å
368	I	91.4	Very high	92.7	Very high	8 Å²	8	55 Å²	55	4%	0.041	33%	0.328	C	S	.	.	S	Bend	trans	-101.8	136.7	-176.1	-56.8	-178.9	0	0	0	109.5	D347 I351 I359 Q365 S370 G371 P373 I376	D347-I368 WeakPolarHBondContact OD1-CA 3.5Å; D347-I368 VanDerWaalsContact OD2-CG2 3.29Å; D347-I368 WeakPolarHBondContact OD2-CG2 3.32Å; I351-I368 HydrophobicContact CD1-CD1 3.6Å; I351-I368 HydrophobicContact CD1-CG1 3.38Å; I359-I368 HydrophobicContact CD1-CD1 3.96Å; I359-I368 HydrophobicContact CG2-CD1 3.62Å; Q365-I368 PolarHBondContact O-N 2.92Å; I368-S370 VanDerWaalsContact C-N 3.27Å; I368-S370 WeakPolarHBondContact CG2-OG 2.98Å; I368-S370 PolarHBondContact O-N 2.76Å; I368-G371 PolarHBondContact O-N 3.05Å; I368-P373 HydrophobicContact CD1-CB 4.4Å; I368-P373 HydrophobicContact CD1-CG 4.41Å; I368-I376 HydrophobicContact CD1-CG1 4.36Å
369	C	92.1	Very high	92.6	Very high	36 Å²	36	53.1 Å²	53.1	24%	0.243	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-43.8	179.1	-66.1	0	0	0	0	113.6	S302 C345 I346 D347 H377	S302-C369 WeakPolarHBondContact CB-SG 3.37Å; C345-C369 VanDerWaalsContact CA-SG 3.58Å; C345-C369 HydrophobicContact CB-CB 3.6Å; C345-C369 WeakPolarHBondContact CB-SG 3.37Å; C345-C369 PolarHBondContact O-SG 2.76Å; C345-C369 VanDerWaalsContact SG-CA 3.51Å; C345-C369 WeakPolarHBondContact SG-CB 3.16Å; C345-C369 CovalentContact SG-SG 2.03Å; C345-C369 PolarHBondContact SG-SG 2.96Å; I346-C369 VanDerWaalsContact C-SG 3.56Å; I346-C369 PolarHBondContact N-SG 2.83Å; I346-C369 VanDerWaalsContact N-SG 3.35Å; D347-C369 PolarHBondContact OD1-N 3.15Å; D347-C369 PolarHBondContact OD1-SG 3.24Å; C369-H377 HydrophobicContact CB-CB 4.41Å
370	S	92.3	Very high	92.7	Very high	43 Å²	43	55.9 Å²	55.9	30%	0.301	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-19	-178.3	62.1	0	0	0	0	113.5	I368 D372 N375	I368-S370 VanDerWaalsContact C-N 3.27Å; I368-S370 WeakPolarHBondContact CG2-OG 2.98Å; I368-S370 PolarHBondContact O-N 2.76Å; S370-D372 PolarHBondContact O-N 3.16Å; S370-D372 PolarHBondContact OG-N 3.41Å; S370-D372 PolarHBondContact OG-O 2.8Å; S370-N375 VanDerWaalsContact CB-O 3.3Å; S370-N375 WeakPolarHBondContact CB-O 3.25Å; S370-N375 PolarHBondContact OG-O 2.72Å
371	G	91.5	Very high	92.8	Very high	40 Å²	40	55.5 Å²	55.5	41%	0.412	34%	0.337	S	S	.	.	S	Bend	trans	68.1	-1.5	-164.2	0	0	0	0	0	114.5	Q365 I368	Q365-G371 WeakPolarHBondContact O-CA 3.31Å; I368-G371 PolarHBondContact O-N 3.05Å
372	D	93.2	Very high	92.7	Very high	77 Å²	77	52.3 Å²	52.3	41%	0.412	31%	0.307	S	S	.	.			trans	-114	109.6	-177.2	178.1	6.1	0	0	0	109.6	S370 A374 N375	S370-D372 PolarHBondContact O-N 3.16Å; S370-D372 PolarHBondContact OG-N 3.41Å; S370-D372 PolarHBondContact OG-O 2.8Å; D372-A374 PolarHBondContact O-N 2.84Å; D372-A374 WeakPolarHBondContact OD1-CB 3.16Å; D372-A374 PolarHBondContact OD1-N 3.25Å; D372-N375 HydrophobicContact CB-CB 4.17Å; D372-N375 CarbonylContact O-C 3.44Å; D372-N375 PolarHBondContact O-N 3.05Å
373	P	91.9	Very high	92.6	Very high	10 Å²	10	54.2 Å²	54.2	7%	0.065	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-16	179.2	-27.4	38.7	0	0	0	115.2	P356 I359 I360 Q365 I368 N375	P356-P373 HydrophobicContact CB-CB 3.89Å; P356-P373 WeakPolarHBondContact CG-O 3.44Å; I359-P373 HydrophobicContact CB-CB 4Å; I359-P373 HydrophobicContact CB-CG 4.21Å; I359-P373 HydrophobicContact CD1-CB 4.2Å; I359-P373 HydrophobicContact CG2-CB 3.84Å; I359-P373 HydrophobicContact CG2-CG 3.61Å; I360-P373 HydrophobicContact CG1-CB 4.48Å; I360-P373 HydrophobicContact CG1-CG 3.89Å; Q365-P373 HydrophobicContact CG-CG 3.68Å; I368-P373 HydrophobicContact CD1-CB 4.4Å; I368-P373 HydrophobicContact CD1-CG 4.41Å; P373-N375 VanDerWaalsContact C-N 3.32Å
374	A	91.9	Very high	92.5	Very high	81 Å²	81	52.2 Å²	52.2	67%	0.669	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-7.1	172.3	0	0	0	0	0	113.5	D372	D372-A374 PolarHBondContact O-N 2.84Å; D372-A374 WeakPolarHBondContact OD1-CB 3.16Å; D372-A374 PolarHBondContact OD1-N 3.25Å
375	N	92.2	Very high	92.4	Very high	77 Å²	77	52.1 Å²	52.1	41%	0.412	30%	0.297	S	S	.	.	S	Bend	trans	-130.3	68.4	-174.6	-173	13.9	0	0	0	110.5	S370 D372 P373 H377	S370-N375 VanDerWaalsContact CB-O 3.3Å; S370-N375 WeakPolarHBondContact CB-O 3.25Å; S370-N375 PolarHBondContact OG-O 2.72Å; D372-N375 HydrophobicContact CB-CB 4.17Å; D372-N375 CarbonylContact O-C 3.44Å; D372-N375 PolarHBondContact O-N 3.05Å; P373-N375 VanDerWaalsContact C-N 3.32Å; N375-H377 VanDerWaalsContact CG-NE2 3.29Å; N375-H377 PolarHBondContact ND2-NE2 3.38Å; N375-H377 PolarHBondContact O-NE2 2.83Å; N375-H377 PolarHBondContact OD1-CD2 3.48Å; N375-H377 PolarHBondContact OD1-NE2 3.24Å
376	I	92.1	Very high	92.3	Very high	47 Å²	47	49.1 Å²	49.1	24%	0.241	28%	0.284	C	S	.	.			trans	-85.3	131.3	179.7	-62.7	174.7	0	0	0	109.6	D347 I351 I359 I368 M378	D347-I376 HydrophobicContact CB-CG2 3.97Å; I351-I376 HydrophobicContact CG2-CD1 4.43Å; I351-I376 HydrophobicContact CG2-CG2 3.98Å; I359-I376 HydrophobicContact CD1-CD1 3.8Å; I368-I376 HydrophobicContact CD1-CG1 4.36Å; I376-M378 HydrophobicContact CG2-CE 3.14Å; I376-M378 HydrophobicContact CG2-CG 4.23Å; I376-M378 HydrophobicContact CG2-SD 4.48Å
377	H	93.4	Very high	92.4	Very high	32 Å²	32	43 Å²	43	15%	0.148	25%	0.25	C	S	.	.			trans	-104.5	76.3	-173.9	-60.8	159.3	0	0	0	111.1	I346 D347 C369 N375 S379 R380	I346-H377 WeakPolarHBondContact CA-O 3.37Å; D347-H377 PolarHBondContact N-O 2.99Å; D347-H377 PolarHBondContact OD2-N 2.83Å; C369-H377 HydrophobicContact CB-CB 4.41Å; N375-H377 VanDerWaalsContact CG-NE2 3.29Å; N375-H377 PolarHBondContact ND2-NE2 3.38Å; N375-H377 PolarHBondContact O-NE2 2.83Å; N375-H377 PolarHBondContact OD1-CD2 3.48Å; N375-H377 PolarHBondContact OD1-NE2 3.24Å; H377-S379 PolarHBondContact O-N 3.1Å; H377-R380 PolarHBondContact ND1-NH1 3.42Å
378	M	93.5	Very high	92.5	Very high	53 Å²	53	42 Å²	42	26%	0.261	25%	0.246	S	C	.	.	S	Bend	trans	-68.3	-21.1	176.9	-72.1	-63	108.7	0	0	114	D347 I351 D352 I376	D347-M378 HydrophobicContact CB-CE 3.48Å; D347-M378 VanDerWaalsContact CB-CE 3.48Å; I351-M378 HydrophobicContact CG2-CE 3.67Å; D352-M378 HydrophobicContact CB-SD 4.03Å; I376-M378 HydrophobicContact CG2-CE 3.14Å; I376-M378 HydrophobicContact CG2-CG 4.23Å; I376-M378 HydrophobicContact CG2-SD 4.48Å
379	S	95.1	Very high	92.6	Very high	50 Å²	50	41.8 Å²	41.8	35%	0.35	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	161.8	173.6	63.7	0	0	0	0	111.3	Y291 C292 H377	Y291-S379 WeakPolarHBondContact OH-CB 3.38Å; Y291-S379 PolarHBondContact OH-OG 3.41Å; C292-S379 CarbonylContact O-C 3.54Å; C292-S379 WeakPolarHBondContact O-CA 3.06Å; C292-S379 WeakPolarHBondContact O-CB 3.32Å; H377-S379 PolarHBondContact O-N 3.1Å
380	R	95.1	Very high	92.6	Very high	57 Å²	57	40.1 Å²	40.1	22%	0.215	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	137.2	172.5	-71.2	-69.5	-119.8	-83.4	16.6	110.2	Y291 C292 Q344 C345 I346 H377	Y291-R380 CarbonylContact C-O 3.57Å; Y291-R380 WeakPolarHBondContact CA-O 3.28Å; C292-R380 PolarHBondContact N-O 3.12Å; C292-R380 PolarHBondContact O-N 3.46Å; Q344-R380 HydrophobicContact CB-CB 4.27Å; Q344-R380 HydrophobicContact CB-CG 4.27Å; C345-R380 WeakPolarHBondContact O-CG 3.3Å; C345-R380 PolarHBondContact O-NH1 2.93Å; I346-R380 HydrophobicContact CD1-CB 3.7Å; I346-R380 HydrophobicContact CD1-CG 3.53Å; H377-R380 PolarHBondContact ND1-NH1 3.42Å
381	T	95.3	Very high	92.7	Very high	85 Å²	85	39.3 Å²	39.3	52%	0.521	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129	162.9	-50	0	0	0	0	108.3	V290 Y291	V290-T381 VanDerWaalsContact O-CA 3.31Å; V290-T381 WeakPolarHBondContact O-CA 3.43Å; Y291-T381 VanDerWaalsContact CD2-OG1 3.29Å; Y291-T381 WeakPolarHBondContact CD2-OG1 3.43Å
382	F	93.2	Very high	92.7	Very high	23 Å²	23	37.5 Å²	37.5	10%	0.101	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	156.3	177.8	65.8	-77.5	0	0	0	110.3	V290 V305 T342 Q344 A384 F412	V290-F382 HydrophobicContact CB-CD1 4.12Å; V290-F382 HydrophobicContact CB-CE1 3.67Å; V290-F382 HydrophobicContact CB-CE2 4.1Å; V290-F382 HydrophobicContact CB-CZ 3.66Å; V290-F382 HydrophobicContact CG1-CE1 3.69Å; V290-F382 HydrophobicContact CG1-CZ 3.71Å; V290-F382 HydrophobicContact CG2-CE2 4.3Å; V290-F382 HydrophobicContact CG2-CZ 4.2Å; V290-F382 PolarHBondContact N-O 3.25Å; V290-F382 WeakPolarHBondContact O-CD1 3.29Å; V290-F382 PolarHBondContact O-N 3.01Å; V305-F382 HydrophobicContact CG1-CE1 4.19Å; V305-F382 HydrophobicContact CG1-CZ 4.11Å; T342-F382 HydrophobicContact CG2-CE2 3.81Å; T342-F382 HydrophobicContact CG2-CZ 3.82Å; Q344-F382 HydrophobicContact CB-CD1 4.34Å; Q344-F382 HydrophobicContact CB-CE1 4.4Å; Q344-F382 HydrophobicContact CG-CB 3.97Å; Q344-F382 HydrophobicContact CG-CD1 3.45Å; Q344-F382 VanDerWaalsContact CG-CD1 3.45Å; Q344-F382 HydrophobicContact CG-CD2 4.15Å; Q344-F382 HydrophobicContact CG-CE1 3.84Å; Q344-F382 HydrophobicContact CG-CG 3.59Å; Q344-F382 HydrophobicContact CG-CZ 4.35Å; F382-A384 HydrophobicContact CE2-CB 4.17Å; F382-F412 HydrophobicContact CE2-CD1 4.37Å; F382-F412 HydrophobicContact CE2-CE1 4.04Å; F382-F412 AromaticContact CZ-CD1 3.88Å; F382-F412 HydrophobicContact CZ-CD1 3.88Å; F382-F412 HydrophobicContact CZ-CE1 4.02Å
383	L	91	Very high	92.7	Very high	108 Å²	108	38 Å²	38	57%	0.565	20%	0.201	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	110.7	176.4	-165.3	72.3	0	0	0	108.7	K287 I288	K287-L383 HydrophobicContact CB-CD1 4.13Å; K287-L383 HydrophobicContact CB-CD2 4.08Å; K287-L383 HydrophobicContact CB-CG 4.17Å; K287-L383 HydrophobicContact CD-CD2 4.42Å; K287-L383 HydrophobicContact CG-CD2 4.35Å; I288-L383 WeakPolarHBondContact O-CA 3.45Å
384	A	91.1	Very high	92.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	118.8	170.2	0	0	0	0	0	109	I288 V290 Y326 F382 M386 F412	I288-A384 HydrophobicContact CD1-CB 4.42Å; I288-A384 HydrophobicContact CG1-CB 3.83Å; I288-A384 PolarHBondContact N-O 3.23Å; I288-A384 PolarHBondContact O-N 3.07Å; V290-A384 HydrophobicContact CG2-CB 3.88Å; Y326-A384 HydrophobicContact CE2-CB 3.99Å; F382-A384 HydrophobicContact CE2-CB 4.17Å; A384-M386 HydrophobicContact CB-CE 4.01Å; A384-F412 HydrophobicContact CB-CE1 3.83Å; A384-F412 HydrophobicContact CB-CZ 3.52Å
385	R	89.5	Confident	92.7	Very high	50 Å²	50	41.6 Å²	41.6	19%	0.189	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	119.3	176.9	-177.1	-174	177.1	-122	-13.1	109.3	D285 I286 K287 N327 E499 N530	D285-R385 VanDerWaalsContact CG-NE 3.27Å; D285-R385 IonicContact OD1-CZ 3.41Å; D285-R385 VanDerWaalsContact OD1-CZ 3.3Å; D285-R385 IonicContact OD1-NE 3.77Å; D285-R385 PolarHBondContact OD1-NE 3.27Å; D285-R385 IonicContact OD1-NH2 2.7Å; D285-R385 PolarHBondContact OD1-NH2 3.28Å; D285-R385 IonicContact OD2-CZ 3.95Å; D285-R385 IonicContact OD2-NE 3.17Å; D285-R385 PolarHBondContact OD2-NE 3.18Å; D285-R385 IonicContact OD2-NH2 2.84Å; D285-R385 PolarHBondContact OD2-NH2 2.95Å; I286-R385 WeakPolarHBondContact O-CA 3.4Å; K287-R385 HydrophobicContact CG-CG 4.43Å; N327-R385 PolarHBondContact N-O 3.4Å; N327-R385 VanDerWaalsContact N-O 3.09Å; N327-R385 PolarHBondContact OD1-O 2.67Å; R385-E499 IonicContact CZ-OE2 3.93Å; R385-E499 IonicContact NH1-OE2 2.64Å; R385-E499 PolarHBondContact NH1-OE2 2.91Å; R385-E499 IonicContact NH2-OE2 3.12Å; R385-N530 PolarHBondContact NH2-ND2 3.27Å; R385-N530 VanDerWaalsContact NH2-ND2 3.11Å
386	M	91.7	Very high	92.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	162.9	-178.9	69	-175.5	83.2	0	0	112.5	I286 I288 V324 T325 Y326 A384 V410 F412	I286-M386 WeakPolarHBondContact CA-O 3.32Å; I286-M386 HydrophobicContact CB-CG 4.1Å; I286-M386 WeakPolarHBondContact CB-O 3.25Å; I286-M386 HydrophobicContact CG2-CG 4.22Å; I286-M386 PolarHBondContact N-O 3.09Å; I286-M386 PolarHBondContact O-N 2.74Å; I288-M386 HydrophobicContact CD1-CE 3.55Å; I288-M386 HydrophobicContact CG1-CE 4.02Å; V324-M386 HydrophobicContact CG1-CB 3.65Å; V324-M386 HydrophobicContact CG1-CG 4.29Å; V324-M386 HydrophobicContact CG1-SD 4.13Å; T325-M386 CarbonylContact O-C 3.59Å; T325-M386 WeakPolarHBondContact O-CA 3.47Å; Y326-M386 HydrophobicContact CD2-CB 4.19Å; Y326-M386 HydrophobicContact CD2-CE 4.4Å; Y326-M386 HydrophobicContact CE2-CE 4.25Å; A384-M386 HydrophobicContact CB-CE 4.01Å; M386-V410 HydrophobicContact SD-CG2 4.02Å; M386-F412 HydrophobicContact CE-CE2 4.18Å; M386-F412 HydrophobicContact CE-CZ 3.78Å
387	R	92.1	Very high	92.6	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.015	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	144.5	163.5	-81.3	162.9	-76.1	132	2.4	108.9	E282 S283 D284 D285 V324 T325 Y497 E499	E282-R387 HydrophobicContact CG-CB 3.97Å; E282-R387 HydrophobicContact CG-CG 4.48Å; E282-R387 IonicContact OE1-NH1 3.92Å; E282-R387 PolarHBondContact OE1-NH1 3.28Å; E282-R387 IonicContact OE2-NH1 2.77Å; E282-R387 PolarHBondContact OE2-NH1 3.33Å; S283-R387 WeakPolarHBondContact OG-CA 3.12Å; D284-R387 WeakPolarHBondContact O-CG 3.39Å; D285-R387 IonicContact OD1-NE 2.99Å; V324-R387 CarbonylContact C-O 3.57Å; V324-R387 VanDerWaalsContact CA-O 3.27Å; V324-R387 WeakPolarHBondContact CA-O 3.4Å; T325-R387 VanDerWaalsContact CG2-NH2 3.34Å; T325-R387 PolarHBondContact N-O 3.01Å; T325-R387 PolarHBondContact O-N 3.23Å; R387-Y497 VanDerWaalsContact CZ-OH 3.27Å; R387-Y497 PolarHBondContact NH1-OH 3.37Å; R387-Y497 PolarHBondContact NH2-OH 2.9Å; R387-E499 IonicContact CZ-OE1 3.59Å; R387-E499 IonicContact NH2-OE1 3.03Å; R387-E499 PolarHBondContact NH2-OE1 2.89Å
388	L	93.8	Very high	92.2	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	145.3	171.6	-54.9	172.8	0	0	0	108.4	W281 E282 S283 I286 V324 V409 Y429 I431	W281-L388 HydrophobicContact CH2-CB 4.3Å; W281-L388 HydrophobicContact CZ3-CB 3.84Å; E282-L388 CarbonylContact C-O 3.56Å; E282-L388 VanDerWaalsContact CA-O 3.23Å; E282-L388 WeakPolarHBondContact CA-O 3.31Å; E282-L388 WeakPolarHBondContact CG-O 3.34Å; S283-L388 PolarHBondContact N-O 2.7Å; S283-L388 PolarHBondContact OG-N 2.88Å; I286-L388 HydrophobicContact CD1-CD1 3.85Å; I286-L388 HydrophobicContact CD1-CG 3.67Å; V324-L388 HydrophobicContact CG2-CD2 4.23Å; L388-V409 HydrophobicContact CD2-CB 4.34Å; L388-V409 HydrophobicContact CD2-CG1 3.49Å; L388-V409 VanDerWaalsContact CD2-CG1 3.49Å; L388-V409 HydrophobicContact CD2-CG2 4.12Å; L388-Y429 HydrophobicContact CD1-CE1 4.08Å; L388-I431 HydrophobicContact CD1-CG2 3.41Å; L388-I431 VanDerWaalsContact CD1-CG2 3.41Å; L388-I431 HydrophobicContact CD2-CG2 4.14Å; L388-I431 HydrophobicContact CG-CG2 4.35Å
389	Y	93.1	Very high	91.9	Very high	3 Å²	3	46.5 Å²	46.5	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	155.9	170	62.2	-101.2	0	0	0	111.8	K279 W281 L322 G323 V324 T325 D330 Y331 D332 K391	K279-Y389 HydrophobicContact CD-CD1 4.35Å; K279-Y389 HydrophobicContact CD-CD2 4.14Å; K279-Y389 HydrophobicContact CD-CG 3.93Å; K279-Y389 HydrophobicContact CG-CD2 4.12Å; K279-Y389 HydrophobicContact CG-CG 4.37Å; W281-Y389 CarbonylContact O-C 3.6Å; W281-Y389 WeakPolarHBondContact O-CA 3.39Å; W281-Y389 VanDerWaalsContact O-CB 3.3Å; W281-Y389 WeakPolarHBondContact O-CB 3.43Å; L322-Y389 CarbonylContact C-O 3.6Å; G323-Y389 PolarHBondContact N-O 3.33Å; G323-Y389 PolarHBondContact O-N 2.71Å; V324-Y389 VanDerWaalsContact C-CE1 3.41Å; T325-Y389 WeakPolarHBondContact OG1-CD1 3.49Å; D330-Y389 HydrophobicContact CB-CE1 4.17Å; Y331-Y389 PolarHBondContact N-OH 2.88Å; Y331-Y389 PolarHBondContact O-OH 3.45Å; D332-Y389 WeakPolarHBondContact CA-OH 3.22Å; D332-Y389 PolarHBondContact N-OH 3.01Å; D332-Y389 VanDerWaalsContact N-OH 3.13Å; D332-Y389 WeakPolarHBondContact OD1-CE2 3.21Å; D332-Y389 VanDerWaalsContact OD1-CZ 3.27Å; D332-Y389 PolarHBondContact OD1-OH 2.72Å; Y389-K391 HydrophobicContact CD2-CD 4.47Å; Y389-K391 HydrophobicContact CD2-CG 3.99Å; Y389-K391 HydrophobicContact CE2-CD 3.99Å; Y389-K391 HydrophobicContact CE2-CG 4Å
390	V	93.1	Very high	91.7	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	124.4	170.5	-171.5	0	0	0	0	108.2	F268 K279 I280 W281 Y320 L322 L434	F268-V390 HydrophobicContact CE1-CG2 4.11Å; F268-V390 HydrophobicContact CZ-CB 3.98Å; F268-V390 HydrophobicContact CZ-CG1 4.26Å; F268-V390 HydrophobicContact CZ-CG2 3.82Å; K279-V390 CarbonylContact C-O 3.42Å; K279-V390 WeakPolarHBondContact CA-O 3.36Å; I280-V390 HydrophobicContact CD1-CG1 3.99Å; I280-V390 HydrophobicContact CG1-CB 4.18Å; I280-V390 HydrophobicContact CG1-CG1 4.13Å; I280-V390 WeakPolarHBondContact CG1-O 3.42Å; I280-V390 PolarHBondContact N-O 2.96Å; W281-V390 HydrophobicContact CB-CB 4.39Å; W281-V390 HydrophobicContact CE3-CG2 3.93Å; W281-V390 PolarHBondContact N-O 2.94Å; W281-V390 PolarHBondContact O-N 2.79Å; Y320-V390 HydrophobicContact CD1-CG1 4.04Å; Y320-V390 HydrophobicContact CG-CG1 4Å; L322-V390 HydrophobicContact CD2-CG1 4.43Å; L322-V390 HydrophobicContact CD2-CG2 3.83Å; V390-L434 HydrophobicContact CG2-CD2 4.32Å
391	K	93.3	Very high	91.4	Very high	27 Å²	27	49.9 Å²	49.9	12%	0.117	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	148.8	168.3	-75.3	178.5	-179.6	169.2	0	110.4	D278 K279 Y320 Q321 D332 Y389	D278-K391 CarbonylContact O-C 3.43Å; D278-K391 WeakPolarHBondContact O-CA 3.25Å; K279-K391 HydrophobicContact CB-CG 4.44Å; K279-K391 HydrophobicContact CG-CD 4.37Å; K279-K391 HydrophobicContact CG-CG 3.71Å; Y320-K391 CarbonylContact C-O 3.46Å; Q321-K391 HydrophobicContact CB-CB 4.08Å; Q321-K391 HydrophobicContact CG-CB 4.47Å; Q321-K391 PolarHBondContact N-O 2.84Å; Q321-K391 PolarHBondContact O-N 3.34Å; D332-K391 VanDerWaalsContact CG-NZ 3.26Å; D332-K391 WeakPolarHBondContact OD1-CE 3.38Å; D332-K391 IonicContact OD1-NZ 3.6Å; D332-K391 PolarHBondContact OD1-NZ 3.19Å; D332-K391 IonicContact OD2-NZ 3.39Å; D332-K391 PolarHBondContact OD2-NZ 2.78Å; Y389-K391 HydrophobicContact CD2-CD 4.47Å; Y389-K391 HydrophobicContact CD2-CG 3.99Å; Y389-K391 HydrophobicContact CE2-CD 3.99Å; Y389-K391 HydrophobicContact CE2-CG 4Å
392	I	92.1	Very high	91.1	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	131.2	173.1	-164.1	171.3	0	0	0	110.6	V270 A274 K275 P276 G277 D278 I280 E394 M395	V270-I392 HydrophobicContact CG1-CD1 3.73Å; A274-I392 HydrophobicContact CB-CD1 3.85Å; A274-I392 HydrophobicContact CB-CG2 4.44Å; K275-I392 VanDerWaalsContact C-CG2 3.42Å; K275-I392 WeakPolarHBondContact O-CG2 3.46Å; P276-I392 CarbonylContact C-O 3.51Å; P276-I392 WeakPolarHBondContact CA-O 3.36Å; G277-I392 PolarHBondContact N-O 3.08Å; D278-I392 HydrophobicContact CB-CG2 4.16Å; D278-I392 PolarHBondContact O-N 2.96Å; I280-I392 HydrophobicContact CD1-CB 4.25Å; I280-I392 HydrophobicContact CG2-CB 3.96Å; I280-I392 HydrophobicContact CG2-CG2 4.08Å; I392-E394 VanDerWaalsContact CG1-O 3.25Å; I392-E394 WeakPolarHBondContact CG1-O 3.32Å; I392-M395 HydrophobicContact CD1-CG 4.15Å; I392-M395 HydrophobicContact CD1-SD 3.26Å; I392-M395 WeakPolarHBondContact CD1-SD 3.34Å
393	R	92.3	Very high	90.7	Very high	87 Å²	87	50.6 Å²	50.6	33%	0.328	25%	0.251	S	S	.	.	S	Bend	trans	-91.4	-41.5	172.9	-64.1	176.4	176.5	-101	6.1	111	P276 Y319 Y320 Q321	P276-R393 WeakPolarHBondContact CB-O 3.39Å; Y319-R393 WeakPolarHBondContact O-CB 3.17Å; Y319-R393 PolarHBondContact O-N 3.34Å; Y320-R393 WeakPolarHBondContact O-CD 3.36Å; Y320-R393 PolarHBondContact O-NE 2.8Å; Q321-R393 HydrophobicContact CB-CG 3.89Å
394	E	92.7	Very high	90.4	Very high	102 Å²	102	45.8 Å²	45.8	48%	0.477	23%	0.226	S	C	.	.	S	Bend	trans	-155	151.8	179.6	-176.9	177.8	-174.9	0	0	107.3	Y319 I392 P396	Y319-E394 HydrophobicContact CD1-CB 4.02Å; Y319-E394 HydrophobicContact CD1-CG 4.35Å; Y319-E394 HydrophobicContact CE1-CB 4.48Å; Y319-E394 HydrophobicContact CE1-CG 4.38Å; I392-E394 VanDerWaalsContact CG1-O 3.25Å; I392-E394 WeakPolarHBondContact CG1-O 3.32Å; E394-P396 WeakPolarHBondContact O-CD 3.45Å
395	M	91.7	Very high	89.9	Confident	65 Å²	65	49.9 Å²	49.9	32%	0.32	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-64.6	122	174.8	-75.8	-64.6	-74.9	0	0	110	V270 A274 I392 V439	V270-M395 HydrophobicContact CG1-CE 4.5Å; V270-M395 HydrophobicContact CG1-SD 4.22Å; A274-M395 HydrophobicContact CB-SD 3.93Å; I392-M395 HydrophobicContact CD1-CG 4.15Å; I392-M395 HydrophobicContact CD1-SD 3.26Å; I392-M395 WeakPolarHBondContact CD1-SD 3.34Å; M395-V439 HydrophobicContact CE-CG1 3.99Å
396	P	92.2	Very high	89.8	Confident	7 Å²	7	51.2 Å²	51.2	5%	0.045	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-70.3	153.5	173.7	1.9	10.9	0	0	0	110.9	Y319 Y320 E394 Y400 V439	Y319-P396 HydrophobicContact CD1-CB 4.04Å; Y319-P396 HydrophobicContact CD1-CG 4.47Å; Y319-P396 HydrophobicContact CD2-CB 4Å; Y319-P396 HydrophobicContact CE2-CB 4.47Å; Y319-P396 HydrophobicContact CG-CB 3.75Å; Y319-P396 HydrophobicContact CG-CG 4.12Å; Y320-P396 HydrophobicContact CE1-CG 3.8Å; Y320-P396 WeakPolarHBondContact OH-CG 3.2Å; E394-P396 WeakPolarHBondContact O-CD 3.45Å; P396-Y400 HydrophobicContact CB-CD1 3.71Å; P396-Y400 HydrophobicContact CB-CG 3.84Å; P396-Y400 HydrophobicContact CG-CD1 4.36Å; P396-V439 HydrophobicContact CB-CG2 3.9Å; P396-V439 HydrophobicContact CG-CG2 3.61Å
397	P	90.2	Very high	89.7	Confident	56 Å²	56	51.7 Å²	51.7	36%	0.364	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-53.4	150.9	159.3	-23.1	33.1	0	0	0	111.5	Y319 D399 Y400	Y319-P397 WeakPolarHBondContact OH-CD 3.45Å; P397-D399 WeakPolarHBondContact CB-OD1 3.37Å; P397-D399 PolarHBondContact O-N 2.98Å; P397-Y400 WeakPolarHBondContact O-CB 3.41Å; P397-Y400 PolarHBondContact O-N 2.88Å
398	H	85.3	Confident	89.6	Confident	107 Å²	107	53 Å²	53	50%	0.495	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-31.8	-178.9	-69.7	76	0	0	0	115	D441	H398-D441 IonicContact CD2-OD1 2.99Å; H398-D441 IonicContact CD2-OD2 2.79Å; H398-D441 IonicContact CE1-OD1 2.74Å; H398-D441 PolarHBondContact CE1-OD1 2.65Å; H398-D441 VanDerWaalsContact CE1-OD1 3.26Å; H398-D441 IonicContact NE2-OD1 2.63Å; H398-D441 PolarHBondContact NE2-OD1 3.17Å; H398-D441 IonicContact NE2-OD2 3.42Å; H398-D441 PolarHBondContact NE2-OD2 2.75Å; H398-D441 VanDerWaalsContact NE2-OD2 3.11Å
399	D	86.3	Confident	89.5	Confident	141 Å²	141	52.9 Å²	52.9	75%	0.754	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	6.5	-179.7	65.1	-24.4	0	0	0	113.4	P397 Q401	P397-D399 WeakPolarHBondContact CB-OD1 3.37Å; P397-D399 PolarHBondContact O-N 2.98Å; D399-Q401 PolarHBondContact O-N 3.2Å
400	Y	90.1	Very high	89.5	Confident	41 Å²	41	52.8 Å²	52.8	16%	0.161	27%	0.273	C	S	.	.			trans	-66.9	131.7	180	-176.7	-108.7	0	0	0	111.8	D317 Y319 Y320 P396 P397	D317-Y400 VanDerWaalsContact CG-OH 3.27Å; D317-Y400 PolarHBondContact OD1-OH 3.35Å; D317-Y400 PolarHBondContact OD2-OH 3.16Å; Y319-Y400 AromaticContact CD2-CD1 3.71Å; Y319-Y400 HydrophobicContact CD2-CD1 3.71Å; Y319-Y400 AromaticContact CD2-CD2 3.79Å; Y319-Y400 HydrophobicContact CD2-CD2 3.79Å; Y319-Y400 AromaticContact CD2-CE1 3.51Å; Y319-Y400 HydrophobicContact CD2-CE1 3.51Å; Y319-Y400 AromaticContact CD2-CE2 3.62Å; Y319-Y400 HydrophobicContact CD2-CE2 3.62Å; Y319-Y400 AromaticContact CD2-CG 3.84Å; Y319-Y400 HydrophobicContact CD2-CG 3.84Å; Y319-Y400 AromaticContact CD2-CZ 3.47Å; Y319-Y400 VanDerWaalsContact CD2-CZ 3.47Å; Y319-Y400 HydrophobicContact CE2-CD1 4.32Å; Y319-Y400 AromaticContact CE2-CD2 3.59Å; Y319-Y400 HydrophobicContact CE2-CD2 3.59Å; Y319-Y400 HydrophobicContact CE2-CE1 4.3Å; Y319-Y400 AromaticContact CE2-CE2 3.6Å; Y319-Y400 HydrophobicContact CE2-CE2 3.6Å; Y319-Y400 AromaticContact CE2-CG 3.97Å; Y319-Y400 HydrophobicContact CE2-CG 3.97Å; Y319-Y400 AromaticContact CE2-CZ 3.97Å; Y319-Y400 HydrophobicContact CG-CD1 4.46Å; Y319-Y400 HydrophobicContact CG-CE1 4.35Å; Y320-Y400 HydrophobicContact CD2-CE1 4.27Å; Y320-Y400 HydrophobicContact CE2-CD1 4.03Å; Y320-Y400 AromaticContact CE2-CE1 3.76Å; Y320-Y400 HydrophobicContact CE2-CE1 3.76Å; P396-Y400 HydrophobicContact CB-CD1 3.71Å; P396-Y400 HydrophobicContact CB-CG 3.84Å; P396-Y400 HydrophobicContact CG-CD1 4.36Å; P397-Y400 WeakPolarHBondContact O-CB 3.41Å; P397-Y400 PolarHBondContact O-N 2.88Å
401	Q	89	Confident	89.5	Confident	137 Å²	137	52.8 Å²	52.8	64%	0.64	27%	0.273	S	S	*	.			trans	-119.9	132.8	167.1	-67.2	-179	-14.3	0	0	108.7	D399 T403	D399-Q401 PolarHBondContact O-N 3.2Å; Q401-T403 PolarHBondContact O-N 2.03Å
402	S	89.1	Confident	89.6	Confident	9 Å²	9	51.5 Å²	51.5	6%	0.063	27%	0.268	C	S	.	.			trans	-60	137.9	176.3	-174.9	0	0	0	0	110.4	D317 L404 L434	D317-S402 WeakPolarHBondContact OD2-CA 3.39Å; D317-S402 WeakPolarHBondContact OD2-CB 3.41Å; D317-S402 PolarHBondContact OD2-OG 3.44Å; S402-L404 WeakPolarHBondContact OG-CB 3.46Å; S402-L404 PolarHBondContact OG-N 3.43Å; S402-L404 VanDerWaalsContact OG-N 3.15Å; S402-L434 VanDerWaalsContact CB-O 3.28Å; S402-L434 WeakPolarHBondContact CB-O 3.02Å
403	T	85.9	Confident	89.5	Confident	115 Å²	115	51.4 Å²	51.4	71%	0.706	27%	0.267	S	S	*	.	S	Bend	trans	-84.3	-0.5	171.6	60.3	0	0	0	0	112.3	Q401 S405	Q401-T403 PolarHBondContact O-N 2.03Å; T403-S405 PolarHBondContact O-N 2.84Å
404	L	84.9	Confident	89.3	Confident	6 Å²	6	47.3 Å²	47.3	3%	0.031	25%	0.252	C	S	.	.			trans	-83	86.5	177.4	-60.9	-172.4	0	0	0	110.4	V315 D317 L322 S402 Y407 L434	V315-L404 HydrophobicContact CB-CD2 4.46Å; V315-L404 HydrophobicContact CG1-CD2 3.34Å; D317-L404 HydrophobicContact CB-CD1 3.67Å; D317-L404 HydrophobicContact CB-CG 4.03Å; L322-L404 HydrophobicContact CD1-CD1 3.74Å; S402-L404 WeakPolarHBondContact OG-CB 3.46Å; S402-L404 PolarHBondContact OG-N 3.43Å; S402-L404 VanDerWaalsContact OG-N 3.15Å; L404-Y407 HydrophobicContact CD1-CD2 4.32Å; L404-L434 HydrophobicContact CB-CD1 3.61Å; L404-L434 HydrophobicContact CD1-CD1 3.98Å; L404-L434 HydrophobicContact CG-CD1 4.44Å
405	S	80.5	Confident	88.7	Confident	86 Å²	86	44 Å²	44	60%	0.601	24%	0.242	S	C	*	.	S	Bend	trans	-75	-37.1	178.7	59.2	0	0	0	0	113.4	T403 T432	T403-S405 PolarHBondContact O-N 2.84Å; S405-T432 WeakPolarHBondContact O-CA 3.21Å; S405-T432 VanDerWaalsContact O-CB 3.31Å; S405-T432 WeakPolarHBondContact O-CB 3.43Å; S405-T432 WeakPolarHBondContact O-CG2 3.41Å
406	D	86.4	Confident	87.9	Confident	79 Å²	79	44.2 Å²	44.2	42%	0.422	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	124.4	178.7	-178.1	16.5	0	0	0	108.9	H430 T432	D406-H430 VanDerWaalsContact CG-ND1 3.27Å; D406-H430 WeakPolarHBondContact OD1-CB 3.11Å; D406-H430 IonicContact OD1-CE1 2.72Å; D406-H430 IonicContact OD1-CG 2.69Å; D406-H430 IonicContact OD1-ND1 3.29Å; D406-H430 PolarHBondContact OD1-ND1 3.07Å; D406-H430 IonicContact OD2-CE1 3.7Å; D406-H430 IonicContact OD2-ND1 3.83Å; D406-H430 PolarHBondContact OD2-ND1 3.12Å; D406-T432 HydrophobicContact CB-CG2 4.14Å
407	Y	88.7	Confident	87.1	Confident	9 Å²	9	46.9 Å²	46.9	4%	0.035	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	123.3	-173.9	-179.7	-89	0	0	0	111.3	N310 V315 L322 A333 L404 V409 H430 I431	N310-Y407 WeakPolarHBondContact CB-OH 3.49Å; N310-Y407 PolarHBondContact ND2-OH 3.02Å; N310-Y407 PolarHBondContact OD1-OH 3.31Å; V315-Y407 HydrophobicContact CB-CD2 4.48Å; V315-Y407 WeakPolarHBondContact O-CE2 3.49Å; L322-Y407 HydrophobicContact CB-CE1 4.22Å; L322-Y407 HydrophobicContact CD1-CD1 3.32Å; L322-Y407 HydrophobicContact CD1-CD2 3.9Å; L322-Y407 HydrophobicContact CD1-CE1 3.53Å; L322-Y407 HydrophobicContact CD1-CE2 4.11Å; L322-Y407 HydrophobicContact CD1-CG 3.5Å; L322-Y407 VanDerWaalsContact CD1-CG 3.5Å; A333-Y407 VanDerWaalsContact CB-OH 3.22Å; A333-Y407 WeakPolarHBondContact CB-OH 3.44Å; L404-Y407 HydrophobicContact CD1-CD2 4.32Å; Y407-V409 HydrophobicContact CD1-CB 4.08Å; Y407-V409 HydrophobicContact CD1-CG2 4.49Å; Y407-V409 HydrophobicContact CE1-CB 4.03Å; Y407-V409 HydrophobicContact CE1-CG2 4.1Å; Y407-V409 PolarHBondContact O-N 3.17Å; Y407-H430 CarbonylContact O-C 3.5Å; Y407-H430 WeakPolarHBondContact O-CA 3.5Å; Y407-I431 HydrophobicContact CD1-CD1 3.95Å; Y407-I431 HydrophobicContact CD1-CG1 4.03Å; Y407-I431 HydrophobicContact CG-CG1 4.41Å; Y407-I431 PolarHBondContact N-O 3.4Å; Y407-I431 PolarHBondContact O-N 3.42Å
408	I	90.6	Very high	86.7	Confident	32 Å²	32	44.5 Å²	44.5	16%	0.164	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	109.9	175.3	-56.2	168.1	0	0	0	108.5	P311 Y312 K428 Y429 H430	P311-I408 WeakPolarHBondContact CD-O 3.49Å; P311-I408 HydrophobicContact CG-CB 4.2Å; P311-I408 HydrophobicContact CG-CG2 3.51Å; Y312-I408 HydrophobicContact CD2-CB 3.93Å; Y312-I408 HydrophobicContact CD2-CD1 3.68Å; Y312-I408 HydrophobicContact CD2-CG1 4.34Å; Y312-I408 HydrophobicContact CD2-CG2 4.27Å; Y312-I408 HydrophobicContact CE2-CB 4.1Å; Y312-I408 HydrophobicContact CE2-CD1 3.35Å; Y312-I408 HydrophobicContact CE2-CG1 4.31Å; Y312-I408 HydrophobicContact CE2-CG2 4.06Å; I408-K428 HydrophobicContact CD1-CD 4.04Å; I408-K428 HydrophobicContact CD1-CG 4.45Å; I408-K428 HydrophobicContact CG2-CB 3.93Å; I408-K428 HydrophobicContact CG2-CG 4.17Å; I408-Y429 CarbonylContact C-O 3.54Å; I408-Y429 WeakPolarHBondContact CA-O 3.46Å; I408-H430 WeakPolarHBondContact CG1-CE1 3.32Å; I408-H430 WeakPolarHBondContact CG1-NE2 3.27Å
409	V	91.4	Very high	86.5	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-34.9	-176.5	75.5	0	0	0	0	112.5	V309 N310 V324 L388 Y407 Y429 I431	V309-V409 VanDerWaalsContact CA-O 3.31Å; V309-V409 WeakPolarHBondContact CA-O 3.34Å; N310-V409 PolarHBondContact N-O 2.97Å; V324-V409 HydrophobicContact CG2-CB 4.39Å; V324-V409 HydrophobicContact CG2-CG1 4.31Å; V324-V409 HydrophobicContact CG2-CG2 3.36Å; L388-V409 HydrophobicContact CD2-CB 4.34Å; L388-V409 HydrophobicContact CD2-CG1 3.49Å; L388-V409 VanDerWaalsContact CD2-CG1 3.49Å; L388-V409 HydrophobicContact CD2-CG2 4.12Å; Y407-V409 HydrophobicContact CD1-CB 4.08Å; Y407-V409 HydrophobicContact CD1-CG2 4.49Å; Y407-V409 HydrophobicContact CE1-CB 4.03Å; Y407-V409 HydrophobicContact CE1-CG2 4.1Å; Y407-V409 PolarHBondContact O-N 3.17Å; V409-Y429 HydrophobicContact CG1-CD1 3.87Å; V409-Y429 WeakPolarHBondContact CG1-O 2.83Å; V409-Y429 PolarHBondContact N-O 3.5Å; V409-I431 HydrophobicContact CB-CG2 4.2Å; V409-I431 HydrophobicContact CG1-CG2 3.87Å
410	V	93.4	Very high	86.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	138.9	177.2	-179	0	0	0	0	110	A307 W308 V309 V324 M386 F412 K428 Y429	A307-V410 HydrophobicContact CB-CG1 3.96Å; W308-V410 CarbonylContact O-C 3.52Å; W308-V410 VanDerWaalsContact O-CA 3.3Å; W308-V410 WeakPolarHBondContact O-CA 3.08Å; V309-V410 HydrophobicContact CG2-CG2 4.19Å; V324-V410 HydrophobicContact CB-CG2 4.48Å; V324-V410 HydrophobicContact CG1-CG2 4.25Å; V324-V410 HydrophobicContact CG2-CG2 3.72Å; M386-V410 HydrophobicContact SD-CG2 4.02Å; V410-F412 HydrophobicContact CG1-CD2 4.16Å; V410-F412 HydrophobicContact CG1-CE2 3.72Å; V410-F412 HydrophobicContact CG1-CZ 3.99Å; V410-K428 CarbonylContact O-C 3.55Å; V410-K428 WeakPolarHBondContact O-CA 3.38Å; V410-Y429 PolarHBondContact O-N 2.81Å
411	Q	94.1	Very high	85.9	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.5	162.6	179.2	171.1	-45.8	0	0	109.3	W308 P311 Y312 D413 V418 N419 N426 L427 K428	W308-Q411 WeakPolarHBondContact CB-O 3.34Å; W308-Q411 PolarHBondContact N-O 2.66Å; W308-Q411 PolarHBondContact O-N 3.44Å; P311-Q411 HydrophobicContact CB-CB 3.87Å; P311-Q411 HydrophobicContact CG-CB 3.79Å; Y312-Q411 PolarHBondContact OH-OE1 3.27Å; Q411-D413 PolarHBondContact NE2-OD2 2.84Å; Q411-V418 VanDerWaalsContact NE2-CG1 3.3Å; Q411-N419 PolarHBondContact NE2-O 3.33Å; Q411-N426 HydrophobicContact CG-CB 3.89Å; Q411-L427 CarbonylContact C-O 3.5Å; Q411-L427 WeakPolarHBondContact CA-O 3.18Å; Q411-K428 HydrophobicContact CB-CG 4.25Å; Q411-K428 HydrophobicContact CG-CG 3.98Å
412	F	94.3	Very high	85.3	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	123.6	171.7	-65.2	-91.3	0	0	0	109.3	C250 I288 V290 Y306 A307 Y326 T342 F382 A384 M386 V410 N426 L427	C250-F412 HydrophobicContact CB-CB 3.88Å; I288-F412 HydrophobicContact CD1-CE2 3.7Å; I288-F412 HydrophobicContact CD1-CZ 4.06Å; V290-F412 HydrophobicContact CG1-CB 4.11Å; V290-F412 HydrophobicContact CG1-CD1 4.03Å; V290-F412 HydrophobicContact CG1-CD2 4.28Å; V290-F412 HydrophobicContact CG1-CG 3.87Å; V290-F412 HydrophobicContact CG2-CD1 4.23Å; V290-F412 HydrophobicContact CG2-CD2 4.15Å; V290-F412 HydrophobicContact CG2-CE1 3.94Å; V290-F412 HydrophobicContact CG2-CE2 3.9Å; V290-F412 HydrophobicContact CG2-CG 4.32Å; V290-F412 HydrophobicContact CG2-CZ 3.78Å; Y306-F412 WeakPolarHBondContact O-CA 3.44Å; A307-F412 HydrophobicContact CB-CD1 3.95Å; A307-F412 HydrophobicContact CB-CE1 3.63Å; A307-F412 HydrophobicContact CB-CZ 4.22Å; Y326-F412 HydrophobicContact CE2-CE1 4.28Å; Y326-F412 HydrophobicContact CE2-CZ 4.31Å; T342-F412 HydrophobicContact CG2-CD1 4.31Å; T342-F412 HydrophobicContact CG2-CE1 4.33Å; F382-F412 HydrophobicContact CE2-CD1 4.37Å; F382-F412 HydrophobicContact CE2-CE1 4.04Å; F382-F412 AromaticContact CZ-CD1 3.88Å; F382-F412 HydrophobicContact CZ-CD1 3.88Å; F382-F412 HydrophobicContact CZ-CE1 4.02Å; A384-F412 HydrophobicContact CB-CE1 3.83Å; A384-F412 HydrophobicContact CB-CZ 3.52Å; M386-F412 HydrophobicContact CE-CE2 4.18Å; M386-F412 HydrophobicContact CE-CZ 3.78Å; V410-F412 HydrophobicContact CG1-CD2 4.16Å; V410-F412 HydrophobicContact CG1-CE2 3.72Å; V410-F412 HydrophobicContact CG1-CZ 3.99Å; F412-N426 WeakPolarHBondContact O-CB 3.28Å; F412-L427 HydrophobicContact CB-CB 4.42Å; F412-L427 HydrophobicContact CD2-CB 4.21Å; F412-L427 HydrophobicContact CD2-CD2 4Å; F412-L427 HydrophobicContact CD2-CG 4.14Å; F412-L427 HydrophobicContact CE2-CD2 4.35Å; F412-L427 PolarHBondContact N-O 3.31Å
413	D	90.9	Very high	85	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	176.5	-171.1	-145.2	-36.9	0	0	0	111.2	Y306 Q411 V418 N419 N426	Y306-D413 PolarHBondContact N-O 2.94Å; Y306-D413 PolarHBondContact O-N 2.95Å; Q411-D413 PolarHBondContact NE2-OD2 2.84Å; D413-V418 WeakPolarHBondContact OD2-CA 3.36Å; D413-N419 PolarHBondContact OD2-N 2.85Å; D413-N426 VanDerWaalsContact CG-ND2 3.34Å; D413-N426 PolarHBondContact OD1-ND2 2.99Å; D413-N426 PolarHBondContact OD1-OD1 2.78Å; D413-N426 PolarHBondContact OD2-ND2 2.81Å
414	G	87.8	Confident	84.9	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.01	26%	0.256	C	S	.	.			trans	-68.1	-179	173.6	0	0	0	0	0	115	E303 W308	E303-G414 WeakPolarHBondContact OE1-CA 3.24Å; W308-G414 PolarHBondContact NE1-O 2.91Å; W308-G414 VanDerWaalsContact NE1-O 3.08Å
415	A	80.8	Confident	85.3	Confident	31 Å²	31	43.7 Å²	43.7	26%	0.256	27%	0.273	S	S	.	.	S	Bend	trans	-76.6	-27.4	-171.8	0	0	0	0	0	113.9	E303 H304 Y306 R339	E303-A415 HydrophobicContact CG-CB 4.48Å; E303-A415 PolarHBondContact OE1-N 2.81Å; H304-A415 PolarHBondContact O-N 3.03Å; Y306-A415 HydrophobicContact CD2-CB 3.92Å; Y306-A415 HydrophobicContact CE2-CB 3.5Å; Y306-A415 VanDerWaalsContact CE2-CB 3.5Å; R339-A415 PolarHBondContact NH1-O 3.01Å; R339-A415 VanDerWaalsContact NH1-O 3.11Å
416	G	73.4	Confident	85.8	Confident	71 Å²	71	39.6 Å²	39.6	73%	0.732	24%	0.244	S	C	*	.	S	Bend	trans	-69.2	-53.7	-169.7	0	0	0	0	0	113.4
417	S	75.6	Confident	86.2	Confident	62 Å²	62	35.9 Å²	35.9	43%	0.434	22%	0.224	S	C	.	.			trans	-172	165.2	175.2	178	0	0	0	0	108.2	N419	S417-N419 PolarHBondContact O-N 2.83Å
418	V	82.5	Confident	86.4	Confident	6 Å²	6	36.2 Å²	36.2	4%	0.036	23%	0.226	C	C	.	.			trans	-54.9	122.8	158.7	177.5	0	0	0	0	108.8	W308 P311 K337 Q411 D413 E420	W308-V418 HydrophobicContact CB-CG2 3.43Å; W308-V418 VanDerWaalsContact CB-CG2 3.43Å; W308-V418 HydrophobicContact CD2-CG2 3.58Å; W308-V418 HydrophobicContact CE3-CG2 3.93Å; W308-V418 HydrophobicContact CG-CG2 3.38Å; P311-V418 HydrophobicContact CB-CB 4.31Å; P311-V418 HydrophobicContact CB-CG1 3.62Å; P311-V418 HydrophobicContact CB-CG2 3.74Å; K337-V418 HydrophobicContact CD-CB 4.14Å; K337-V418 HydrophobicContact CD-CG2 3.73Å; Q411-V418 VanDerWaalsContact NE2-CG1 3.3Å; D413-V418 WeakPolarHBondContact OD2-CA 3.36Å; V418-E420 HydrophobicContact CG1-CG 4.2Å
419	N	81.5	Confident	86.5	Confident	30 Å²	30	35 Å²	35	16%	0.16	22%	0.219	C	C	.	.			trans	-83.7	114.1	168.6	-178.1	-4.5	0	0	0	108.4	Q411 D413 S417 D421 A424 N426	Q411-N419 PolarHBondContact NE2-O 3.33Å; D413-N419 PolarHBondContact OD2-N 2.85Å; S417-N419 PolarHBondContact O-N 2.83Å; N419-D421 VanDerWaalsContact OD1-CB 3.24Å; N419-D421 WeakPolarHBondContact OD1-CB 3.36Å; N419-D421 PolarHBondContact OD1-N 3.15Å; N419-D421 VanDerWaalsContact OD1-N 3.08Å; N419-A424 HydrophobicContact CB-CB 4.23Å; N419-A424 VanDerWaalsContact CG-CB 3.48Å; N419-A424 VanDerWaalsContact ND2-CB 3.3Å; N419-A424 WeakPolarHBondContact ND2-CB 3.44Å; N419-N426 WeakPolarHBondContact CB-ND2 3.49Å
420	E	83	Confident	86.5	Confident	109 Å²	109	35.9 Å²	35.9	51%	0.509	22%	0.223	S	C	.	.			trans	-92.1	0.3	-175.5	-56.9	-176.5	-171.4	0	0	112.3	Y312 K337 V418 P422	Y312-E420 HydrophobicContact CD1-CG 4.26Å; Y312-E420 HydrophobicContact CE1-CB 3.93Å; Y312-E420 HydrophobicContact CE1-CG 3.64Å; K337-E420 IonicContact NZ-OE1 2.76Å; K337-E420 PolarHBondContact NZ-OE1 2.79Å; V418-E420 HydrophobicContact CG1-CG 4.2Å; E420-P422 WeakPolarHBondContact O-CD 3.35Å
421	D	79.5	Confident	86.4	Confident	75 Å²	75	36 Å²	36	40%	0.401	22%	0.224	S	C	.	.			trans	-62.8	124.1	176.1	-171.4	-37.1	0	0	0	109.5	N419 T423 A424	N419-D421 VanDerWaalsContact OD1-CB 3.24Å; N419-D421 WeakPolarHBondContact OD1-CB 3.36Å; N419-D421 PolarHBondContact OD1-N 3.15Å; N419-D421 VanDerWaalsContact OD1-N 3.08Å; D421-T423 VanDerWaalsContact CG-OG1 3.27Å; D421-T423 PolarHBondContact O-N 2.91Å; D421-T423 VanDerWaalsContact O-N 3.09Å; D421-T423 WeakPolarHBondContact OD1-CB 3.4Å; D421-T423 PolarHBondContact OD1-N 3.02Å; D421-T423 PolarHBondContact OD1-OG1 2.76Å; D421-T423 PolarHBondContact OD2-OG1 2.87Å; D421-A424 HydrophobicContact CB-CB 4.15Å; D421-A424 WeakPolarHBondContact O-CB 3.49Å; D421-A424 PolarHBondContact O-N 3.05Å
422	P	76.4	Confident	86.2	Confident	116 Å²	116	37.6 Å²	37.6	75%	0.753	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-21	178.4	-24.4	34.3	0	0	0	114.3	E420	E420-P422 WeakPolarHBondContact O-CD 3.35Å
423	T	82.4	Confident	86	Confident	114 Å²	114	37.7 Å²	37.7	70%	0.699	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-9.9	177	70.1	0	0	0	0	113.1	D421	D421-T423 VanDerWaalsContact CG-OG1 3.27Å; D421-T423 PolarHBondContact O-N 2.91Å; D421-T423 VanDerWaalsContact O-N 3.09Å; D421-T423 WeakPolarHBondContact OD1-CB 3.4Å; D421-T423 PolarHBondContact OD1-N 3.02Å; D421-T423 PolarHBondContact OD1-OG1 2.76Å; D421-T423 PolarHBondContact OD2-OG1 2.87Å
424	A	85.8	Confident	85.9	Confident	15 Å²	15	37.7 Å²	37.7	12%	0.124	23%	0.234	C	C	.	.	S	Bend	trans	-66.1	134.6	175.4	0	0	0	0	0	110.5	N419 D421 N426	N419-A424 HydrophobicContact CB-CB 4.23Å; N419-A424 VanDerWaalsContact CG-CB 3.48Å; N419-A424 VanDerWaalsContact ND2-CB 3.3Å; N419-A424 WeakPolarHBondContact ND2-CB 3.44Å; D421-A424 HydrophobicContact CB-CB 4.15Å; D421-A424 WeakPolarHBondContact O-CB 3.49Å; D421-A424 PolarHBondContact O-N 3.05Å; A424-N426 VanDerWaalsContact C-N 3.3Å; A424-N426 PolarHBondContact O-N 2.95Å; A424-N426 VanDerWaalsContact O-N 3.07Å
425	Q	91.8	Very high	85.9	Confident	81 Å²	81	41 Å²	41	38%	0.379	25%	0.249	S	C	.	.			trans	-90.4	70.7	-176.4	-66.8	173.8	-17	0	0	109.6	N249 C250 Y251 V259	N249-Q425 CarbonylContact C-O 3.52Å; N249-Q425 WeakPolarHBondContact CA-O 3.42Å; N249-Q425 HydrophobicContact CB-CB 3.86Å; N249-Q425 VanDerWaalsContact CG-OE1 3.3Å; N249-Q425 PolarHBondContact ND2-OE1 2.91Å; C250-Q425 PolarHBondContact N-O 2.89Å; C250-Q425 CarbonylContact O-C 3.48Å; C250-Q425 VanDerWaalsContact O-O 3.09Å; Y251-Q425 HydrophobicContact CE1-CB 3.74Å; Y251-Q425 HydrophobicContact CE1-CG 4.08Å; Y251-Q425 PolarHBondContact OH-OE1 2.97Å; V259-Q425 HydrophobicContact CG1-CB 4.16Å
426	N	91.2	Very high	86.2	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	26%	0.256	C	S	.	.			trans	-120.3	123.1	-178.9	-68.6	-40.2	0	0	0	110.7	L248 C250 Q411 F412 D413 N419 A424 K428	L248-N426 PolarHBondContact O-OD1 2.82Å; C250-N426 CarbonylContact O-C 3.51Å; Q411-N426 HydrophobicContact CG-CB 3.89Å; F412-N426 WeakPolarHBondContact O-CB 3.28Å; D413-N426 VanDerWaalsContact CG-ND2 3.34Å; D413-N426 PolarHBondContact OD1-ND2 2.99Å; D413-N426 PolarHBondContact OD1-OD1 2.78Å; D413-N426 PolarHBondContact OD2-ND2 2.81Å; N419-N426 WeakPolarHBondContact CB-ND2 3.49Å; A424-N426 VanDerWaalsContact C-N 3.3Å; A424-N426 PolarHBondContact O-N 2.95Å; A424-N426 VanDerWaalsContact O-N 3.07Å; N426-K428 PolarHBondContact O-N 2.83Å; N426-K428 VanDerWaalsContact O-N 3.13Å
427	L	94.8	Very high	87.1	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.223	C	C	.	.			trans	-63.3	114.7	-178.6	177.3	61.7	0	0	0	110.6	C250 F252 V259 K261 I288 V290 Q411 F412	C250-L427 HydrophobicContact CB-CB 4.26Å; C250-L427 PolarHBondContact O-N 2.98Å; F252-L427 HydrophobicContact CB-CD1 3.88Å; F252-L427 HydrophobicContact CB-CD2 4.37Å; V259-L427 CarbonylContact O-C 3.51Å; V259-L427 VanDerWaalsContact O-CA 3.3Å; V259-L427 WeakPolarHBondContact O-CA 3.44Å; K261-L427 HydrophobicContact CB-CD1 4.23Å; I288-L427 HydrophobicContact CD1-CD2 4.38Å; V290-L427 HydrophobicContact CB-CD2 4.41Å; V290-L427 HydrophobicContact CG1-CD2 4.12Å; V290-L427 HydrophobicContact CG2-CD2 3.92Å; Q411-L427 CarbonylContact C-O 3.5Å; Q411-L427 WeakPolarHBondContact CA-O 3.18Å; F412-L427 HydrophobicContact CB-CB 4.42Å; F412-L427 HydrophobicContact CD2-CB 4.21Å; F412-L427 HydrophobicContact CD2-CD2 4Å; F412-L427 HydrophobicContact CD2-CG 4.14Å; F412-L427 HydrophobicContact CE2-CD2 4.35Å; F412-L427 PolarHBondContact N-O 3.31Å
428	K	93.6	Very high	87.8	Confident	17 Å²	17	41.7 Å²	41.7	7%	0.074	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135.8	174.7	-65.4	157.7	-169.2	171.2	0	109.9	V259 E260 K261 I408 V410 Q411 N426	V259-K428 PolarHBondContact O-N 2.82Å; E260-K428 IonicContact OE1-NZ 3.03Å; E260-K428 WeakPolarHBondContact OE2-CB 3.46Å; K261-K428 PolarHBondContact N-O 2.44Å; I408-K428 HydrophobicContact CD1-CD 4.04Å; I408-K428 HydrophobicContact CD1-CG 4.45Å; I408-K428 HydrophobicContact CG2-CB 3.93Å; I408-K428 HydrophobicContact CG2-CG 4.17Å; V410-K428 CarbonylContact O-C 3.55Å; V410-K428 WeakPolarHBondContact O-CA 3.38Å; Q411-K428 HydrophobicContact CB-CG 4.25Å; Q411-K428 HydrophobicContact CG-CG 3.98Å; N426-K428 PolarHBondContact O-N 2.83Å; N426-K428 VanDerWaalsContact O-N 3.13Å
429	Y	93.1	Very high	88.2	Confident	7 Å²	7	42 Å²	42	3%	0.027	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	113.8	173.5	-155.4	-86.4	0	0	0	109.3	K261 E263 I286 I288 L388 I408 V409 V410 I431	K261-Y429 HydrophobicContact CB-CD2 4.03Å; K261-Y429 HydrophobicContact CB-CE2 4.29Å; K261-Y429 HydrophobicContact CG-CD2 3.76Å; K261-Y429 HydrophobicContact CG-CE2 3.51Å; K261-Y429 CarbonylContact O-C 3.55Å; K261-Y429 WeakPolarHBondContact O-CA 3.35Å; E263-Y429 HydrophobicContact CB-CE1 3.98Å; E263-Y429 PolarHBondContact OE2-OH 2.87Å; I286-Y429 HydrophobicContact CD1-CE1 4.48Å; I286-Y429 HydrophobicContact CG2-CE2 4.17Å; I286-Y429 WeakPolarHBondContact CG2-OH 3.1Å; I288-Y429 HydrophobicContact CD1-CD2 3.92Å; I288-Y429 HydrophobicContact CD1-CE2 4.33Å; I288-Y429 HydrophobicContact CG2-CD2 4.42Å; I288-Y429 HydrophobicContact CG2-CE2 3.82Å; L388-Y429 HydrophobicContact CD1-CE1 4.08Å; I408-Y429 CarbonylContact C-O 3.54Å; I408-Y429 WeakPolarHBondContact CA-O 3.46Å; V409-Y429 HydrophobicContact CG1-CD1 3.87Å; V409-Y429 WeakPolarHBondContact CG1-O 2.83Å; V409-Y429 PolarHBondContact N-O 3.5Å; V410-Y429 PolarHBondContact O-N 2.81Å; Y429-I431 HydrophobicContact CD1-CG2 4.49Å
430	H	91.6	Very high	88.6	Confident	18 Å²	18	40.6 Å²	40.6	8%	0.083	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	144.1	-178.3	-72.7	-112.5	0	0	0	110.8	E260 K261 S262 E263 D406 Y407 I408	E260-H430 IonicContact OE2-CD2 2.69Å; E260-H430 PolarHBondContact OE2-CD2 3.42Å; E260-H430 IonicContact OE2-CE1 3.82Å; E260-H430 IonicContact OE2-NE2 3.33Å; E260-H430 PolarHBondContact OE2-NE2 3.47Å; K261-H430 PolarHBondContact O-N 3.27Å; S262-H430 WeakPolarHBondContact CA-O 2.98Å; E263-H430 PolarHBondContact N-O 3.32Å; D406-H430 VanDerWaalsContact CG-ND1 3.27Å; D406-H430 WeakPolarHBondContact OD1-CB 3.11Å; D406-H430 IonicContact OD1-CE1 2.72Å; D406-H430 IonicContact OD1-CG 2.69Å; D406-H430 IonicContact OD1-ND1 3.29Å; D406-H430 PolarHBondContact OD1-ND1 3.07Å; D406-H430 IonicContact OD2-CE1 3.7Å; D406-H430 IonicContact OD2-ND1 3.83Å; D406-H430 PolarHBondContact OD2-ND1 3.12Å; Y407-H430 CarbonylContact O-C 3.5Å; Y407-H430 WeakPolarHBondContact O-CA 3.5Å; I408-H430 WeakPolarHBondContact CG1-CE1 3.32Å; I408-H430 WeakPolarHBondContact CG1-NE2 3.27Å
431	I	90	Very high	88.8	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	135	168.5	72.4	179.6	0	0	0	108.7	E263 I265 L322 L388 Y407 V409 Y429 L434	E263-I431 WeakPolarHBondContact O-CA 3.19Å; I265-I431 HydrophobicContact CD1-CB 4.05Å; I265-I431 HydrophobicContact CD1-CD1 3.96Å; I265-I431 HydrophobicContact CD1-CG1 4.33Å; I265-I431 HydrophobicContact CG1-CB 4.45Å; L322-I431 HydrophobicContact CD1-CD1 3.64Å; L322-I431 HydrophobicContact CD2-CD1 3.82Å; L322-I431 HydrophobicContact CG-CD1 4.19Å; L388-I431 HydrophobicContact CD1-CG2 3.41Å; L388-I431 VanDerWaalsContact CD1-CG2 3.41Å; L388-I431 HydrophobicContact CD2-CG2 4.14Å; L388-I431 HydrophobicContact CG-CG2 4.35Å; Y407-I431 HydrophobicContact CD1-CD1 3.95Å; Y407-I431 HydrophobicContact CD1-CG1 4.03Å; Y407-I431 HydrophobicContact CG-CG1 4.41Å; Y407-I431 PolarHBondContact N-O 3.4Å; Y407-I431 PolarHBondContact O-N 3.42Å; V409-I431 HydrophobicContact CB-CG2 4.2Å; V409-I431 HydrophobicContact CG1-CG2 3.87Å; Y429-I431 HydrophobicContact CD1-CG2 4.49Å; I431-L434 HydrophobicContact CD1-CD1 4.26Å; I431-L434 HydrophobicContact CG1-CD1 4.45Å
432	T	90.3	Very high	89.3	Confident	34 Å²	34	34.1 Å²	34.1	21%	0.209	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	171.9	175.9	67.4	0	0	0	0	109.5	E263 V264 I265 S405 D406	E263-T432 PolarHBondContact O-N 2.78Å; E263-T432 VanDerWaalsContact O-N 3.09Å; V264-T432 WeakPolarHBondContact CG2-OG1 3.3Å; I265-T432 WeakPolarHBondContact CB-O 3.48Å; I265-T432 PolarHBondContact N-O 3.01Å; S405-T432 WeakPolarHBondContact O-CA 3.21Å; S405-T432 VanDerWaalsContact O-CB 3.31Å; S405-T432 WeakPolarHBondContact O-CB 3.43Å; S405-T432 WeakPolarHBondContact O-CG2 3.41Å; D406-T432 HydrophobicContact CB-CG2 4.14Å
433	G	89.6	Confident	90	Very high	1 Å²	1	29 Å²	29	1%	0.01	15%	0.15	C	C	.	.			trans	92.3	6	174.3	0	0	0	0	0	115.1	E435 N436	G433-E435 WeakPolarHBondContact CA-OE1 3.4Å; G433-E435 WeakPolarHBondContact CA-OE2 3.31Å; G433-E435 PolarHBondContact N-OE2 2.98Å; G433-E435 PolarHBondContact O-N 3.11Å; G433-N436 WeakPolarHBondContact O-CB 3.44Å; G433-N436 PolarHBondContact O-N 2.72Å; G433-N436 VanDerWaalsContact O-N 3.09Å; G433-N436 PolarHBondContact O-ND2 3.41Å
434	L	88.6	Confident	90.4	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-66.5	-17.8	178.5	-64.8	169.5	0	0	0	112.8	I265 L322 V390 S402 L404 I431 N436 I437	I265-L434 HydrophobicContact CD1-CD2 3.63Å; I265-L434 HydrophobicContact CD1-CG 4.29Å; L322-L434 HydrophobicContact CD1-CD1 3.92Å; L322-L434 HydrophobicContact CD2-CD1 3.95Å; L322-L434 HydrophobicContact CD2-CD2 3.89Å; L322-L434 HydrophobicContact CG-CD1 4.49Å; V390-L434 HydrophobicContact CG2-CD2 4.32Å; S402-L434 VanDerWaalsContact CB-O 3.28Å; S402-L434 WeakPolarHBondContact CB-O 3.02Å; L404-L434 HydrophobicContact CB-CD1 3.61Å; L404-L434 HydrophobicContact CD1-CD1 3.98Å; L404-L434 HydrophobicContact CG-CD1 4.44Å; I431-L434 HydrophobicContact CD1-CD1 4.26Å; I431-L434 HydrophobicContact CG1-CD1 4.45Å; L434-N436 PolarHBondContact O-N 2.96Å; L434-I437 HydrophobicContact CB-CD1 4.28Å; L434-I437 HydrophobicContact CD2-CD1 3.87Å; L434-I437 WeakPolarHBondContact O-CD1 3.32Å; L434-I437 VanDerWaalsContact O-CG1 3.29Å; L434-I437 WeakPolarHBondContact O-CG1 3.09Å; L434-I437 PolarHBondContact O-N 3.35Å
435	E	88.1	Confident	90.4	Very high	71 Å²	71	27.7 Å²	27.7	33%	0.332	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	-66.9	-16.1	172.2	70.7	-74.9	173.9	0	0	113.2	G433	G433-E435 WeakPolarHBondContact CA-OE1 3.4Å; G433-E435 WeakPolarHBondContact CA-OE2 3.31Å; G433-E435 PolarHBondContact N-OE2 2.98Å; G433-E435 PolarHBondContact O-N 3.11Å
436	N	87.9	Confident	90.1	Very high	75 Å²	75	27.3 Å²	27.3	40%	0.401	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-96.2	16	-178.7	-53.9	-66.6	0	0	0	113.3	P267 G433 L434	P267-N436 HydrophobicContact CB-CB 4.12Å; P267-N436 HydrophobicContact CG-CB 4Å; G433-N436 WeakPolarHBondContact O-CB 3.44Å; G433-N436 PolarHBondContact O-N 2.72Å; G433-N436 VanDerWaalsContact O-N 3.09Å; G433-N436 PolarHBondContact O-ND2 3.41Å; L434-N436 PolarHBondContact O-N 2.96Å
437	I	91.2	Very high	89.8	Confident	8 Å²	8	30.3 Å²	30.3	4%	0.041	16%	0.155	C	C	.	.			trans	-80.5	127	174.1	-57.1	169.3	0	0	0	108.8	F268 V270 Y320 L434	F268-I437 HydrophobicContact CD1-CG1 4.05Å; F268-I437 HydrophobicContact CD2-CG2 4.29Å; F268-I437 HydrophobicContact CE1-CD1 3.6Å; F268-I437 HydrophobicContact CE1-CG1 3.47Å; F268-I437 VanDerWaalsContact CE1-CG1 3.47Å; F268-I437 HydrophobicContact CE2-CD1 4.27Å; F268-I437 HydrophobicContact CE2-CG1 4.17Å; F268-I437 HydrophobicContact CE2-CG2 3.82Å; F268-I437 HydrophobicContact CZ-CB 4.42Å; F268-I437 HydrophobicContact CZ-CD1 3.37Å; F268-I437 HydrophobicContact CZ-CG1 3.53Å; F268-I437 HydrophobicContact CZ-CG2 4Å; F268-I437 WeakPolarHBondContact O-CA 3.47Å; V270-I437 HydrophobicContact CG2-CG2 3.64Å; Y320-I437 HydrophobicContact CD2-CD1 3.82Å; Y320-I437 HydrophobicContact CE1-CG2 4.35Å; Y320-I437 HydrophobicContact CE2-CB 4.21Å; Y320-I437 HydrophobicContact CE2-CD1 3.56Å; Y320-I437 HydrophobicContact CE2-CG1 4.48Å; Y320-I437 HydrophobicContact CE2-CG2 4.24Å; Y320-I437 HydrophobicContact CG-CD1 4.46Å; Y320-I437 VanDerWaalsContact OH-CG2 3.23Å; Y320-I437 WeakPolarHBondContact OH-CG2 3.4Å; L434-I437 HydrophobicContact CB-CD1 4.28Å; L434-I437 HydrophobicContact CD2-CD1 3.87Å; L434-I437 WeakPolarHBondContact O-CD1 3.32Å; L434-I437 VanDerWaalsContact O-CG1 3.29Å; L434-I437 WeakPolarHBondContact O-CG1 3.09Å; L434-I437 PolarHBondContact O-N 3.35Å
438	R	91.7	Very high	89.3	Confident	96 Å²	96	32.6 Å²	32.6	36%	0.362	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	151.2	174.2	63.8	-176.7	178.9	147.8	-1.6	111.6	F268 A269 V270 L440 G489 N577	F268-R438 PolarHBondContact O-N 2.86Å; F268-R438 VanDerWaalsContact O-N 3.13Å; A269-R438 CarbonylContact C-O 3.43Å; A269-R438 WeakPolarHBondContact CA-O 3.01Å; A269-R438 HydrophobicContact CB-CG 3.6Å; V270-R438 PolarHBondContact N-O 3.22Å; R438-L440 HydrophobicContact CG-CD2 4.37Å; R438-G489 PolarHBondContact NH1-O 3.04Å; R438-G489 PolarHBondContact NH2-O 3.14Å; R438-N577 VanDerWaalsContact CZ-OXT 3.31Å; R438-N577 PolarHBondContact NE-OXT 3.38Å; R438-N577 PolarHBondContact NH2-O 3.29Å; R438-N577 PolarHBondContact NH2-OXT 3.36Å
439	V	91.2	Very high	88.8	Confident	11 Å²	11	34.8 Å²	34.8	7%	0.067	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	128.5	174.2	-175.1	0	0	0	0	108.7	V270 M395 P396	V270-V439 HydrophobicContact CB-CG1 4.46Å; V270-V439 HydrophobicContact CB-CG2 4.36Å; V270-V439 HydrophobicContact CG2-CG2 4.36Å; M395-V439 HydrophobicContact CE-CG1 3.99Å; P396-V439 HydrophobicContact CB-CG2 3.9Å; P396-V439 HydrophobicContact CG-CG2 3.61Å
440	L	89.6	Confident	88.5	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.01	20%	0.198	C	C	.	.			trans	-98.3	146.4	179.2	-52.8	175.3	0	0	0	110.5	A269 V270 G272 R438 C442 D488 F490 Y576	A269-L440 HydrophobicContact CB-CD1 3.59Å; A269-L440 HydrophobicContact CB-CD2 3.94Å; A269-L440 HydrophobicContact CB-CG 3.64Å; V270-L440 PolarHBondContact O-N 3.37Å; G272-L440 WeakPolarHBondContact CA-O 3.26Å; G272-L440 PolarHBondContact N-O 2.97Å; R438-L440 HydrophobicContact CG-CD2 4.37Å; L440-C442 HydrophobicContact CB-CB 4.25Å; L440-D488 WeakPolarHBondContact CA-OD2 3.2Å; L440-D488 HydrophobicContact CD2-CB 3.87Å; L440-F490 HydrophobicContact CD1-CB 3.73Å; L440-F490 HydrophobicContact CD1-CD1 4.08Å; L440-F490 HydrophobicContact CD1-CD2 4.18Å; L440-F490 HydrophobicContact CD1-CG 3.73Å; L440-F490 HydrophobicContact CD2-CB 4.27Å; L440-Y576 HydrophobicContact CD1-CD1 3.88Å; L440-Y576 HydrophobicContact CD1-CG 4.47Å
441	D	86.5	Confident	87.6	Confident	47 Å²	47	44.7 Å²	44.7	25%	0.251	24%	0.235	S	C	.	.	S	Bend	trans	-78.1	-8.9	160.2	-75.2	-42.7	0	0	0	112.7	H398 Q485 D488	H398-D441 IonicContact CD2-OD1 2.99Å; H398-D441 IonicContact CD2-OD2 2.79Å; H398-D441 IonicContact CE1-OD1 2.74Å; H398-D441 PolarHBondContact CE1-OD1 2.65Å; H398-D441 VanDerWaalsContact CE1-OD1 3.26Å; H398-D441 IonicContact NE2-OD1 2.63Å; H398-D441 PolarHBondContact NE2-OD1 3.17Å; H398-D441 IonicContact NE2-OD2 3.42Å; H398-D441 PolarHBondContact NE2-OD2 2.75Å; H398-D441 VanDerWaalsContact NE2-OD2 3.11Å; D441-Q485 HydrophobicContact CB-CB 4.14Å; D441-Q485 WeakPolarHBondContact CB-O 3.46Å; D441-D488 PolarHBondContact N-OD2 2.76Å
442	C	89.7	Confident	87	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.264	C	S	.	.			trans	-94.7	155.5	-177.4	-68.1	0	0	0	0	113.3	P271 G272 L440 C486 F490	P271-C442 WeakPolarHBondContact CA-O 3.48Å; G272-C442 PolarHBondContact N-O 3.11Å; L440-C442 HydrophobicContact CB-CB 4.25Å; C442-C486 WeakPolarHBondContact CA-SG 3.37Å; C442-C486 HydrophobicContact CB-CB 4.01Å; C442-C486 WeakPolarHBondContact CB-SG 3.25Å; C442-C486 WeakPolarHBondContact SG-CA 3.35Å; C442-C486 WeakPolarHBondContact SG-CB 3.48Å; C442-C486 CovalentContact SG-SG 2.03Å; C442-C486 PolarHBondContact SG-SG 3.45Å; C442-F490 HydrophobicContact CB-CD1 3.82Å; C442-F490 HydrophobicContact CB-CE1 3.34Å; C442-F490 HydrophobicContact CB-CZ 4.1Å
443	S	91.3	Very high	86.6	Confident	9 Å²	9	54.4 Å²	54.4	6%	0.063	29%	0.285	C	S	.	.			trans	-146.8	170	166.2	56	0	0	0	0	109.3	N273 S481	N273-S443 WeakPolarHBondContact ND2-CB 3.24Å; N273-S443 VanDerWaalsContact OD1-CB 3.27Å; N273-S443 WeakPolarHBondContact OD1-CB 3.48Å; S443-S481 VanDerWaalsContact O-CB 3.31Å; S443-S481 WeakPolarHBondContact O-CB 3.3Å; S443-S481 PolarHBondContact O-N 3.11Å
444	V	90.2	Very high	86.3	Confident	5 Å²	5	58.6 Å²	58.6	3%	0.03	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	148.9	171.8	-72.7	0	0	0	0	111	F446 T478 T479 K480 F490 V492 F538 Y576	V444-F446 HydrophobicContact CB-CE2 4.06Å; V444-F446 HydrophobicContact CB-CZ 4.29Å; V444-F446 HydrophobicContact CG2-CD2 4.35Å; V444-F446 HydrophobicContact CG2-CE2 3.27Å; V444-F446 HydrophobicContact CG2-CZ 3.43Å; V444-F446 VanDerWaalsContact CG2-CZ 3.43Å; V444-T478 HydrophobicContact CB-CG2 3.54Å; V444-T478 HydrophobicContact CG1-CG2 3.72Å; V444-T478 HydrophobicContact CG2-CG2 3.84Å; V444-T479 CarbonylContact C-O 3.57Å; V444-T479 VanDerWaalsContact CA-O 3.26Å; V444-T479 WeakPolarHBondContact CA-O 3.3Å; V444-K480 HydrophobicContact CG1-CB 4.43Å; V444-F490 HydrophobicContact CG1-CE2 3.77Å; V444-F490 HydrophobicContact CG1-CZ 3.72Å; V444-V492 HydrophobicContact CG2-CG2 4.23Å; V444-F538 HydrophobicContact CG1-CD2 4.09Å; V444-F538 HydrophobicContact CG1-CE2 3.66Å; V444-F538 HydrophobicContact CG1-CZ 4.1Å; V444-Y576 HydrophobicContact CG2-CE1 3.66Å; V444-Y576 HydrophobicContact CG2-CE2 4.45Å; V444-Y576 VanDerWaalsContact CG2-CZ 3.49Å; V444-Y576 WeakPolarHBondContact CG2-OH 3.42Å; V444-Y576 PolarHBondContact N-OH 3.26Å
445	N	87.4	Confident	86.2	Confident	96 Å²	96	61.2 Å²	61.2	51%	0.513	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	147.1	167.6	-67	-51.5	0	0	0	109.7	T478 T479	N445-T478 CarbonylContact O-C 3.52Å; N445-T478 WeakPolarHBondContact O-CA 3.35Å; N445-T479 PolarHBondContact N-O 3.45Å; N445-T479 PolarHBondContact O-N 2.74Å
446	F	85.1	Confident	86.3	Confident	74 Å²	74	63.1 Å²	63.1	33%	0.325	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	145.7	-179.5	-64.4	-98.1	0	0	0	111.7	V444 I476 K477 T478 V492 Y535 F572 I574	V444-F446 HydrophobicContact CB-CE2 4.06Å; V444-F446 HydrophobicContact CB-CZ 4.29Å; V444-F446 HydrophobicContact CG2-CD2 4.35Å; V444-F446 HydrophobicContact CG2-CE2 3.27Å; V444-F446 HydrophobicContact CG2-CZ 3.43Å; V444-F446 VanDerWaalsContact CG2-CZ 3.43Å; F446-I476 HydrophobicContact CD1-CG2 4.2Å; F446-K477 CarbonylContact C-O 3.58Å; F446-K477 WeakPolarHBondContact CA-O 3.26Å; F446-T478 HydrophobicContact CD1-CG2 3.91Å; F446-T478 WeakPolarHBondContact CD1-OG1 3.26Å; F446-T478 HydrophobicContact CE1-CG2 3.37Å; F446-T478 WeakPolarHBondContact CE1-OG1 3.36Å; F446-T478 HydrophobicContact CE2-CG2 4.17Å; F446-T478 HydrophobicContact CZ-CG2 3.49Å; F446-T478 VanDerWaalsContact CZ-CG2 3.49Å; F446-V492 HydrophobicContact CZ-CG1 4.35Å; F446-Y535 HydrophobicContact CE1-CE1 4.27Å; F446-F572 HydrophobicContact CD1-CE1 4.27Å; F446-F572 HydrophobicContact CE1-CE1 4.16Å; F446-I574 HydrophobicContact CD2-CD1 4.03Å; F446-I574 HydrophobicContact CE1-CD1 4.3Å; F446-I574 HydrophobicContact CE1-CG2 3.86Å; F446-I574 HydrophobicContact CE2-CD1 3.05Å; F446-I574 HydrophobicContact CE2-CG1 4.42Å; F446-I574 HydrophobicContact CE2-CG2 4.46Å; F446-I574 HydrophobicContact CZ-CB 4.34Å; F446-I574 HydrophobicContact CZ-CD1 3.23Å; F446-I574 HydrophobicContact CZ-CG1 4.33Å; F446-I574 HydrophobicContact CZ-CG2 3.72Å
447	S	84.4	Confident	86.5	Confident	63 Å²	63	60.5 Å²	60.5	44%	0.441	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	136	167.1	57.2	0	0	0	0	109.5	K477	S447-K477 PolarHBondContact N-O 2.69Å; S447-K477 PolarHBondContact O-N 3.15Å
448	I	84.8	Confident	86.4	Confident	48 Å²	48	61.9 Å²	61.9	25%	0.246	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	135.3	174.9	-58	176.1	0	0	0	107.7	P450 Q453 S475 I476	I448-P450 CarbonylContact O-C 3.59Å; I448-Q453 HydrophobicContact CB-CG 4.22Å; I448-S475 CarbonylContact C-O 3.59Å; I448-S475 WeakPolarHBondContact CA-O 3.43Å; I448-I476 HydrophobicContact CG1-CG1 4.31Å
449	S	82.3	Confident	86.3	Confident	62 Å²	62	67.7 Å²	67.7	43%	0.434	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.5	173.7	-174.9	0	0	0	0	109.4	F474 S475	S449-F474 CarbonylContact O-C 3.56Å; S449-F474 WeakPolarHBondContact O-CA 3.34Å; S449-F474 VanDerWaalsContact O-CB 3.26Å; S449-F474 WeakPolarHBondContact O-CB 3.33Å; S449-S475 PolarHBondContact N-O 2.78Å; S449-S475 PolarHBondContact O-N 2.96Å
450	P	86.3	Confident	86.2	Confident	49 Å²	49	69.7 Å²	69.7	32%	0.318	37%	0.373	S	S	.	.	S	Bend	cis	-68	151.6	4.2	30.2	-36.2	0	0	0	112.2	I448 T452 Q453	I448-P450 CarbonylContact O-C 3.59Å; P450-T452 PolarHBondContact O-N 3.35Å; P450-Q453 PolarHBondContact O-N 2.8Å
451	E	74.1	Confident	86.1	Confident	184 Å²	184	73.7 Å²	73.7	86%	0.86	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-21.2	-179	-65.6	-177.4	174.9	0	0	113.1	Q453	E451-Q453 PolarHBondContact O-N 3.48Å
452	T	76.5	Confident	86.3	Confident	102 Å²	102	74.2 Å²	74.2	63%	0.626	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-20	172.7	58.5	0	0	0	0	112.9	P450 V454	P450-T452 PolarHBondContact O-N 3.35Å; T452-V454 PolarHBondContact O-N 3.43Å; T452-V454 VanDerWaalsContact O-N 3.12Å; T452-V454 PolarHBondContact OG1-N 2.7Å
453	Q	82.4	Confident	86.2	Confident	138 Å²	138	78.6 Å²	78.6	65%	0.645	42%	0.42	S	S	*	.			trans	57.2	19.5	-172.8	-47.3	-177	10.6	0	0	113.4	I448 P450 E451	I448-Q453 HydrophobicContact CB-CG 4.22Å; P450-Q453 PolarHBondContact O-N 2.8Å; E451-Q453 PolarHBondContact O-N 3.48Å
454	V	83.2	Confident	86.1	Confident	89 Å²	89	82.2 Å²	82.2	54%	0.539	44%	0.438	S	S	.	.			trans	-112	123.5	178.3	178.2	0	0	0	0	108.6	T452 D456	T452-V454 PolarHBondContact O-N 3.43Å; T452-V454 VanDerWaalsContact O-N 3.12Å; T452-V454 PolarHBondContact OG1-N 2.7Å; V454-D456 PolarHBondContact O-N 2.99Å
455	I	86.7	Confident	86.2	Confident	57 Å²	57	82 Å²	82	29%	0.292	44%	0.437	S	S	.	.			trans	-91.9	95.8	171.2	-56.7	176.3	0	0	0	107.7	F457 K472 F474 A551	I455-F457 HydrophobicContact CG2-CD2 4.37Å; I455-F457 HydrophobicContact CG2-CE2 3.8Å; I455-F457 HydrophobicContact CG2-CZ 4.11Å; I455-K472 HydrophobicContact CG2-CB 3.45Å; I455-K472 VanDerWaalsContact CG2-CB 3.45Å; I455-K472 HydrophobicContact CG2-CG 4.1Å; I455-F474 HydrophobicContact CD1-CB 4.17Å; I455-F474 HydrophobicContact CD1-CD1 3.35Å; I455-F474 HydrophobicContact CD1-CD2 4.5Å; I455-F474 HydrophobicContact CD1-CE1 3.76Å; I455-F474 HydrophobicContact CD1-CG 3.76Å; I455-F474 HydrophobicContact CD1-CZ 4.48Å; I455-F474 HydrophobicContact CG1-CB 4.31Å; I455-F474 HydrophobicContact CG1-CD1 4.33Å; I455-F474 HydrophobicContact CG1-CG 4.42Å; I455-A551 HydrophobicContact CD1-CB 3.82Å; I455-A551 HydrophobicContact CG2-CB 3.95Å
456	D	90.1	Very high	86.2	Confident	111 Å²	111	84.4 Å²	84.4	59%	0.594	44%	0.439	S	S	*	.			trans	-90	110.6	-179.1	-172.8	8.5	0	0	0	111.5	V454 G458 K472	V454-D456 PolarHBondContact O-N 2.99Å; D456-G458 WeakPolarHBondContact OD1-CA 3.29Å; D456-G458 PolarHBondContact OD1-N 3.03Å; D456-K472 WeakPolarHBondContact O-CE 3.44Å; D456-K472 PolarHBondContact O-NZ 3.03Å
457	F	92	Very high	86.4	Confident	20 Å²	20	89.7 Å²	89.7	9%	0.088	46%	0.457	C	S	.	.			trans	-77.1	-9.8	172.5	-72.3	-84.3	0	0	0	113	I455 F460 M470 K472 L517 A551 L553 F566	I455-F457 HydrophobicContact CG2-CD2 4.37Å; I455-F457 HydrophobicContact CG2-CE2 3.8Å; I455-F457 HydrophobicContact CG2-CZ 4.11Å; F457-F460 HydrophobicContact CB-CE1 4.37Å; F457-M470 HydrophobicContact CD1-CB 3.96Å; F457-M470 HydrophobicContact CE1-CB 4.32Å; F457-M470 WeakPolarHBondContact CE1-O 3.46Å; F457-M470 WeakPolarHBondContact O-CE 3.26Å; F457-K472 HydrophobicContact CD1-CG 3.76Å; F457-K472 HydrophobicContact CE1-CB 4.13Å; F457-K472 HydrophobicContact CE1-CG 3.79Å; F457-K472 HydrophobicContact CG-CG 4.28Å; F457-K472 HydrophobicContact CZ-CB 4.33Å; F457-K472 HydrophobicContact CZ-CG 4.35Å; F457-L517 HydrophobicContact CE2-CD1 4.22Å; F457-L517 HydrophobicContact CZ-CD1 4.12Å; F457-A551 HydrophobicContact CZ-CB 3.89Å; F457-L553 HydrophobicContact CB-CD2 4.21Å; F457-L553 HydrophobicContact CD1-CB 3.9Å; F457-L553 HydrophobicContact CD1-CD2 4.13Å; F457-L553 HydrophobicContact CD2-CD2 4.31Å; F457-L553 HydrophobicContact CE1-CB 3.6Å; F457-L553 HydrophobicContact CE2-CB 4.25Å; F457-L553 HydrophobicContact CG-CB 4.36Å; F457-L553 HydrophobicContact CG-CD2 3.95Å; F457-L553 HydrophobicContact CZ-CB 3.78Å; F457-F566 HydrophobicContact CB-CZ 4.4Å
458	G	89.2	Confident	86.8	Confident	37 Å²	37	93 Å²	93	38%	0.381	47%	0.465	S	S	.	.			trans	69.9	-164.6	-177.6	0	0	0	0	0	112.8	D456	D456-G458 WeakPolarHBondContact OD1-CA 3.29Å; D456-G458 PolarHBondContact OD1-N 3.03Å
459	K	90.1	Very high	87.2	Confident	217 Å²	217	94.5 Å²	94.5	94%	0.943	47%	0.474	S	S	*	.			trans	-88.9	134.8	171.7	-63	179.6	-178.2	178	0	109.3
460	F	89	Confident	87.8	Confident	53 Å²	53	93.7 Å²	93.7	23%	0.232	46%	0.463	C	S	.	.			trans	-139.5	160.4	175.2	52.6	-91.8	0	0	0	110.7	F457 I465 M470 L515 L553 F566	F457-F460 HydrophobicContact CB-CE1 4.37Å; F460-I465 HydrophobicContact CD2-CB 3.88Å; F460-I465 HydrophobicContact CD2-CG2 4.05Å; F460-I465 HydrophobicContact CE2-CB 3.81Å; F460-I465 HydrophobicContact CE2-CG1 4.05Å; F460-I465 HydrophobicContact CE2-CG2 3.86Å; F460-M470 HydrophobicContact CB-CE 3.88Å; F460-M470 HydrophobicContact CB-SD 3.66Å; F460-M470 HydrophobicContact CD1-CE 3.67Å; F460-M470 HydrophobicContact CD1-SD 3.43Å; F460-M470 WeakPolarHBondContact CD1-SD 3.39Å; F460-M470 HydrophobicContact CD2-SD 3.92Å; F460-M470 HydrophobicContact CE1-CE 4.48Å; F460-M470 HydrophobicContact CE1-SD 3.98Å; F460-M470 HydrophobicContact CE2-SD 4.42Å; F460-M470 HydrophobicContact CG-CE 3.97Å; F460-M470 HydrophobicContact CG-SD 3.38Å; F460-M470 WeakPolarHBondContact CG-SD 3.36Å; F460-M470 HydrophobicContact CZ-SD 4.45Å; F460-L515 HydrophobicContact CZ-CD1 4.16Å; F460-L553 HydrophobicContact CE1-CD2 3.77Å; F460-L553 HydrophobicContact CZ-CD2 3.66Å; F460-F566 AromaticContact CE1-CE1 3.55Å; F460-F566 HydrophobicContact CE1-CE1 3.55Å; F460-F566 AromaticContact CE1-CZ 3.64Å; F460-F566 HydrophobicContact CE1-CZ 3.64Å; F460-F566 HydrophobicContact CZ-CD1 4.48Å; F460-F566 AromaticContact CZ-CE1 3.46Å; F460-F566 HydrophobicContact CZ-CE1 3.46Å; F460-F566 VanDerWaalsContact CZ-CE1 3.46Å; F460-F566 AromaticContact CZ-CZ 3.82Å; F460-F566 HydrophobicContact CZ-CZ 3.82Å
461	N	88	Confident	88.3	Confident	86 Å²	86	95.2 Å²	95.2	46%	0.46	47%	0.472	S	S	.	.			trans	-84.1	146.3	175.8	-173.7	-15.8	0	0	0	110.3	L463 D464 I465	N461-L463 PolarHBondContact O-N 3.39Å; N461-L463 VanDerWaalsContact O-N 3.14Å; N461-L463 PolarHBondContact OD1-N 3.46Å; N461-L463 VanDerWaalsContact OD1-N 3.15Å; N461-D464 WeakPolarHBondContact CB-OD2 3.42Å; N461-D464 PolarHBondContact O-N 2.71Å; N461-I465 PolarHBondContact O-N 3.22Å
462	L	88.9	Confident	89.4	Confident	59 Å²	59	90.9 Å²	90.9	31%	0.309	45%	0.45	S	S	.	.	H	α-helix	trans	-51.5	-32.9	171.3	-64	179.4	0	0	0	113	I465 R466 I561 A563	L462-I465 WeakPolarHBondContact O-CG2 3.31Å; L462-R466 VanDerWaalsContact O-CG 3.25Å; L462-R466 WeakPolarHBondContact O-CG 3.37Å; L462-R466 PolarHBondContact O-N 3.1Å; L462-I561 HydrophobicContact CD2-CB 4.18Å; L462-I561 HydrophobicContact CD2-CG2 3.54Å; L462-A563 HydrophobicContact CD1-CB 4.32Å; L462-A563 HydrophobicContact CD2-CB 4.48Å
463	L	88.2	Confident	90.3	Very high	92 Å²	92	90.6 Å²	90.6	48%	0.482	45%	0.449	S	S	.	.	H	α-helix	trans	-68.9	-33.7	177.4	-70.1	177.8	0	0	0	113.2	N461 R467	N461-L463 PolarHBondContact O-N 3.39Å; N461-L463 VanDerWaalsContact O-N 3.14Å; N461-L463 PolarHBondContact OD1-N 3.46Å; N461-L463 VanDerWaalsContact OD1-N 3.15Å; L463-R467 WeakPolarHBondContact O-CG 3.11Å; L463-R467 PolarHBondContact O-N 3.24Å
464	D	89.4	Confident	90.8	Very high	84 Å²	84	84.7 Å²	84.7	45%	0.449	42%	0.421	S	S	.	.	H	α-helix	trans	-72.3	-48.7	-175.6	-62.4	-30.9	0	0	0	110.2	N461 R466 R467 H468	N461-D464 WeakPolarHBondContact CB-OD2 3.42Å; N461-D464 PolarHBondContact O-N 2.71Å; D464-R466 PolarHBondContact O-N 3.3Å; D464-R467 PolarHBondContact O-N 3.06Å; D464-H468 PolarHBondContact O-N 2.96Å
465	I	91.3	Very high	91.4	Very high	1 Å²	1	81.2 Å²	81.2	1%	0.005	40%	0.401	C	S	.	.	H	α-helix	trans	-67.9	-20	179.5	-166.6	60.3	0	0	0	113.4	F460 N461 L462 M470 L515 L553 I561	F460-I465 HydrophobicContact CD2-CB 3.88Å; F460-I465 HydrophobicContact CD2-CG2 4.05Å; F460-I465 HydrophobicContact CE2-CB 3.81Å; F460-I465 HydrophobicContact CE2-CG1 4.05Å; F460-I465 HydrophobicContact CE2-CG2 3.86Å; N461-I465 PolarHBondContact O-N 3.22Å; L462-I465 WeakPolarHBondContact O-CG2 3.31Å; I465-M470 HydrophobicContact CD1-CB 4.34Å; I465-M470 HydrophobicContact CD1-CG 3.88Å; I465-M470 HydrophobicContact CD1-SD 4.13Å; I465-L515 HydrophobicContact CG1-CD2 3.74Å; I465-L553 HydrophobicContact CD1-CD2 4.29Å; I465-L553 HydrophobicContact CD1-CG 4.06Å; I465-L553 WeakPolarHBondContact CD1-O 3.46Å; I465-I561 HydrophobicContact CG2-CD1 3.76Å
466	R	88.7	Confident	91.7	Very high	147 Å²	147	78.6 Å²	78.6	56%	0.555	39%	0.387	S	S	*	.	H	α-helix	trans	-75.6	-28.9	170.9	-78.9	179.6	-173.8	-157.6	3.6	112.9	L462 D464 I561	L462-R466 VanDerWaalsContact O-CG 3.25Å; L462-R466 WeakPolarHBondContact O-CG 3.37Å; L462-R466 PolarHBondContact O-N 3.1Å; D464-R466 PolarHBondContact O-N 3.3Å; R466-I561 HydrophobicContact CG-CD1 3.55Å
467	R	89	Confident	91.9	Very high	184 Å²	184	76.4 Å²	76.4	69%	0.694	37%	0.372	S	S	*	.	H	α-helix	trans	-94.6	-34.2	-175.2	-71.3	177.2	176.2	179.2	-0.6	112.3	L463 D464	L463-R467 WeakPolarHBondContact O-CG 3.11Å; L463-R467 PolarHBondContact O-N 3.24Å; D464-R467 PolarHBondContact O-N 3.06Å
468	H	91.9	Very high	91.9	Very high	134 Å²	134	75.4 Å²	75.4	62%	0.62	37%	0.368	S	S	*	.	S	Bend	trans	-141.6	145.4	-174.4	-52.3	96.5	0	0	0	110.9	D464	D464-H468 PolarHBondContact O-N 2.96Å
469	N	94.8	Very high	92	Very high	78 Å²	78	75.9 Å²	75.9	42%	0.417	36%	0.364	S	S	.	.			trans	-70.1	142.8	167.7	-59.8	-9.3	0	0	0	108.9	E552 L553 S554	N469-E552 HydrophobicContact CB-CG 3.83Å; N469-E552 PolarHBondContact ND2-OE2 3.42Å; N469-L553 CarbonylContact C-O 3.58Å; N469-L553 WeakPolarHBondContact CA-O 3.37Å; N469-S554 VanDerWaalsContact OD1-CB 3.22Å; N469-S554 WeakPolarHBondContact OD1-CB 3.29Å
470	M	94.8	Very high	92.1	Very high	45 Å²	45	66.7 Å²	66.7	22%	0.222	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	136.3	173.1	-65.7	-178.9	68.5	0	0	109.1	F457 F460 I465 E552 L553	F457-M470 HydrophobicContact CD1-CB 3.96Å; F457-M470 HydrophobicContact CE1-CB 4.32Å; F457-M470 WeakPolarHBondContact CE1-O 3.46Å; F457-M470 WeakPolarHBondContact O-CE 3.26Å; F460-M470 HydrophobicContact CB-CE 3.88Å; F460-M470 HydrophobicContact CB-SD 3.66Å; F460-M470 HydrophobicContact CD1-CE 3.67Å; F460-M470 HydrophobicContact CD1-SD 3.43Å; F460-M470 WeakPolarHBondContact CD1-SD 3.39Å; F460-M470 HydrophobicContact CD2-SD 3.92Å; F460-M470 HydrophobicContact CE1-CE 4.48Å; F460-M470 HydrophobicContact CE1-SD 3.98Å; F460-M470 HydrophobicContact CE2-SD 4.42Å; F460-M470 HydrophobicContact CG-CE 3.97Å; F460-M470 HydrophobicContact CG-SD 3.38Å; F460-M470 WeakPolarHBondContact CG-SD 3.36Å; F460-M470 HydrophobicContact CZ-SD 4.45Å; I465-M470 HydrophobicContact CD1-CB 4.34Å; I465-M470 HydrophobicContact CD1-CG 3.88Å; I465-M470 HydrophobicContact CD1-SD 4.13Å; M470-E552 CarbonylContact O-C 3.56Å; M470-E552 WeakPolarHBondContact O-CA 3.24Å; M470-L553 HydrophobicContact CB-CB 4.32Å; M470-L553 PolarHBondContact N-O 2.92Å; M470-L553 PolarHBondContact O-N 3.37Å
471	T	96.4	Very high	91.9	Very high	82 Å²	82	65.7 Å²	65.7	50%	0.503	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	141.6	-177.2	56.8	0	0	0	0	111.9	T550 A551 E552	T471-T550 HydrophobicContact CG2-CG2 3.85Å; T471-A551 CarbonylContact C-O 3.53Å; T471-A551 VanDerWaalsContact CA-O 3.26Å; T471-A551 WeakPolarHBondContact CA-O 3.32Å; T471-E552 HydrophobicContact CG2-CB 4.37Å; T471-E552 HydrophobicContact CG2-CG 4.38Å
472	K	95.8	Very high	91.2	Very high	92 Å²	92	68.6 Å²	68.6	40%	0.4	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	136.7	170.9	-70.3	-71.9	177.9	159.4	0	109.3	I455 D456 F457 A551	I455-K472 HydrophobicContact CG2-CB 3.45Å; I455-K472 VanDerWaalsContact CG2-CB 3.45Å; I455-K472 HydrophobicContact CG2-CG 4.1Å; D456-K472 WeakPolarHBondContact O-CE 3.44Å; D456-K472 PolarHBondContact O-NZ 3.03Å; F457-K472 HydrophobicContact CD1-CG 3.76Å; F457-K472 HydrophobicContact CE1-CB 4.13Å; F457-K472 HydrophobicContact CE1-CG 3.79Å; F457-K472 HydrophobicContact CG-CG 4.28Å; F457-K472 HydrophobicContact CZ-CB 4.33Å; F457-K472 HydrophobicContact CZ-CG 4.35Å; K472-A551 PolarHBondContact N-O 2.8Å; K472-A551 PolarHBondContact O-N 2.99Å
473	T	96.4	Very high	90.3	Very high	96 Å²	96	69.1 Å²	69.1	59%	0.589	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.8	146.3	177.4	55.1	0	0	0	0	111	T548 Y549	T473-T548 HydrophobicContact CG2-CG2 4.4Å; T473-Y549 VanDerWaalsContact CA-O 3.25Å; T473-Y549 WeakPolarHBondContact CA-O 3.46Å
474	F	93.8	Very high	89.1	Confident	15 Å²	15	73.1 Å²	73.1	7%	0.066	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	154.8	168.3	68.7	-78.8	0	0	0	108.2	S449 I455 I476 F496 L519 Y549 A551	S449-F474 CarbonylContact O-C 3.56Å; S449-F474 WeakPolarHBondContact O-CA 3.34Å; S449-F474 VanDerWaalsContact O-CB 3.26Å; S449-F474 WeakPolarHBondContact O-CB 3.33Å; I455-F474 HydrophobicContact CD1-CB 4.17Å; I455-F474 HydrophobicContact CD1-CD1 3.35Å; I455-F474 HydrophobicContact CD1-CD2 4.5Å; I455-F474 HydrophobicContact CD1-CE1 3.76Å; I455-F474 HydrophobicContact CD1-CG 3.76Å; I455-F474 HydrophobicContact CD1-CZ 4.48Å; I455-F474 HydrophobicContact CG1-CB 4.31Å; I455-F474 HydrophobicContact CG1-CD1 4.33Å; I455-F474 HydrophobicContact CG1-CG 4.42Å; F474-I476 HydrophobicContact CD2-CG1 4.3Å; F474-I476 HydrophobicContact CE2-CD1 4.11Å; F474-I476 HydrophobicContact CE2-CG1 4.2Å; F474-F496 AromaticContact CE2-CE1 3.93Å; F474-F496 HydrophobicContact CE2-CE1 3.93Å; F474-F496 HydrophobicContact CE2-CZ 4.09Å; F474-F496 AromaticContact CZ-CE1 3.88Å; F474-F496 HydrophobicContact CZ-CE1 3.88Å; F474-F496 AromaticContact CZ-CZ 3.91Å; F474-F496 HydrophobicContact CZ-CZ 3.91Å; F474-L519 HydrophobicContact CE1-CD2 3.92Å; F474-L519 HydrophobicContact CZ-CD1 4.42Å; F474-L519 HydrophobicContact CZ-CD2 4.16Å; F474-Y549 HydrophobicContact CD2-CD2 4.22Å; F474-Y549 HydrophobicContact CE1-CG 4.29Å; F474-Y549 AromaticContact CE2-CD2 3.71Å; F474-Y549 HydrophobicContact CE2-CD2 3.71Å; F474-Y549 AromaticContact CE2-CG 3.99Å; F474-Y549 HydrophobicContact CE2-CG 3.99Å; F474-Y549 HydrophobicContact CZ-CD2 4.01Å; F474-Y549 AromaticContact CZ-CG 3.78Å; F474-Y549 HydrophobicContact CZ-CG 3.78Å; F474-Y549 PolarHBondContact N-O 3.12Å; F474-Y549 PolarHBondContact O-N 2.98Å; F474-A551 HydrophobicContact CD1-CB 4.39Å; F474-A551 HydrophobicContact CE1-CB 4.26Å
475	S	95.1	Very high	88.3	Confident	16 Å²	16	75.2 Å²	75.2	11%	0.112	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	143.5	-177.9	-54.1	0	0	0	0	110.4	I448 S449 K547 T548	I448-S475 CarbonylContact C-O 3.59Å; I448-S475 WeakPolarHBondContact CA-O 3.43Å; S449-S475 PolarHBondContact N-O 2.78Å; S449-S475 PolarHBondContact O-N 2.96Å; S475-K547 CarbonylContact C-O 3.45Å; S475-K547 VanDerWaalsContact CA-O 3.26Å; S475-K547 WeakPolarHBondContact CA-O 3.46Å; S475-T548 PolarHBondContact OG-OG1 3.43Å
476	I	93.1	Very high	87.9	Confident	1 Å²	1	76.1 Å²	76.1	1%	0.005	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	121	172.9	-54.2	-178.6	0	0	0	107	F446 I448 F474 F496 Y535 E546 K547 Y549 F572	F446-I476 HydrophobicContact CD1-CG2 4.2Å; I448-I476 HydrophobicContact CG1-CG1 4.31Å; F474-I476 HydrophobicContact CD2-CG1 4.3Å; F474-I476 HydrophobicContact CE2-CD1 4.11Å; F474-I476 HydrophobicContact CE2-CG1 4.2Å; I476-F496 HydrophobicContact CD1-CE1 4.05Å; I476-F496 HydrophobicContact CD1-CZ 4.14Å; I476-Y535 PolarHBondContact O-OH 3.49Å; I476-E546 WeakPolarHBondContact O-CA 3.47Å; I476-K547 PolarHBondContact N-O 3.36Å; I476-K547 PolarHBondContact O-N 3.07Å; I476-Y549 HydrophobicContact CB-CE2 3.98Å; I476-Y549 HydrophobicContact CD1-CD2 4.29Å; I476-Y549 HydrophobicContact CD1-CE2 3.75Å; I476-Y549 HydrophobicContact CG1-CD2 4.12Å; I476-Y549 HydrophobicContact CG1-CE2 3.74Å; I476-F572 HydrophobicContact CD1-CB 4.17Å; I476-F572 HydrophobicContact CD1-CD1 3.83Å; I476-F572 HydrophobicContact CD1-CD2 3.33Å; I476-F572 HydrophobicContact CD1-CE1 3.94Å; I476-F572 HydrophobicContact CD1-CE2 3.45Å; I476-F572 VanDerWaalsContact CD1-CE2 3.45Å; I476-F572 HydrophobicContact CD1-CG 3.5Å; I476-F572 HydrophobicContact CD1-CZ 3.74Å; I476-F572 HydrophobicContact CG2-CD1 4.18Å; I476-F572 HydrophobicContact CG2-CE1 3.76Å; I476-F572 HydrophobicContact CG2-CZ 4.11Å
477	K	93.4	Very high	87.4	Confident	65 Å²	65	74.6 Å²	74.6	28%	0.283	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	135.2	177.2	175.9	179.8	-179.5	173.9	0	109.7	F446 S447 I544 Y545 E546	F446-K477 CarbonylContact C-O 3.58Å; F446-K477 WeakPolarHBondContact CA-O 3.26Å; S447-K477 PolarHBondContact N-O 2.69Å; S447-K477 PolarHBondContact O-N 3.15Å; K477-I544 HydrophobicContact CD-CG2 4.29Å; K477-I544 VanDerWaalsContact CE-CG2 3.43Å; K477-I544 HydrophobicContact CG-CG2 4.05Å; K477-Y545 CarbonylContact C-O 3.56Å; K477-Y545 WeakPolarHBondContact CA-O 3.39Å; K477-E546 HydrophobicContact CB-CB 4.09Å; K477-E546 HydrophobicContact CB-CG 3.95Å; K477-E546 HydrophobicContact CG-CB 4.23Å
478	T	92.2	Very high	87.2	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.1	-177.4	-55.1	0	0	0	0	108.8	V444 N445 F446 Y535 F538 I544 Y545	V444-T478 HydrophobicContact CB-CG2 3.54Å; V444-T478 HydrophobicContact CG1-CG2 3.72Å; V444-T478 HydrophobicContact CG2-CG2 3.84Å; N445-T478 CarbonylContact O-C 3.52Å; N445-T478 WeakPolarHBondContact O-CA 3.35Å; F446-T478 HydrophobicContact CD1-CG2 3.91Å; F446-T478 WeakPolarHBondContact CD1-OG1 3.26Å; F446-T478 HydrophobicContact CE1-CG2 3.37Å; F446-T478 WeakPolarHBondContact CE1-OG1 3.36Å; F446-T478 HydrophobicContact CE2-CG2 4.17Å; F446-T478 HydrophobicContact CZ-CG2 3.49Å; F446-T478 VanDerWaalsContact CZ-CG2 3.49Å; T478-Y535 HydrophobicContact CG2-CE1 4.46Å; T478-Y535 WeakPolarHBondContact OG1-CE1 3.32Å; T478-Y535 PolarHBondContact OG1-OH 2.77Å; T478-F538 HydrophobicContact CG2-CE2 3.86Å; T478-F538 HydrophobicContact CG2-CZ 3.74Å; T478-I544 WeakPolarHBondContact O-CA 3.06Å; T478-Y545 PolarHBondContact N-O 3.12Å; T478-Y545 PolarHBondContact O-N 3.02Å
479	T	92.1	Very high	87.1	Confident	47 Å²	47	63 Å²	63	29%	0.288	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.2	-176.4	-55.1	0	0	0	0	109.2	V444 N445 S481 L543 I544	V444-T479 CarbonylContact C-O 3.57Å; V444-T479 VanDerWaalsContact CA-O 3.26Å; V444-T479 WeakPolarHBondContact CA-O 3.3Å; N445-T479 PolarHBondContact N-O 3.45Å; N445-T479 PolarHBondContact O-N 2.74Å; T479-S481 PolarHBondContact O-N 3.19Å; T479-L543 CarbonylContact C-O 3.4Å; T479-L543 WeakPolarHBondContact CA-O 3.33Å; T479-I544 HydrophobicContact CG2-CG1 3.97Å
480	K	91.5	Very high	87	Confident	23 Å²	23	59.3 Å²	59.3	10%	0.1	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	126.4	171.9	-178.9	168.7	178.1	169.4	0	109	V444 Q482 C486 D488 F490 F538 L543	V444-K480 HydrophobicContact CG1-CB 4.43Å; K480-Q482 PolarHBondContact O-N 3.01Å; K480-C486 WeakPolarHBondContact CE-SG 3.45Å; K480-D488 PolarHBondContact NZ-O 2.91Å; K480-F490 HydrophobicContact CD-CE1 3.91Å; K480-F490 HydrophobicContact CD-CZ 4.24Å; K480-F490 HydrophobicContact CG-CE1 4.17Å; K480-F490 HydrophobicContact CG-CZ 4.15Å; K480-F538 HydrophobicContact CB-CD1 4.03Å; K480-F538 HydrophobicContact CB-CE1 4.24Å; K480-F538 HydrophobicContact CB-CG 4.48Å; K480-F538 HydrophobicContact CD-CB 4.04Å; K480-F538 HydrophobicContact CD-CD1 4.4Å; K480-F538 HydrophobicContact CD-CG 4.42Å; K480-F538 PolarHBondContact NZ-O 3.47Å; K480-L543 PolarHBondContact N-O 2.91Å
481	S	84.2	Confident	87	Confident	32 Å²	32	60.3 Å²	60.3	22%	0.224	33%	0.326	C	S	.	.			trans	-65.1	126.7	174.3	-173.7	0	0	0	0	109	S443 T479 C486	S443-S481 VanDerWaalsContact O-CB 3.31Å; S443-S481 WeakPolarHBondContact O-CB 3.3Å; S443-S481 PolarHBondContact O-N 3.11Å; T479-S481 PolarHBondContact O-N 3.19Å; S481-C486 WeakPolarHBondContact O-CB 3.43Å; S481-C486 PolarHBondContact O-SG 2.82Å
482	Q	74.6	Confident	86.9	Confident	147 Å²	147	56.4 Å²	56.4	69%	0.687	30%	0.302	S	S	*	.			trans	-106.5	83.6	177	-61.2	-170.5	-70.1	0	0	109.2	K480 L543	K480-Q482 PolarHBondContact O-N 3.01Å; Q482-L543 HydrophobicContact CG-CD2 4.02Å
483	N	70.5	Confident	86.9	Confident	70 Å²	70	52.5 Å²	52.5	37%	0.374	29%	0.286	S	S	.	.			trans	-100	158.5	158.4	59	1.3	0	0	0	108.2	Q485 C486	N483-Q485 PolarHBondContact O-N 2.83Å; N483-C486 PolarHBondContact O-N 2.79Å; N483-C486 WeakPolarHBondContact OD1-CB 3.45Å; N483-C486 PolarHBondContact OD1-N 3.01Å
484	D	62.4	Low	86.9	Confident	177 Å²	177	48.4 Å²	48.4	95%	0.947	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-9.4	-178.4	-61.7	-33.5	0	0	0	114
485	Q	72.9	Confident	86.9	Confident	127 Å²	127	47.9 Å²	47.9	59%	0.593	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-24.1	178.8	-64.1	-177.6	-35.4	0	0	113.6	D441 N483 T487	D441-Q485 HydrophobicContact CB-CB 4.14Å; D441-Q485 WeakPolarHBondContact CB-O 3.46Å; N483-Q485 PolarHBondContact O-N 2.83Å; Q485-T487 VanDerWaalsContact C-N 3.34Å; Q485-T487 PolarHBondContact O-N 2.96Å
486	C	82.3	Confident	86.9	Confident	20 Å²	20	47.6 Å²	47.6	14%	0.135	26%	0.256	C	S	.	.			trans	-76.5	84	-175.9	172.7	0	0	0	0	111.7	C442 K480 S481 N483	C442-C486 WeakPolarHBondContact CA-SG 3.37Å; C442-C486 HydrophobicContact CB-CB 4.01Å; C442-C486 WeakPolarHBondContact CB-SG 3.25Å; C442-C486 WeakPolarHBondContact SG-CA 3.35Å; C442-C486 WeakPolarHBondContact SG-CB 3.48Å; C442-C486 CovalentContact SG-SG 2.03Å; C442-C486 PolarHBondContact SG-SG 3.45Å; K480-C486 WeakPolarHBondContact CE-SG 3.45Å; S481-C486 WeakPolarHBondContact O-CB 3.43Å; S481-C486 PolarHBondContact O-SG 2.82Å; N483-C486 PolarHBondContact O-N 2.79Å; N483-C486 WeakPolarHBondContact OD1-CB 3.45Å; N483-C486 PolarHBondContact OD1-N 3.01Å
487	T	78.8	Confident	86.8	Confident	115 Å²	115	48.6 Å²	48.6	71%	0.706	26%	0.26	S	S	*	.			trans	-103.7	-14.9	177.7	58.6	0	0	0	0	113.1	Q485	Q485-T487 VanDerWaalsContact C-N 3.34Å; Q485-T487 PolarHBondContact O-N 2.96Å
488	D	84	Confident	86.4	Confident	47 Å²	47	45.7 Å²	45.7	25%	0.251	25%	0.248	S	C	.	.			trans	-69.5	139.1	-175.4	-63.1	-47.3	0	0	0	113.2	L440 D441 K480	L440-D488 WeakPolarHBondContact CA-OD2 3.2Å; L440-D488 HydrophobicContact CD2-CB 3.87Å; D441-D488 PolarHBondContact N-OD2 2.76Å; K480-D488 PolarHBondContact NZ-O 2.91Å
489	G	89.9	Confident	85.7	Confident	28 Å²	28	49.3 Å²	49.3	29%	0.289	27%	0.265	S	S	.	.			trans	-85.2	127.7	162.8	0	0	0	0	0	110.7	R438	R438-G489 PolarHBondContact NH1-O 3.04Å; R438-G489 PolarHBondContact NH2-O 3.14Å
490	F	93.3	Very high	85.4	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.268	C	S	.	.			trans	-147.3	159.2	-179.5	64.8	-83.2	0	0	0	111.6	L440 C442 V444 K480 V492 F538 Y576	L440-F490 HydrophobicContact CD1-CB 3.73Å; L440-F490 HydrophobicContact CD1-CD1 4.08Å; L440-F490 HydrophobicContact CD1-CD2 4.18Å; L440-F490 HydrophobicContact CD1-CG 3.73Å; L440-F490 HydrophobicContact CD2-CB 4.27Å; C442-F490 HydrophobicContact CB-CD1 3.82Å; C442-F490 HydrophobicContact CB-CE1 3.34Å; C442-F490 HydrophobicContact CB-CZ 4.1Å; V444-F490 HydrophobicContact CG1-CE2 3.77Å; V444-F490 HydrophobicContact CG1-CZ 3.72Å; K480-F490 HydrophobicContact CD-CE1 3.91Å; K480-F490 HydrophobicContact CD-CZ 4.24Å; K480-F490 HydrophobicContact CG-CE1 4.17Å; K480-F490 HydrophobicContact CG-CZ 4.15Å; F490-V492 HydrophobicContact CD2-CG2 4.05Å; F490-V492 HydrophobicContact CE2-CG2 3.84Å; F490-F538 HydrophobicContact CD1-CB 4.49Å; F490-F538 HydrophobicContact CD2-CD2 4.35Å; F490-F538 HydrophobicContact CE1-CB 4.17Å; F490-F538 HydrophobicContact CE2-CB 4.33Å; F490-F538 AromaticContact CE2-CD2 3.69Å; F490-F538 HydrophobicContact CE2-CD2 3.69Å; F490-F538 HydrophobicContact CE2-CE2 4.45Å; F490-F538 HydrophobicContact CE2-CG 4.34Å; F490-F538 HydrophobicContact CZ-CB 4.08Å; F490-F538 AromaticContact CZ-CD2 3.96Å; F490-F538 HydrophobicContact CZ-CD2 3.96Å; F490-F538 HydrophobicContact CZ-CG 4.22Å; F490-F538 CarbonylContact O-C 3.55Å; F490-F538 WeakPolarHBondContact O-CA 3.33Å; F490-F538 WeakPolarHBondContact O-CB 3.1Å; F490-F538 PolarHBondContact O-N 3.47Å; F490-Y576 AromaticContact CD2-CD1 3.67Å; F490-Y576 HydrophobicContact CD2-CD1 3.67Å; F490-Y576 HydrophobicContact CD2-CE1 4.24Å; F490-Y576 AromaticContact CE2-CD1 3.71Å; F490-Y576 HydrophobicContact CE2-CD1 3.71Å; F490-Y576 AromaticContact CE2-CE1 3.79Å; F490-Y576 HydrophobicContact CE2-CE1 3.79Å; F490-Y576 HydrophobicContact CZ-CE1 4.45Å
491	K	95.1	Very high	85.1	Confident	67 Å²	67	54.1 Å²	54.1	29%	0.291	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	160.4	172.5	-64.6	-177	169.3	-149.1	0	109.4	E534 A536 D537 T539 N577	K491-E534 WeakPolarHBondContact CD-OE2 3.34Å; K491-E534 IonicContact NZ-OE1 3.27Å; K491-E534 IonicContact NZ-OE2 2.63Å; K491-E534 PolarHBondContact NZ-OE2 2.83Å; K491-A536 CarbonylContact C-O 3.43Å; K491-A536 WeakPolarHBondContact CA-O 3.11Å; K491-D537 WeakPolarHBondContact CE-OD2 3.48Å; K491-D537 HydrophobicContact CG-CB 4.41Å; K491-D537 IonicContact NZ-OD2 2.73Å; K491-D537 PolarHBondContact NZ-OD2 3.45Å; K491-T539 HydrophobicContact CG-CG2 4.38Å; K491-N577 HydrophobicContact CB-CB 4.36Å; K491-N577 PolarHBondContact N-O 3.08Å; K491-N577 PolarHBondContact O-N 2.89Å
492	V	94.6	Very high	85.3	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	124.8	170.3	179.1	0	0	0	0	107.3	V444 F446 F490 Y535 A536 F538 I574 N575 Y576	V444-V492 HydrophobicContact CG2-CG2 4.23Å; F446-V492 HydrophobicContact CZ-CG1 4.35Å; F490-V492 HydrophobicContact CD2-CG2 4.05Å; F490-V492 HydrophobicContact CE2-CG2 3.84Å; V492-Y535 HydrophobicContact CG1-CD1 4.35Å; V492-Y535 WeakPolarHBondContact O-CA 3.46Å; V492-Y535 PolarHBondContact O-N 2.81Å; V492-A536 HydrophobicContact CB-CB 4.47Å; V492-A536 PolarHBondContact N-O 3.17Å; V492-A536 PolarHBondContact O-N 3.47Å; V492-A536 VanDerWaalsContact O-N 3.08Å; V492-F538 HydrophobicContact CG2-CD2 4.23Å; V492-F538 HydrophobicContact CG2-CE2 4.13Å; V492-I574 HydrophobicContact CG1-CB 3.85Å; V492-I574 HydrophobicContact CG1-CG2 4.03Å; V492-N575 WeakPolarHBondContact CA-O 3.33Å; V492-Y576 HydrophobicContact CG2-CD1 4.39Å
493	S	95.9	Very high	86.1	Confident	10 Å²	10	49.2 Å²	49.2	7%	0.07	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	150.1	164.8	55.2	0	0	0	0	109.8	A533 I574 N575 N577	S493-A533 CarbonylContact C-O 3.55Å; S493-A533 WeakPolarHBondContact CA-O 3.47Å; S493-A533 VanDerWaalsContact CB-O 3.25Å; S493-A533 WeakPolarHBondContact CB-O 3.35Å; S493-I574 CarbonylContact O-C 3.58Å; S493-I574 WeakPolarHBondContact O-CA 3.38Å; S493-N575 PolarHBondContact N-O 3.33Å; S493-N575 PolarHBondContact O-N 3.12Å; S493-N577 VanDerWaalsContact CB-ND2 3.29Å; S493-N577 WeakPolarHBondContact CB-ND2 3.42Å; S493-N577 PolarHBondContact N-ND2 3.26Å; S493-N577 PolarHBondContact OG-ND2 3.29Å
494	S	94.7	Very high	87.2	Confident	10 Å²	10	49.6 Å²	49.6	7%	0.07	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	156.8	177.5	75.1	0	0	0	0	112.5	Y532 A533 Y535 F572 K573	S494-Y532 VanDerWaalsContact O-CA 3.31Å; S494-Y532 WeakPolarHBondContact O-CA 3.38Å; S494-A533 PolarHBondContact N-O 2.98Å; S494-A533 PolarHBondContact O-N 2.76Å; S494-Y535 WeakPolarHBondContact OG-CB 3.19Å; S494-F572 VanDerWaalsContact CB-CE2 3.41Å; S494-F572 WeakPolarHBondContact OG-CE2 3.4Å; S494-F572 WeakPolarHBondContact OG-CZ 3.32Å; S494-K573 CarbonylContact C-O 3.57Å; S494-K573 WeakPolarHBondContact CA-O 3.42Å; S494-K573 WeakPolarHBondContact CB-O 3.44Å
495	S	94.2	Very high	88.7	Confident	4 Å²	4	48.3 Å²	48.3	3%	0.028	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	130.7	174.9	179.5	0	0	0	0	109.7	Y497 N530 K531 K573	S495-Y497 PolarHBondContact O-N 2.93Å; S495-N530 WeakPolarHBondContact OG-CA 3.41Å; S495-K531 PolarHBondContact OG-N 3.11Å; S495-K531 PolarHBondContact OG-O 2.77Å; S495-K573 PolarHBondContact N-O 3.25Å; S495-K573 PolarHBondContact O-N 3.07Å
496	F	94.9	Very high	89.7	Confident	10 Å²	10	44.2 Å²	44.2	4%	0.044	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	107.1	164.2	-72.5	-69.5	0	0	0	108.4	F474 I476 L519 Y527 F529 N530 Y549 V570 F572	F474-F496 AromaticContact CE2-CE1 3.93Å; F474-F496 HydrophobicContact CE2-CE1 3.93Å; F474-F496 HydrophobicContact CE2-CZ 4.09Å; F474-F496 AromaticContact CZ-CE1 3.88Å; F474-F496 HydrophobicContact CZ-CE1 3.88Å; F474-F496 AromaticContact CZ-CZ 3.91Å; F474-F496 HydrophobicContact CZ-CZ 3.91Å; I476-F496 HydrophobicContact CD1-CE1 4.05Å; I476-F496 HydrophobicContact CD1-CZ 4.14Å; F496-L519 HydrophobicContact CB-CD1 3.83Å; F496-L519 HydrophobicContact CD1-CD1 3.39Å; F496-L519 HydrophobicContact CD2-CD1 3.81Å; F496-L519 HydrophobicContact CE1-CD1 3.8Å; F496-L519 HydrophobicContact CE2-CD1 4.18Å; F496-L519 HydrophobicContact CG-CD1 3.39Å; F496-L519 HydrophobicContact CZ-CD1 4.18Å; F496-Y527 HydrophobicContact CD2-CD1 4.46Å; F496-Y527 HydrophobicContact CD2-CG 4.17Å; F496-Y527 HydrophobicContact CE2-CD1 4.48Å; F496-Y527 HydrophobicContact CE2-CD2 4.23Å; F496-Y527 HydrophobicContact CE2-CE2 4.48Å; F496-Y527 HydrophobicContact CE2-CG 4.24Å; F496-F529 HydrophobicContact CB-CD1 3.99Å; F496-F529 HydrophobicContact CB-CE1 4.23Å; F496-F529 CarbonylContact O-C 3.59Å; F496-F529 VanDerWaalsContact O-CA 3.31Å; F496-F529 WeakPolarHBondContact O-CA 3.36Å; F496-F529 WeakPolarHBondContact O-CD1 3.36Å; F496-N530 PolarHBondContact O-N 2.86Å; F496-Y549 AromaticContact CE2-CD1 3.79Å; F496-Y549 HydrophobicContact CE2-CD1 3.79Å; F496-Y549 AromaticContact CE2-CE1 3.51Å; F496-Y549 HydrophobicContact CE2-CE1 3.51Å; F496-Y549 HydrophobicContact CE2-CG 4.49Å; F496-Y549 AromaticContact CZ-CD1 3.74Å; F496-Y549 HydrophobicContact CZ-CD1 3.74Å; F496-Y549 HydrophobicContact CZ-CD2 4.14Å; F496-Y549 AromaticContact CZ-CE1 3.61Å; F496-Y549 HydrophobicContact CZ-CE1 3.61Å; F496-Y549 HydrophobicContact CZ-CE2 4.02Å; F496-Y549 AromaticContact CZ-CG 4Å; F496-Y549 HydrophobicContact CZ-CG 4Å; F496-Y549 AromaticContact CZ-CZ 3.73Å; F496-V570 HydrophobicContact CB-CG1 3.86Å; F496-V570 HydrophobicContact CD1-CG1 4Å; F496-V570 HydrophobicContact CG-CG1 4.4Å; F496-F572 AromaticContact CD1-CD2 3.87Å; F496-F572 HydrophobicContact CD1-CD2 3.87Å; F496-F572 AromaticContact CE1-CD2 3.52Å; F496-F572 HydrophobicContact CE1-CD2 3.52Å; F496-F572 HydrophobicContact CE1-CE2 4.15Å; F496-F572 HydrophobicContact CE1-CG 4.47Å; F496-F572 HydrophobicContact CE2-CE2 4.48Å; F496-F572 AromaticContact CZ-CD2 3.89Å; F496-F572 HydrophobicContact CZ-CD2 3.89Å; F496-F572 HydrophobicContact CZ-CE2 4.04Å
497	Y	90.4	Very high	90.4	Very high	21 Å²	21	46.3 Å²	46.3	8%	0.082	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	141.9	-168.7	168.8	-90.7	0	0	0	112.8	R387 S495 E499 N530 V570 L571 K573	R387-Y497 VanDerWaalsContact CZ-OH 3.27Å; R387-Y497 PolarHBondContact NH1-OH 3.37Å; R387-Y497 PolarHBondContact NH2-OH 2.9Å; S495-Y497 PolarHBondContact O-N 2.93Å; Y497-E499 HydrophobicContact CE1-CG 4.36Å; Y497-E499 VanDerWaalsContact CZ-OE1 3.32Å; Y497-E499 VanDerWaalsContact OH-CD 3.3Å; Y497-E499 PolarHBondContact OH-OE1 2.84Å; Y497-N530 WeakPolarHBondContact CA-OD1 3.4Å; Y497-N530 WeakPolarHBondContact CD2-OD1 3.47Å; Y497-V570 CarbonylContact O-C 3.56Å; Y497-V570 WeakPolarHBondContact O-CA 3.29Å; Y497-L571 WeakPolarHBondContact CB-O 3.48Å; Y497-L571 HydrophobicContact CD1-CB 3.97Å; Y497-L571 HydrophobicContact CD1-CD1 3.76Å; Y497-L571 HydrophobicContact CD1-CG 4.05Å; Y497-L571 HydrophobicContact CE1-CD1 3.93Å; Y497-L571 PolarHBondContact N-O 2.91Å; Y497-L571 PolarHBondContact O-N 3.32Å; Y497-K573 HydrophobicContact CD1-CD 4.26Å; Y497-K573 VanDerWaalsContact CD1-CE 3.45Å; Y497-K573 HydrophobicContact CD2-CD 4.48Å; Y497-K573 HydrophobicContact CG-CD 3.91Å
498	T	86	Confident	91.2	Very high	4 Å²	4	40.8 Å²	40.8	3%	0.025	21%	0.211	C	C	.	.			trans	-155.8	155	178.2	-175.6	0	0	0	0	111.8	E500 L502 L509 F529 N530	T498-E500 PolarHBondContact OG1-N 2.82Å; T498-E500 VanDerWaalsContact OG1-N 3.15Å; T498-L502 HydrophobicContact CG2-CD1 4.42Å; T498-L502 HydrophobicContact CG2-CD2 3.85Å; T498-L502 HydrophobicContact CG2-CG 4.28Å; T498-L509 HydrophobicContact CG2-CD1 3.29Å; T498-L509 HydrophobicContact CG2-CD2 4.45Å; T498-L509 HydrophobicContact CG2-CG 4.45Å; T498-F529 HydrophobicContact CG2-CB 4.33Å; T498-F529 HydrophobicContact CG2-CD1 3.91Å; T498-F529 HydrophobicContact CG2-CG 4.33Å; T498-N530 PolarHBondContact N-OD1 3.49Å; T498-N530 PolarHBondContact O-ND2 2.78Å; T498-N530 PolarHBondContact O-OD1 3.2Å
499	E	78.5	Confident	91.7	Very high	77 Å²	77	38.6 Å²	38.6	36%	0.36	20%	0.199	S	C	.	.	S	Bend	trans	-103.4	-2.2	171.8	-69.4	-66.1	173.7	0	0	112.9	G328 R385 R387 Y497	G328-E499 WeakPolarHBondContact CA-OE1 3.29Å; R385-E499 IonicContact CZ-OE2 3.93Å; R385-E499 IonicContact NH1-OE2 2.64Å; R385-E499 PolarHBondContact NH1-OE2 2.91Å; R385-E499 IonicContact NH2-OE2 3.12Å; R387-E499 IonicContact CZ-OE1 3.59Å; R387-E499 IonicContact NH2-OE1 3.03Å; R387-E499 PolarHBondContact NH2-OE1 2.89Å; Y497-E499 HydrophobicContact CE1-CG 4.36Å; Y497-E499 VanDerWaalsContact CZ-OE1 3.32Å; Y497-E499 VanDerWaalsContact OH-CD 3.3Å; Y497-E499 PolarHBondContact OH-OE1 2.84Å
500	E	84	Confident	91.7	Very high	77 Å²	77	39.6 Å²	39.6	36%	0.36	20%	0.198	S	C	.	.	S	Bend	trans	-71.7	170.1	175.1	-43.3	-69.2	166.4	0	0	111.2	T498 L502 L509	T498-E500 PolarHBondContact OG1-N 2.82Å; T498-E500 VanDerWaalsContact OG1-N 3.15Å; E500-L502 PolarHBondContact O-N 2.74Å; E500-L509 HydrophobicContact CB-CD1 3.49Å; E500-L509 VanDerWaalsContact CB-CD1 3.49Å; E500-L509 HydrophobicContact CB-CG 4.11Å; E500-L509 HydrophobicContact CG-CD1 4.09Å; E500-L509 HydrophobicContact CG-CD2 4.39Å; E500-L509 HydrophobicContact CG-CG 4.39Å
501	T	86	Confident	91.5	Very high	93 Å²	93	40.5 Å²	40.5	57%	0.571	20%	0.203	S	C	*	.	P	Polyproline II helix	trans	-67.6	125.5	178.8	-59.5	0	0	0	0	110.8	L510	T501-L510 HydrophobicContact CG2-CD1 3.8Å; T501-L510 HydrophobicContact CG2-CG 4.35Å; T501-L510 PolarHBondContact O-N 3.23Å
502	L	88.6	Confident	90.9	Very high	31 Å²	31	38.8 Å²	38.8	16%	0.162	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	142.8	176.5	-69.8	173.5	0	0	0	111.1	T498 E500 D506 A508 L509 F529 N530	T498-L502 HydrophobicContact CG2-CD1 4.42Å; T498-L502 HydrophobicContact CG2-CD2 3.85Å; T498-L502 HydrophobicContact CG2-CG 4.28Å; E500-L502 PolarHBondContact O-N 2.74Å; L502-D506 HydrophobicContact CB-CB 4.32Å; L502-D506 WeakPolarHBondContact CB-OD1 3.37Å; L502-D506 HydrophobicContact CD1-CB 4.02Å; L502-A508 CarbonylContact C-O 3.55Å; L502-A508 WeakPolarHBondContact CA-O 3.45Å; L502-L509 HydrophobicContact CD2-CB 4.39Å; L502-L509 HydrophobicContact CD2-CD1 3.67Å; L502-L509 HydrophobicContact CG-CD1 4.44Å; L502-F529 HydrophobicContact CD1-CB 3.82Å; L502-F529 HydrophobicContact CD2-CB 3.57Å; L502-F529 HydrophobicContact CD2-CD2 3.8Å; L502-F529 HydrophobicContact CD2-CG 3.73Å; L502-F529 HydrophobicContact CG-CB 4.38Å; L502-N530 WeakPolarHBondContact CD1-ND2 3.3Å
503	V	91.8	Very high	90.6	Very high	46 Å²	46	39.3 Å²	39.3	28%	0.279	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	172.8	177.5	-61.6	0	0	0	0	110.4	D506 K507 A508 L510	V503-D506 PolarHBondContact O-N 3.15Å; V503-K507 PolarHBondContact O-N 3.29Å; V503-A508 HydrophobicContact CG2-CB 3.85Å; V503-A508 PolarHBondContact N-O 2.83Å; V503-A508 PolarHBondContact O-N 3.39Å; V503-A508 VanDerWaalsContact O-N 3.13Å; V503-L510 HydrophobicContact CB-CD2 4.44Å; V503-L510 HydrophobicContact CG1-CD1 3.87Å; V503-L510 HydrophobicContact CG1-CD2 3.88Å; V503-L510 HydrophobicContact CG1-CG 3.87Å; V503-L510 HydrophobicContact CG2-CD2 3.64Å; V503-L510 HydrophobicContact CG2-CG 4.32Å
504	E	94	Very high	90.4	Very high	78 Å²	78	39.4 Å²	39.4	36%	0.364	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	54.5	178.6	-58.2	175.6	176.3	0	0	112.8	D506 K507 A508 K516 R518	E504-D506 VanDerWaalsContact C-N 3.28Å; E504-D506 PolarHBondContact O-N 2.97Å; E504-K507 VanDerWaalsContact O-CB 3.27Å; E504-K507 WeakPolarHBondContact O-CB 3.17Å; E504-K507 PolarHBondContact O-N 2.94Å; E504-K507 VanDerWaalsContact O-N 3.16Å; E504-A508 HydrophobicContact CB-CB 4.45Å; E504-K516 IonicContact OE1-NZ 2.96Å; E504-K516 PolarHBondContact OE1-NZ 3Å; E504-R518 IonicContact OE1-NH2 3.26Å; E504-R518 PolarHBondContact OE1-NH2 2.99Å; E504-R518 VanDerWaalsContact OE1-NH2 3.12Å; E504-R518 IonicContact OE2-CZ 2.74Å; E504-R518 IonicContact OE2-NE 3.31Å; E504-R518 PolarHBondContact OE2-NE 3.06Å; E504-R518 IonicContact OE2-NH2 3.91Å; E504-R518 PolarHBondContact OE2-NH2 3.06Å
505	E	93.1	Very high	90.4	Very high	150 Å²	150	39 Å²	39	70%	0.701	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.6	43.6	-176.8	-53.4	171.1	172.9	0	0	112.2	K507	E505-K507 PolarHBondContact O-N 3.04Å; E505-K507 IonicContact OE2-NZ 3.78Å; E505-K507 PolarHBondContact OE2-NZ 2.78Å
506	D	93.3	Very high	90.4	Very high	41 Å²	41	39.8 Å²	39.8	22%	0.219	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	18.2	-179.2	-56.5	-31.1	0	0	0	114.8	K287 L502 V503 E504 T528 F529	K287-D506 IonicContact NZ-OD1 2.85Å; K287-D506 PolarHBondContact NZ-OD1 2.85Å; K287-D506 IonicContact NZ-OD2 3.23Å; K287-D506 PolarHBondContact NZ-OD2 3.4Å; L502-D506 HydrophobicContact CB-CB 4.32Å; L502-D506 WeakPolarHBondContact CB-OD1 3.37Å; L502-D506 HydrophobicContact CD1-CB 4.02Å; V503-D506 PolarHBondContact O-N 3.15Å; E504-D506 VanDerWaalsContact C-N 3.28Å; E504-D506 PolarHBondContact O-N 2.97Å; D506-T528 HydrophobicContact CB-CG2 3.92Å; D506-F529 WeakPolarHBondContact O-CD2 3.36Å; D506-F529 PolarHBondContact O-N 3.16Å
507	K	97.2	Very high	90.6	Very high	63 Å²	63	40 Å²	40	27%	0.274	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-6.9	179.4	-67.1	163.2	-178.7	157	0	114.5	V503 E504 E505 R518 P526 Y527	V503-K507 PolarHBondContact O-N 3.29Å; E504-K507 VanDerWaalsContact O-CB 3.27Å; E504-K507 WeakPolarHBondContact O-CB 3.17Å; E504-K507 PolarHBondContact O-N 2.94Å; E504-K507 VanDerWaalsContact O-N 3.16Å; E505-K507 PolarHBondContact O-N 3.04Å; E505-K507 IonicContact OE2-NZ 3.78Å; E505-K507 PolarHBondContact OE2-NZ 2.78Å; K507-R518 WeakPolarHBondContact O-CG 3.07Å; K507-P526 HydrophobicContact CB-CB 4.15Å; K507-P526 HydrophobicContact CB-CG 4.37Å; K507-P526 HydrophobicContact CD-CG 4.13Å; K507-P526 HydrophobicContact CG-CG 4.43Å; K507-Y527 WeakPolarHBondContact CA-O 3.11Å
508	A	96.9	Very high	90.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	138.8	177.8	0	0	0	0	0	111.6	L502 V503 E504 K516 L517 R518	L502-A508 CarbonylContact C-O 3.55Å; L502-A508 WeakPolarHBondContact CA-O 3.45Å; V503-A508 HydrophobicContact CG2-CB 3.85Å; V503-A508 PolarHBondContact N-O 2.83Å; V503-A508 PolarHBondContact O-N 3.39Å; V503-A508 VanDerWaalsContact O-N 3.13Å; E504-A508 HydrophobicContact CB-CB 4.45Å; A508-K516 HydrophobicContact CB-CD 4.24Å; A508-L517 WeakPolarHBondContact CA-O 3.34Å; A508-R518 HydrophobicContact CB-CG 3.82Å
509	L	93.1	Very high	91.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130	177.5	-171.8	67.5	0	0	0	110.5	T498 E500 L502 I511 K516 L517 F529 T568 V570	T498-L509 HydrophobicContact CG2-CD1 3.29Å; T498-L509 HydrophobicContact CG2-CD2 4.45Å; T498-L509 HydrophobicContact CG2-CG 4.45Å; E500-L509 HydrophobicContact CB-CD1 3.49Å; E500-L509 VanDerWaalsContact CB-CD1 3.49Å; E500-L509 HydrophobicContact CB-CG 4.11Å; E500-L509 HydrophobicContact CG-CD1 4.09Å; E500-L509 HydrophobicContact CG-CD2 4.39Å; E500-L509 HydrophobicContact CG-CG 4.39Å; L502-L509 HydrophobicContact CD2-CB 4.39Å; L502-L509 HydrophobicContact CD2-CD1 3.67Å; L502-L509 HydrophobicContact CG-CD1 4.44Å; L509-I511 HydrophobicContact CB-CG2 4.42Å; L509-I511 HydrophobicContact CD2-CG2 4.02Å; L509-I511 HydrophobicContact CG-CG2 4.09Å; L509-K516 CarbonylContact O-C 3.55Å; L509-K516 WeakPolarHBondContact O-CA 3.44Å; L509-K516 WeakPolarHBondContact O-CB 3.33Å; L509-L517 HydrophobicContact CB-CB 4.32Å; L509-L517 PolarHBondContact N-O 3.46Å; L509-L517 PolarHBondContact O-N 2.89Å; L509-F529 HydrophobicContact CB-CE2 4.25Å; L509-F529 HydrophobicContact CB-CZ 4.1Å; L509-T568 HydrophobicContact CD2-CG2 3.89Å; L509-V570 HydrophobicContact CD2-CG2 3.96Å
510	L	91.1	Very high	92.4	Very high	50 Å²	50	38.6 Å²	38.6	26%	0.262	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	125.5	169.1	-56.4	-170.6	0	0	0	109.5	T501 V503 K516 I556	T501-L510 HydrophobicContact CG2-CD1 3.8Å; T501-L510 HydrophobicContact CG2-CG 4.35Å; T501-L510 PolarHBondContact O-N 3.23Å; V503-L510 HydrophobicContact CB-CD2 4.44Å; V503-L510 HydrophobicContact CG1-CD1 3.87Å; V503-L510 HydrophobicContact CG1-CD2 3.88Å; V503-L510 HydrophobicContact CG1-CG 3.87Å; V503-L510 HydrophobicContact CG2-CD2 3.64Å; V503-L510 HydrophobicContact CG2-CG 4.32Å; L510-K516 HydrophobicContact CD2-CB 4.27Å; L510-I556 HydrophobicContact CD2-CD1 3.62Å; L510-I556 HydrophobicContact CD2-CG1 4.2Å
511	I	87.6	Confident	92.8	Very high	18 Å²	18	36.4 Å²	36.4	9%	0.092	19%	0.193	C	C	.	.			trans	-115.9	11.7	-174.9	70	170.7	0	0	0	113.2	L509 L515 L517 L553 F566 T568	L509-I511 HydrophobicContact CB-CG2 4.42Å; L509-I511 HydrophobicContact CD2-CG2 4.02Å; L509-I511 HydrophobicContact CG-CG2 4.09Å; I511-L515 HydrophobicContact CD1-CB 4.09Å; I511-L515 HydrophobicContact CG1-CB 3.81Å; I511-L515 PolarHBondContact N-O 2.82Å; I511-L517 HydrophobicContact CG2-CB 3.79Å; I511-L553 HydrophobicContact CD1-CD1 3.29Å; I511-L553 HydrophobicContact CG1-CD1 4.4Å; I511-F566 HydrophobicContact CD1-CD2 3.53Å; I511-F566 HydrophobicContact CD1-CE2 3.95Å; I511-F566 HydrophobicContact CD1-CG 4.35Å; I511-F566 HydrophobicContact CG1-CD2 4.46Å; I511-T568 HydrophobicContact CB-CG2 4.39Å; I511-T568 HydrophobicContact CG2-CG2 3.66Å
512	G	83.6	Confident	93	Very high	31 Å²	31	37.5 Å²	37.5	32%	0.32	19%	0.192	S	C	.	.	S	Bend	trans	86.1	178.3	-174.8	0	0	0	0	0	113.8	G514 L515	G512-G514 PolarHBondContact O-N 2.99Å; G512-L515 WeakPolarHBondContact O-CB 3.39Å; G512-L515 PolarHBondContact O-N 3.13Å
513	N	88.9	Confident	93.2	Very high	12 Å²	12	41.8 Å²	41.8	6%	0.064	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	24.1	177.6	-60.7	-12.2	0	0	0	115.8	L515 I561 E562 G564 P565	N513-L515 VanDerWaalsContact C-N 3.27Å; N513-L515 HydrophobicContact CB-CD1 4.5Å; N513-L515 PolarHBondContact O-N 3.07Å; N513-I561 WeakPolarHBondContact O-CA 3.42Å; N513-I561 VanDerWaalsContact O-CG2 3.31Å; N513-I561 WeakPolarHBondContact O-CG2 3.35Å; N513-E562 PolarHBondContact O-N 2.93Å; N513-E562 VanDerWaalsContact O-N 3.17Å; N513-G564 PolarHBondContact ND2-O 2.97Å; N513-P565 PolarHBondContact ND2-O 2.87Å
514	G	91.2	Very high	93.3	Very high	11 Å²	11	42.9 Å²	42.9	11%	0.113	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	17.9	-175.2	0	0	0	0	0	114.1	G512 I556	G512-G514 PolarHBondContact O-N 2.99Å; G514-I556 PolarHBondContact O-N 3.24Å
515	L	94	Very high	93.4	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.016	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	152.2	-178.8	-57.5	176.7	0	0	0	111.6	F460 I465 I511 G512 N513 L553 S554 I561 F566	F460-L515 HydrophobicContact CZ-CD1 4.16Å; I465-L515 HydrophobicContact CG1-CD2 3.74Å; I511-L515 HydrophobicContact CD1-CB 4.09Å; I511-L515 HydrophobicContact CG1-CB 3.81Å; I511-L515 PolarHBondContact N-O 2.82Å; G512-L515 WeakPolarHBondContact O-CB 3.39Å; G512-L515 PolarHBondContact O-N 3.13Å; N513-L515 VanDerWaalsContact C-N 3.27Å; N513-L515 HydrophobicContact CB-CD1 4.5Å; N513-L515 PolarHBondContact O-N 3.07Å; L515-L553 HydrophobicContact CB-CD1 4.06Å; L515-L553 HydrophobicContact CD1-CD1 4.22Å; L515-L553 HydrophobicContact CD1-CD2 4.48Å; L515-S554 WeakPolarHBondContact CA-O 3.45Å; L515-I561 HydrophobicContact CD2-CD1 4.38Å; L515-I561 HydrophobicContact CD2-CG2 4.04Å; L515-I561 HydrophobicContact CG-CG2 4.47Å; L515-F566 HydrophobicContact CD1-CD1 4.05Å; L515-F566 HydrophobicContact CD1-CE1 4.23Å; L515-F566 HydrophobicContact CD1-CG 4.31Å
516	K	95.6	Very high	93.6	Very high	19 Å²	19	37.4 Å²	37.4	8%	0.083	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	152	171.6	67.4	-175.6	-179.2	-174.3	0	111	E504 A508 L509 L510 S554 I556	E504-K516 IonicContact OE1-NZ 2.96Å; E504-K516 PolarHBondContact OE1-NZ 3Å; A508-K516 HydrophobicContact CB-CD 4.24Å; L509-K516 CarbonylContact O-C 3.55Å; L509-K516 WeakPolarHBondContact O-CA 3.44Å; L509-K516 WeakPolarHBondContact O-CB 3.33Å; L510-K516 HydrophobicContact CD2-CB 4.27Å; K516-S554 WeakPolarHBondContact CE-OG 3.33Å; K516-S554 VanDerWaalsContact CG-OG 3.28Å; K516-S554 WeakPolarHBondContact CG-OG 3.27Å; K516-S554 PolarHBondContact N-O 2.65Å; K516-S554 PolarHBondContact O-N 2.82Å; K516-I556 HydrophobicContact CB-CG1 4Å; K516-I556 HydrophobicContact CD-CG1 4.34Å; K516-I556 HydrophobicContact CG-CG1 4.28Å
517	L	97.1	Very high	93.6	Very high	14 Å²	14	37.5 Å²	37.5	7%	0.073	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	129.7	176.3	-179.9	70.9	0	0	0	109.8	F457 A508 L509 I511 A551 E552 T568	F457-L517 HydrophobicContact CE2-CD1 4.22Å; F457-L517 HydrophobicContact CZ-CD1 4.12Å; A508-L517 WeakPolarHBondContact CA-O 3.34Å; L509-L517 HydrophobicContact CB-CB 4.32Å; L509-L517 PolarHBondContact N-O 3.46Å; L509-L517 PolarHBondContact O-N 2.89Å; I511-L517 HydrophobicContact CG2-CB 3.79Å; L517-A551 HydrophobicContact CD1-CB 4.13Å; L517-E552 CarbonylContact C-O 3.51Å; L517-E552 WeakPolarHBondContact CA-O 3.49Å; L517-T568 HydrophobicContact CD2-CG2 4.11Å
518	R	98.1	Very high	93.6	Very high	55 Å²	55	36.7 Å²	36.7	21%	0.208	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	150	164.4	-58.5	-165.5	-172.4	124.3	-15.8	109.8	E504 K507 A508 L520 E552	E504-R518 IonicContact OE1-NH2 3.26Å; E504-R518 PolarHBondContact OE1-NH2 2.99Å; E504-R518 VanDerWaalsContact OE1-NH2 3.12Å; E504-R518 IonicContact OE2-CZ 2.74Å; E504-R518 IonicContact OE2-NE 3.31Å; E504-R518 PolarHBondContact OE2-NE 3.06Å; E504-R518 IonicContact OE2-NH2 3.91Å; E504-R518 PolarHBondContact OE2-NH2 3.06Å; K507-R518 WeakPolarHBondContact O-CG 3.07Å; A508-R518 HydrophobicContact CB-CG 3.82Å; R518-L520 HydrophobicContact CB-CD2 3.97Å; R518-E552 HydrophobicContact CB-CB 4.35Å; R518-E552 IonicContact CZ-OE1 3.74Å; R518-E552 PolarHBondContact N-O 2.89Å; R518-E552 IonicContact NH1-OE1 3.02Å; R518-E552 PolarHBondContact NH1-OE1 2.86Å; R518-E552 PolarHBondContact O-N 3Å
519	L	97.8	Very high	93.5	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	126.8	167	-57.1	-179.5	0	0	0	107.4	F474 F496 P526 Y527 F529 T550 A551 V570	F474-L519 HydrophobicContact CE1-CD2 3.92Å; F474-L519 HydrophobicContact CZ-CD1 4.42Å; F474-L519 HydrophobicContact CZ-CD2 4.16Å; F496-L519 HydrophobicContact CB-CD1 3.83Å; F496-L519 HydrophobicContact CD1-CD1 3.39Å; F496-L519 HydrophobicContact CD2-CD1 3.81Å; F496-L519 HydrophobicContact CE1-CD1 3.8Å; F496-L519 HydrophobicContact CE2-CD1 4.18Å; F496-L519 HydrophobicContact CG-CD1 3.39Å; F496-L519 HydrophobicContact CZ-CD1 4.18Å; L519-P526 WeakPolarHBondContact O-CA 3.45Å; L519-Y527 HydrophobicContact CB-CD2 4.43Å; L519-Y527 WeakPolarHBondContact O-CD2 3.43Å; L519-Y527 PolarHBondContact O-N 3Å; L519-F529 HydrophobicContact CD1-CE1 3.86Å; L519-F529 HydrophobicContact CD1-CZ 4.03Å; L519-F529 HydrophobicContact CG-CE1 4.18Å; L519-F529 HydrophobicContact CG-CZ 3.81Å; L519-T550 CarbonylContact C-O 3.53Å; L519-T550 WeakPolarHBondContact CA-O 3.45Å; L519-A551 HydrophobicContact CD2-CB 3.95Å; L519-V570 HydrophobicContact CD1-CG1 4.25Å
520	L	97.5	Very high	93.5	Very high	15 Å²	15	37 Å²	37	8%	0.079	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	146.4	-175.5	-45.5	179.5	0	0	0	110.5	R518 S525 P526 Y549 T550 E552	R518-L520 HydrophobicContact CB-CD2 3.97Å; L520-S525 WeakPolarHBondContact CA-O 3.45Å; L520-P526 HydrophobicContact CD2-CB 3.88Å; L520-Y549 WeakPolarHBondContact O-CA 3.38Å; L520-T550 PolarHBondContact N-O 3.22Å; L520-T550 PolarHBondContact O-N 3.3Å; L520-E552 HydrophobicContact CD1-CB 4.03Å; L520-E552 HydrophobicContact CG-CB 4.26Å
521	D	92.8	Very high	93.7	Very high	30 Å²	30	40.2 Å²	40.2	16%	0.16	23%	0.226	C	C	.	.			trans	-78.4	-178.9	170.4	76.8	4	0	0	0	112	N523 A524 S525 Y527	D521-N523 PolarHBondContact O-N 2.82Å; D521-N523 VanDerWaalsContact OD1-C 3.22Å; D521-N523 VanDerWaalsContact OD1-CA 3.24Å; D521-N523 WeakPolarHBondContact OD1-CA 3.33Å; D521-N523 WeakPolarHBondContact OD1-CB 3.33Å; D521-N523 PolarHBondContact OD1-N 2.96Å; D521-A524 PolarHBondContact O-N 3.41Å; D521-A524 PolarHBondContact OD1-N 3.18Å; D521-A524 VanDerWaalsContact OD1-N 3.08Å; D521-S525 PolarHBondContact N-O 3.03Å; D521-S525 WeakPolarHBondContact OD1-CB 3.47Å; D521-S525 PolarHBondContact OD1-N 3.1Å; D521-Y527 HydrophobicContact CB-CD2 4.44Å; D521-Y527 HydrophobicContact CB-CE2 3.47Å; D521-Y527 VanDerWaalsContact CB-CE2 3.47Å; D521-Y527 WeakPolarHBondContact CB-OH 3.22Å
522	E	90.5	Very high	94	Very high	117 Å²	117	40.7 Å²	40.7	55%	0.547	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-21.3	176.6	62.3	-84.6	-160.6	0	0	113.9	K547	E522-K547 IonicContact OE1-NZ 3.11Å; E522-K547 PolarHBondContact OE1-NZ 3.33Å; E522-K547 WeakPolarHBondContact OE2-CE 3.44Å; E522-K547 IonicContact OE2-NZ 3.46Å; E522-K547 PolarHBondContact OE2-NZ 2.97Å
523	N	92.5	Very high	94.5	Very high	120 Å²	120	41.7 Å²	41.7	64%	0.642	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.2	12.3	176.4	-56	-56	0	0	0	112	D521 S525	D521-N523 PolarHBondContact O-N 2.82Å; D521-N523 VanDerWaalsContact OD1-C 3.22Å; D521-N523 VanDerWaalsContact OD1-CA 3.24Å; D521-N523 WeakPolarHBondContact OD1-CA 3.33Å; D521-N523 WeakPolarHBondContact OD1-CB 3.33Å; D521-N523 PolarHBondContact OD1-N 2.96Å; N523-S525 PolarHBondContact O-N 2.8Å
524	A	93.7	Very high	94.8	Very high	69 Å²	69	47 Å²	47	57%	0.57	26%	0.257	S	S	*	.	S	Bend	trans	59	22	-174.4	0	0	0	0	0	114.5	D521	D521-A524 PolarHBondContact O-N 3.41Å; D521-A524 PolarHBondContact OD1-N 3.18Å; D521-A524 VanDerWaalsContact OD1-N 3.08Å
525	S	95.8	Very high	95	Very high	58 Å²	58	47 Å²	47	41%	0.406	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-86.7	135.1	175	-62.7	0	0	0	0	110.4	L520 D521 N523	L520-S525 WeakPolarHBondContact CA-O 3.45Å; D521-S525 PolarHBondContact N-O 3.03Å; D521-S525 WeakPolarHBondContact OD1-CB 3.47Å; D521-S525 PolarHBondContact OD1-N 3.1Å; N523-S525 PolarHBondContact O-N 2.8Å
526	P	96.7	Very high	95	Very high	55 Å²	55	46.9 Å²	46.9	36%	0.357	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-75.6	134	-177	30.1	-35.1	0	0	0	112.2	K507 L519 L520	K507-P526 HydrophobicContact CB-CB 4.15Å; K507-P526 HydrophobicContact CB-CG 4.37Å; K507-P526 HydrophobicContact CD-CG 4.13Å; K507-P526 HydrophobicContact CG-CG 4.43Å; L519-P526 WeakPolarHBondContact O-CA 3.45Å; L520-P526 HydrophobicContact CD2-CB 3.88Å
527	Y	95.1	Very high	95	Very high	44 Å²	44	48.2 Å²	48.2	17%	0.173	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-69.2	143.8	169.4	-75.3	-86.2	0	0	0	110.9	F496 K507 L519 D521 K547 Y549	F496-Y527 HydrophobicContact CD2-CD1 4.46Å; F496-Y527 HydrophobicContact CD2-CG 4.17Å; F496-Y527 HydrophobicContact CE2-CD1 4.48Å; F496-Y527 HydrophobicContact CE2-CD2 4.23Å; F496-Y527 HydrophobicContact CE2-CE2 4.48Å; F496-Y527 HydrophobicContact CE2-CG 4.24Å; K507-Y527 WeakPolarHBondContact CA-O 3.11Å; L519-Y527 HydrophobicContact CB-CD2 4.43Å; L519-Y527 WeakPolarHBondContact O-CD2 3.43Å; L519-Y527 PolarHBondContact O-N 3Å; D521-Y527 HydrophobicContact CB-CD2 4.44Å; D521-Y527 HydrophobicContact CB-CE2 3.47Å; D521-Y527 VanDerWaalsContact CB-CE2 3.47Å; D521-Y527 WeakPolarHBondContact CB-OH 3.22Å; Y527-K547 WeakPolarHBondContact OH-CE 3.27Å; Y527-K547 PolarHBondContact OH-NZ 2.92Å; Y527-Y549 HydrophobicContact CD2-CD1 4.25Å; Y527-Y549 HydrophobicContact CD2-CE1 4.43Å; Y527-Y549 HydrophobicContact CE1-CE1 4.33Å; Y527-Y549 AromaticContact CE2-CD1 3.49Å; Y527-Y549 HydrophobicContact CE2-CD1 3.49Å; Y527-Y549 VanDerWaalsContact CE2-CD1 3.49Å; Y527-Y549 AromaticContact CE2-CE1 3.57Å; Y527-Y549 HydrophobicContact CE2-CE1 3.57Å; Y527-Y549 AromaticContact CZ-CD1 3.95Å; Y527-Y549 AromaticContact CZ-CE1 3.53Å; Y527-Y549 WeakPolarHBondContact OH-CE1 3.45Å
528	T	96.9	Very high	94.8	Very high	46 Å²	46	47.6 Å²	47.6	28%	0.282	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-82.6	119.1	166.6	-51.3	0	0	0	0	108.2	D506 K531	D506-T528 HydrophobicContact CB-CG2 3.92Å; T528-K531 HydrophobicContact CG2-CB 4.08Å; T528-K531 HydrophobicContact CG2-CD 4.16Å
529	F	94.8	Very high	94.5	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.009	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	155	175.3	-73	-92.5	0	0	0	110.8	F496 T498 L502 D506 L509 L519 K531 V570	F496-F529 HydrophobicContact CB-CD1 3.99Å; F496-F529 HydrophobicContact CB-CE1 4.23Å; F496-F529 CarbonylContact O-C 3.59Å; F496-F529 VanDerWaalsContact O-CA 3.31Å; F496-F529 WeakPolarHBondContact O-CA 3.36Å; F496-F529 WeakPolarHBondContact O-CD1 3.36Å; T498-F529 HydrophobicContact CG2-CB 4.33Å; T498-F529 HydrophobicContact CG2-CD1 3.91Å; T498-F529 HydrophobicContact CG2-CG 4.33Å; L502-F529 HydrophobicContact CD1-CB 3.82Å; L502-F529 HydrophobicContact CD2-CB 3.57Å; L502-F529 HydrophobicContact CD2-CD2 3.8Å; L502-F529 HydrophobicContact CD2-CG 3.73Å; L502-F529 HydrophobicContact CG-CB 4.38Å; D506-F529 WeakPolarHBondContact O-CD2 3.36Å; D506-F529 PolarHBondContact O-N 3.16Å; L509-F529 HydrophobicContact CB-CE2 4.25Å; L509-F529 HydrophobicContact CB-CZ 4.1Å; L519-F529 HydrophobicContact CD1-CE1 3.86Å; L519-F529 HydrophobicContact CD1-CZ 4.03Å; L519-F529 HydrophobicContact CG-CE1 4.18Å; L519-F529 HydrophobicContact CG-CZ 3.81Å; F529-K531 PolarHBondContact O-N 3.25Å; F529-K531 VanDerWaalsContact O-N 3.11Å; F529-V570 HydrophobicContact CD1-CG1 4.34Å; F529-V570 HydrophobicContact CE1-CG1 3.96Å; F529-V570 HydrophobicContact CE1-CG2 3.97Å
530	N	92.4	Very high	94	Very high	5 Å²	5	51.9 Å²	51.9	3%	0.027	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	22	177.8	-58.2	-17.8	0	0	0	114.6	D285 R385 S495 F496 Y497 T498 L502	D285-N530 HydrophobicContact CB-CB 4.01Å; D285-N530 PolarHBondContact N-O 2.78Å; R385-N530 PolarHBondContact NH2-ND2 3.27Å; R385-N530 VanDerWaalsContact NH2-ND2 3.11Å; S495-N530 WeakPolarHBondContact OG-CA 3.41Å; F496-N530 PolarHBondContact O-N 2.86Å; Y497-N530 WeakPolarHBondContact CA-OD1 3.4Å; Y497-N530 WeakPolarHBondContact CD2-OD1 3.47Å; T498-N530 PolarHBondContact N-OD1 3.49Å; T498-N530 PolarHBondContact O-ND2 2.78Å; T498-N530 PolarHBondContact O-OD1 3.2Å; L502-N530 WeakPolarHBondContact CD1-ND2 3.3Å
531	K	94.9	Very high	93.5	Very high	116 Å²	116	59 Å²	59	50%	0.504	33%	0.331	S	S	.	.			trans	-126.8	126.5	177.3	-172.4	174.4	-176.1	176	0	110.2	S495 T528 F529	S495-K531 PolarHBondContact OG-N 3.11Å; S495-K531 PolarHBondContact OG-O 2.77Å; T528-K531 HydrophobicContact CG2-CB 4.08Å; T528-K531 HydrophobicContact CG2-CD 4.16Å; F529-K531 PolarHBondContact O-N 3.25Å; F529-K531 VanDerWaalsContact O-N 3.11Å
532	Y	94.6	Very high	93.3	Very high	29 Å²	29	61.1 Å²	61.1	11%	0.114	34%	0.341	C	S	.	.			trans	-75.2	135.3	174.6	-74.5	-85.3	0	0	0	110.6	E282 D284 S494 K573 N575	E282-Y532 HydrophobicContact CB-CE2 4.46Å; E282-Y532 WeakPolarHBondContact O-CE2 3.49Å; D284-Y532 WeakPolarHBondContact OD1-CB 3.36Å; D284-Y532 WeakPolarHBondContact OD1-CD2 3.43Å; D284-Y532 PolarHBondContact OD1-N 2.94Å; S494-Y532 VanDerWaalsContact O-CA 3.31Å; S494-Y532 WeakPolarHBondContact O-CA 3.38Å; Y532-K573 HydrophobicContact CE1-CB 4.23Å; Y532-K573 WeakPolarHBondContact OH-CB 3.35Å; Y532-N575 HydrophobicContact CE1-CB 4.44Å
533	A	94.3	Very high	93.4	Very high	52 Å²	52	58.6 Å²	58.6	43%	0.43	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	155.7	170	0	0	0	0	0	109.4	S493 S494 Y535	S493-A533 CarbonylContact C-O 3.55Å; S493-A533 WeakPolarHBondContact CA-O 3.47Å; S493-A533 VanDerWaalsContact CB-O 3.25Å; S493-A533 WeakPolarHBondContact CB-O 3.35Å; S494-A533 PolarHBondContact N-O 2.98Å; S494-A533 PolarHBondContact O-N 2.76Å; A533-Y535 PolarHBondContact O-N 3.35Å
534	E	94.8	Very high	93.5	Very high	124 Å²	124	57 Å²	57	58%	0.579	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.1	132.2	172.8	-170.8	178.8	110.8	0	0	110	K491	K491-E534 WeakPolarHBondContact CD-OE2 3.34Å; K491-E534 IonicContact NZ-OE1 3.27Å; K491-E534 IonicContact NZ-OE2 2.63Å; K491-E534 PolarHBondContact NZ-OE2 2.83Å
535	Y	94.8	Very high	93.5	Very high	9 Å²	9	56.5 Å²	56.5	4%	0.035	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	-48.9	-178.5	163.1	-97.3	0	0	0	111.6	F446 I476 T478 V492 S494 A533 Y545 K547 Y549 F572	F446-Y535 HydrophobicContact CE1-CE1 4.27Å; I476-Y535 PolarHBondContact O-OH 3.49Å; T478-Y535 HydrophobicContact CG2-CE1 4.46Å; T478-Y535 WeakPolarHBondContact OG1-CE1 3.32Å; T478-Y535 PolarHBondContact OG1-OH 2.77Å; V492-Y535 HydrophobicContact CG1-CD1 4.35Å; V492-Y535 WeakPolarHBondContact O-CA 3.46Å; V492-Y535 PolarHBondContact O-N 2.81Å; S494-Y535 WeakPolarHBondContact OG-CB 3.19Å; A533-Y535 PolarHBondContact O-N 3.35Å; Y535-Y545 HydrophobicContact CD1-CD1 4.37Å; Y535-Y545 HydrophobicContact CD2-CE1 4.01Å; Y535-Y545 AromaticContact CE1-CD1 3.8Å; Y535-Y545 HydrophobicContact CE1-CD1 3.8Å; Y535-Y545 HydrophobicContact CE1-CE1 4.25Å; Y535-Y545 AromaticContact CE2-CD1 3.99Å; Y535-Y545 HydrophobicContact CE2-CD1 3.99Å; Y535-Y545 AromaticContact CE2-CE1 3.71Å; Y535-Y545 HydrophobicContact CE2-CE1 3.71Å; Y535-Y545 HydrophobicContact CG-CE1 4.43Å; Y535-Y545 AromaticContact CZ-CD1 3.6Å; Y535-Y545 AromaticContact CZ-CE1 3.84Å; Y535-Y545 WeakPolarHBondContact O-CE1 3.24Å; Y535-Y545 PolarHBondContact O-OH 2.99Å; Y535-K547 HydrophobicContact CE2-CB 3.91Å; Y535-Y549 WeakPolarHBondContact CD2-OH 3.5Å; Y535-Y549 WeakPolarHBondContact CE2-OH 3.29Å; Y535-F572 HydrophobicContact CD1-CZ 4.49Å; Y535-F572 HydrophobicContact CD2-CZ 4.04Å; Y535-F572 HydrophobicContact CE2-CZ 4.07Å; Y535-F572 HydrophobicContact CG-CZ 4.26Å
536	A	94.7	Very high	93.5	Very high	2 Å²	2	58.7 Å²	58.7	2%	0.017	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	144	179.5	0	0	0	0	0	111.6	K491 V492 F538 Y545	K491-A536 CarbonylContact C-O 3.43Å; K491-A536 WeakPolarHBondContact CA-O 3.11Å; V492-A536 HydrophobicContact CB-CB 4.47Å; V492-A536 PolarHBondContact N-O 3.17Å; V492-A536 PolarHBondContact O-N 3.47Å; V492-A536 VanDerWaalsContact O-N 3.08Å; A536-F538 HydrophobicContact CB-CD2 4.15Å; A536-F538 HydrophobicContact CB-CE2 3.5Å; A536-F538 VanDerWaalsContact CB-CE2 3.5Å; A536-F538 HydrophobicContact CB-CZ 3.88Å; A536-Y545 HydrophobicContact CB-CD1 3.69Å; A536-Y545 HydrophobicContact CB-CE1 4.39Å; A536-Y545 HydrophobicContact CB-CG 3.76Å
537	D	95.2	Very high	93.4	Very high	47 Å²	47	57.5 Å²	57.5	25%	0.251	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	105.3	176.9	-170.5	-17.2	0	0	0	110.1	K491 T539	K491-D537 WeakPolarHBondContact CE-OD2 3.48Å; K491-D537 HydrophobicContact CG-CB 4.41Å; K491-D537 IonicContact NZ-OD2 2.73Å; K491-D537 PolarHBondContact NZ-OD2 3.45Å; D537-T539 WeakPolarHBondContact OD1-CB 3.46Å; D537-T539 WeakPolarHBondContact OD1-CG2 2.92Å; D537-T539 PolarHBondContact OD1-N 3.02Å; D537-T539 PolarHBondContact OD1-OG1 3Å
538	F	93.9	Very high	93.4	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.311	C	S	.	.			trans	-103.4	26.8	178.4	-60.3	-74.1	0	0	0	112.2	V444 T478 K480 F490 V492 A536 S540 M542	V444-F538 HydrophobicContact CG1-CD2 4.09Å; V444-F538 HydrophobicContact CG1-CE2 3.66Å; V444-F538 HydrophobicContact CG1-CZ 4.1Å; T478-F538 HydrophobicContact CG2-CE2 3.86Å; T478-F538 HydrophobicContact CG2-CZ 3.74Å; K480-F538 HydrophobicContact CB-CD1 4.03Å; K480-F538 HydrophobicContact CB-CE1 4.24Å; K480-F538 HydrophobicContact CB-CG 4.48Å; K480-F538 HydrophobicContact CD-CB 4.04Å; K480-F538 HydrophobicContact CD-CD1 4.4Å; K480-F538 HydrophobicContact CD-CG 4.42Å; K480-F538 PolarHBondContact NZ-O 3.47Å; F490-F538 HydrophobicContact CD1-CB 4.49Å; F490-F538 HydrophobicContact CD2-CD2 4.35Å; F490-F538 HydrophobicContact CE1-CB 4.17Å; F490-F538 HydrophobicContact CE2-CB 4.33Å; F490-F538 AromaticContact CE2-CD2 3.69Å; F490-F538 HydrophobicContact CE2-CD2 3.69Å; F490-F538 HydrophobicContact CE2-CE2 4.45Å; F490-F538 HydrophobicContact CE2-CG 4.34Å; F490-F538 HydrophobicContact CZ-CB 4.08Å; F490-F538 AromaticContact CZ-CD2 3.96Å; F490-F538 HydrophobicContact CZ-CD2 3.96Å; F490-F538 HydrophobicContact CZ-CG 4.22Å; F490-F538 CarbonylContact O-C 3.55Å; F490-F538 WeakPolarHBondContact O-CA 3.33Å; F490-F538 WeakPolarHBondContact O-CB 3.1Å; F490-F538 PolarHBondContact O-N 3.47Å; V492-F538 HydrophobicContact CG2-CD2 4.23Å; V492-F538 HydrophobicContact CG2-CE2 4.13Å; A536-F538 HydrophobicContact CB-CD2 4.15Å; A536-F538 HydrophobicContact CB-CE2 3.5Å; A536-F538 VanDerWaalsContact CB-CE2 3.5Å; A536-F538 HydrophobicContact CB-CZ 3.88Å; F538-S540 VanDerWaalsContact C-N 3.29Å; F538-M542 WeakPolarHBondContact CD1-O 3.3Å
539	T	91.8	Very high	93.4	Very high	83 Å²	83	56.6 Å²	56.6	51%	0.509	30%	0.298	S	S	.	.	S	Bend	trans	-77	-17.6	171.7	62.5	0	0	0	0	113	K491 D537	K491-T539 HydrophobicContact CG-CG2 4.38Å; D537-T539 WeakPolarHBondContact OD1-CB 3.46Å; D537-T539 WeakPolarHBondContact OD1-CG2 2.92Å; D537-T539 PolarHBondContact OD1-N 3.02Å; D537-T539 PolarHBondContact OD1-OG1 3Å
540	S	87.1	Confident	93.5	Very high	67 Å²	67	58.2 Å²	58.2	47%	0.469	31%	0.307	S	S	.	.	S	Bend	trans	-99.4	-174.5	174.3	68.2	0	0	0	0	111.9	F538 M542	F538-S540 VanDerWaalsContact C-N 3.29Å; S540-M542 PolarHBondContact O-N 3.38Å; S540-M542 PolarHBondContact OG-N 3.24Å
541	D	85.8	Confident	93.8	Very high	164 Å²	164	58 Å²	58	88%	0.877	31%	0.306	S	S	*	.	S	Bend	trans	-68.3	4.3	175.1	-59	-32.6	0	0	0	113.9	L543	D541-L543 PolarHBondContact O-N 2.94Å
542	M	89.8	Confident	93.9	Very high	74 Å²	74	53.6 Å²	53.6	37%	0.365	29%	0.288	S	S	.	.			trans	-62.4	125.7	174.3	-171.8	-178.3	-63.6	0	0	110.1	F538 S540 I544 Y545	F538-M542 WeakPolarHBondContact CD1-O 3.3Å; S540-M542 PolarHBondContact O-N 3.38Å; S540-M542 PolarHBondContact OG-N 3.24Å; M542-I544 WeakPolarHBondContact CG-O 3.48Å; M542-Y545 HydrophobicContact SD-CD2 3.81Å; M542-Y545 HydrophobicContact SD-CG 4.37Å
543	L	91.7	Very high	94	Very high	65 Å²	65	52.2 Å²	52.2	34%	0.34	28%	0.282	S	S	.	.			trans	-106.3	-24.4	177.3	-60.7	174.2	0	0	0	112.7	T479 K480 Q482 D541	T479-L543 CarbonylContact C-O 3.4Å; T479-L543 WeakPolarHBondContact CA-O 3.33Å; K480-L543 PolarHBondContact N-O 2.91Å; Q482-L543 HydrophobicContact CG-CD2 4.02Å; D541-L543 PolarHBondContact O-N 2.94Å
544	I	94.1	Very high	94.1	Very high	85 Å²	85	49.9 Å²	49.9	44%	0.436	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	128.6	-174.8	-63.7	175	0	0	0	107.7	K477 T478 T479 M542	K477-I544 HydrophobicContact CD-CG2 4.29Å; K477-I544 VanDerWaalsContact CE-CG2 3.43Å; K477-I544 HydrophobicContact CG-CG2 4.05Å; T478-I544 WeakPolarHBondContact O-CA 3.06Å; T479-I544 HydrophobicContact CG2-CG1 3.97Å; M542-I544 WeakPolarHBondContact CG-O 3.48Å
545	Y	95.3	Very high	94.1	Very high	59 Å²	59	45.6 Å²	45.6	23%	0.231	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131	168.7	-176.7	-98	0	0	0	108.9	K477 T478 Y535 A536 M542 K547	K477-Y545 CarbonylContact C-O 3.56Å; K477-Y545 WeakPolarHBondContact CA-O 3.39Å; T478-Y545 PolarHBondContact N-O 3.12Å; T478-Y545 PolarHBondContact O-N 3.02Å; Y535-Y545 HydrophobicContact CD1-CD1 4.37Å; Y535-Y545 HydrophobicContact CD2-CE1 4.01Å; Y535-Y545 AromaticContact CE1-CD1 3.8Å; Y535-Y545 HydrophobicContact CE1-CD1 3.8Å; Y535-Y545 HydrophobicContact CE1-CE1 4.25Å; Y535-Y545 AromaticContact CE2-CD1 3.99Å; Y535-Y545 HydrophobicContact CE2-CD1 3.99Å; Y535-Y545 AromaticContact CE2-CE1 3.71Å; Y535-Y545 HydrophobicContact CE2-CE1 3.71Å; Y535-Y545 HydrophobicContact CG-CE1 4.43Å; Y535-Y545 AromaticContact CZ-CD1 3.6Å; Y535-Y545 AromaticContact CZ-CE1 3.84Å; Y535-Y545 WeakPolarHBondContact O-CE1 3.24Å; Y535-Y545 PolarHBondContact O-OH 2.99Å; A536-Y545 HydrophobicContact CB-CD1 3.69Å; A536-Y545 HydrophobicContact CB-CE1 4.39Å; A536-Y545 HydrophobicContact CB-CG 3.76Å; M542-Y545 HydrophobicContact SD-CD2 3.81Å; M542-Y545 HydrophobicContact SD-CG 4.37Å; Y545-K547 HydrophobicContact CE1-CB 3.87Å; Y545-K547 HydrophobicContact CE1-CD 4.43Å
546	E	95.5	Very high	94	Very high	104 Å²	104	47.1 Å²	47.1	49%	0.486	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	132.4	177.4	-178.3	167.4	-173.1	0	0	109.7	I476 K477	I476-E546 WeakPolarHBondContact O-CA 3.47Å; K477-E546 HydrophobicContact CB-CB 4.09Å; K477-E546 HydrophobicContact CB-CG 3.95Å; K477-E546 HydrophobicContact CG-CB 4.23Å
547	K	94.3	Very high	93.7	Very high	30 Å²	30	51.5 Å²	51.5	13%	0.13	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.1	179.9	-168	166	-166.5	170.2	0	110.3	S475 I476 E522 Y527 Y535 Y545 Y549	S475-K547 CarbonylContact C-O 3.45Å; S475-K547 VanDerWaalsContact CA-O 3.26Å; S475-K547 WeakPolarHBondContact CA-O 3.46Å; I476-K547 PolarHBondContact N-O 3.36Å; I476-K547 PolarHBondContact O-N 3.07Å; E522-K547 IonicContact OE1-NZ 3.11Å; E522-K547 PolarHBondContact OE1-NZ 3.33Å; E522-K547 WeakPolarHBondContact OE2-CE 3.44Å; E522-K547 IonicContact OE2-NZ 3.46Å; E522-K547 PolarHBondContact OE2-NZ 2.97Å; Y527-K547 WeakPolarHBondContact OH-CE 3.27Å; Y527-K547 PolarHBondContact OH-NZ 2.92Å; Y535-K547 HydrophobicContact CE2-CB 3.91Å; Y545-K547 HydrophobicContact CE1-CB 3.87Å; Y545-K547 HydrophobicContact CE1-CD 4.43Å; K547-Y549 HydrophobicContact CB-CE2 3.99Å; K547-Y549 HydrophobicContact CD-CE1 4Å; K547-Y549 HydrophobicContact CG-CE1 4.24Å; K547-Y549 HydrophobicContact CG-CE2 4.12Å; K547-Y549 WeakPolarHBondContact O-CE2 3.37Å
548	T	95.5	Very high	93.4	Very high	71 Å²	71	53.5 Å²	53.5	44%	0.436	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	133.3	173.4	-59.2	0	0	0	0	109.5	T473 S475	T473-T548 HydrophobicContact CG2-CG2 4.4Å; S475-T548 PolarHBondContact OG-OG1 3.43Å
549	Y	96.2	Very high	93.1	Very high	1 Å²	1	56.5 Å²	56.5	0%	0.004	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	156.8	178.7	-60	-86.9	0	0	0	109.6	T473 F474 I476 F496 L520 Y527 Y535 K547	T473-Y549 VanDerWaalsContact CA-O 3.25Å; T473-Y549 WeakPolarHBondContact CA-O 3.46Å; F474-Y549 HydrophobicContact CD2-CD2 4.22Å; F474-Y549 HydrophobicContact CE1-CG 4.29Å; F474-Y549 AromaticContact CE2-CD2 3.71Å; F474-Y549 HydrophobicContact CE2-CD2 3.71Å; F474-Y549 AromaticContact CE2-CG 3.99Å; F474-Y549 HydrophobicContact CE2-CG 3.99Å; F474-Y549 HydrophobicContact CZ-CD2 4.01Å; F474-Y549 AromaticContact CZ-CG 3.78Å; F474-Y549 HydrophobicContact CZ-CG 3.78Å; F474-Y549 PolarHBondContact N-O 3.12Å; F474-Y549 PolarHBondContact O-N 2.98Å; I476-Y549 HydrophobicContact CB-CE2 3.98Å; I476-Y549 HydrophobicContact CD1-CD2 4.29Å; I476-Y549 HydrophobicContact CD1-CE2 3.75Å; I476-Y549 HydrophobicContact CG1-CD2 4.12Å; I476-Y549 HydrophobicContact CG1-CE2 3.74Å; F496-Y549 AromaticContact CE2-CD1 3.79Å; F496-Y549 HydrophobicContact CE2-CD1 3.79Å; F496-Y549 AromaticContact CE2-CE1 3.51Å; F496-Y549 HydrophobicContact CE2-CE1 3.51Å; F496-Y549 HydrophobicContact CE2-CG 4.49Å; F496-Y549 AromaticContact CZ-CD1 3.74Å; F496-Y549 HydrophobicContact CZ-CD1 3.74Å; F496-Y549 HydrophobicContact CZ-CD2 4.14Å; F496-Y549 AromaticContact CZ-CE1 3.61Å; F496-Y549 HydrophobicContact CZ-CE1 3.61Å; F496-Y549 HydrophobicContact CZ-CE2 4.02Å; F496-Y549 AromaticContact CZ-CG 4Å; F496-Y549 HydrophobicContact CZ-CG 4Å; F496-Y549 AromaticContact CZ-CZ 3.73Å; L520-Y549 WeakPolarHBondContact O-CA 3.38Å; Y527-Y549 HydrophobicContact CD2-CD1 4.25Å; Y527-Y549 HydrophobicContact CD2-CE1 4.43Å; Y527-Y549 HydrophobicContact CE1-CE1 4.33Å; Y527-Y549 AromaticContact CE2-CD1 3.49Å; Y527-Y549 HydrophobicContact CE2-CD1 3.49Å; Y527-Y549 VanDerWaalsContact CE2-CD1 3.49Å; Y527-Y549 AromaticContact CE2-CE1 3.57Å; Y527-Y549 HydrophobicContact CE2-CE1 3.57Å; Y527-Y549 AromaticContact CZ-CD1 3.95Å; Y527-Y549 AromaticContact CZ-CE1 3.53Å; Y527-Y549 WeakPolarHBondContact OH-CE1 3.45Å; Y535-Y549 WeakPolarHBondContact CD2-OH 3.5Å; Y535-Y549 WeakPolarHBondContact CE2-OH 3.29Å; K547-Y549 HydrophobicContact CB-CE2 3.99Å; K547-Y549 HydrophobicContact CD-CE1 4Å; K547-Y549 HydrophobicContact CG-CE1 4.24Å; K547-Y549 HydrophobicContact CG-CE2 4.12Å; K547-Y549 WeakPolarHBondContact O-CE2 3.37Å
550	T	98	Very high	93	Very high	35 Å²	35	57 Å²	57	22%	0.215	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	118.7	171.3	-58.7	0	0	0	0	110.1	T471 L519 L520	T471-T550 HydrophobicContact CG2-CG2 3.85Å; L519-T550 CarbonylContact C-O 3.53Å; L519-T550 WeakPolarHBondContact CA-O 3.45Å; L520-T550 PolarHBondContact N-O 3.22Å; L520-T550 PolarHBondContact O-N 3.3Å
551	A	97.4	Very high	93.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	116.3	166.3	0	0	0	0	0	109.2	I455 F457 T471 K472 F474 L517 L519	I455-A551 HydrophobicContact CD1-CB 3.82Å; I455-A551 HydrophobicContact CG2-CB 3.95Å; F457-A551 HydrophobicContact CZ-CB 3.89Å; T471-A551 CarbonylContact C-O 3.53Å; T471-A551 VanDerWaalsContact CA-O 3.26Å; T471-A551 WeakPolarHBondContact CA-O 3.32Å; K472-A551 PolarHBondContact N-O 2.8Å; K472-A551 PolarHBondContact O-N 2.99Å; F474-A551 HydrophobicContact CD1-CB 4.39Å; F474-A551 HydrophobicContact CE1-CB 4.26Å; L517-A551 HydrophobicContact CD1-CB 4.13Å; L519-A551 HydrophobicContact CD2-CB 3.95Å
552	E	98	Very high	93.2	Very high	25 Å²	25	52 Å²	52	12%	0.117	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	112.2	178.6	179.7	-173.3	76	0	0	109.9	N469 M470 T471 L517 R518 L520	N469-E552 HydrophobicContact CB-CG 3.83Å; N469-E552 PolarHBondContact ND2-OE2 3.42Å; M470-E552 CarbonylContact O-C 3.56Å; M470-E552 WeakPolarHBondContact O-CA 3.24Å; T471-E552 HydrophobicContact CG2-CB 4.37Å; T471-E552 HydrophobicContact CG2-CG 4.38Å; L517-E552 CarbonylContact C-O 3.51Å; L517-E552 WeakPolarHBondContact CA-O 3.49Å; R518-E552 HydrophobicContact CB-CB 4.35Å; R518-E552 IonicContact CZ-OE1 3.74Å; R518-E552 PolarHBondContact N-O 2.89Å; R518-E552 IonicContact NH1-OE1 3.02Å; R518-E552 PolarHBondContact NH1-OE1 2.86Å; R518-E552 PolarHBondContact O-N 3Å; L520-E552 HydrophobicContact CD1-CB 4.03Å; L520-E552 HydrophobicContact CG-CB 4.26Å
553	L	96.4	Very high	93	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	127.9	170.4	-177.9	68.7	0	0	0	109.4	F457 F460 I465 N469 M470 I511 L515 F566	F457-L553 HydrophobicContact CB-CD2 4.21Å; F457-L553 HydrophobicContact CD1-CB 3.9Å; F457-L553 HydrophobicContact CD1-CD2 4.13Å; F457-L553 HydrophobicContact CD2-CD2 4.31Å; F457-L553 HydrophobicContact CE1-CB 3.6Å; F457-L553 HydrophobicContact CE2-CB 4.25Å; F457-L553 HydrophobicContact CG-CB 4.36Å; F457-L553 HydrophobicContact CG-CD2 3.95Å; F457-L553 HydrophobicContact CZ-CB 3.78Å; F460-L553 HydrophobicContact CE1-CD2 3.77Å; F460-L553 HydrophobicContact CZ-CD2 3.66Å; I465-L553 HydrophobicContact CD1-CD2 4.29Å; I465-L553 HydrophobicContact CD1-CG 4.06Å; I465-L553 WeakPolarHBondContact CD1-O 3.46Å; N469-L553 CarbonylContact C-O 3.58Å; N469-L553 WeakPolarHBondContact CA-O 3.37Å; M470-L553 HydrophobicContact CB-CB 4.32Å; M470-L553 PolarHBondContact N-O 2.92Å; M470-L553 PolarHBondContact O-N 3.37Å; I511-L553 HydrophobicContact CD1-CD1 3.29Å; I511-L553 HydrophobicContact CG1-CD1 4.4Å; L515-L553 HydrophobicContact CB-CD1 4.06Å; L515-L553 HydrophobicContact CD1-CD1 4.22Å; L515-L553 HydrophobicContact CD1-CD2 4.48Å; L553-F566 HydrophobicContact CD1-CE2 4.33Å; L553-F566 HydrophobicContact CD2-CE2 4.04Å; L553-F566 HydrophobicContact CD2-CZ 3.69Å
554	S	96.1	Very high	92.6	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.021	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	164.3	-179.9	58.3	0	0	0	0	112	N469 L515 K516	N469-S554 VanDerWaalsContact OD1-CB 3.22Å; N469-S554 WeakPolarHBondContact OD1-CB 3.29Å; L515-S554 WeakPolarHBondContact CA-O 3.45Å; K516-S554 WeakPolarHBondContact CE-OG 3.33Å; K516-S554 VanDerWaalsContact CG-OG 3.28Å; K516-S554 WeakPolarHBondContact CG-OG 3.27Å; K516-S554 PolarHBondContact N-O 2.65Å; K516-S554 PolarHBondContact O-N 2.82Å
555	S	94.5	Very high	92.1	Very high	34 Å²	34	51.6 Å²	51.6	24%	0.238	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	151.5	173.1	59.5	0	0	0	0	112
556	I	92.5	Very high	91.5	Very high	40 Å²	40	51.5 Å²	51.5	21%	0.205	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-85.4	124.8	172.1	-54.8	162.5	0	0	0	108.3	L510 G514 K516 G558 T559	L510-I556 HydrophobicContact CD2-CD1 3.62Å; L510-I556 HydrophobicContact CD2-CG1 4.2Å; G514-I556 PolarHBondContact O-N 3.24Å; K516-I556 HydrophobicContact CB-CG1 4Å; K516-I556 HydrophobicContact CD-CG1 4.34Å; K516-I556 HydrophobicContact CG-CG1 4.28Å; I556-G558 PolarHBondContact O-N 2.74Å; I556-T559 VanDerWaalsContact CG2-OG1 3.29Å; I556-T559 WeakPolarHBondContact CG2-OG1 3.48Å; I556-T559 PolarHBondContact O-N 3.2Å; I556-T559 VanDerWaalsContact O-N 3.08Å
557	A	88.5	Confident	90.9	Very high	95 Å²	95	53.1 Å²	53.1	79%	0.785	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	125.8	-178.4	0	0	0	0	0	111.1	T559	A557-T559 VanDerWaalsContact C-N 3.29Å; A557-T559 PolarHBondContact O-N 3.12Å
558	G	88.5	Confident	90.4	Very high	88 Å²	88	53.7 Å²	53.7	91%	0.907	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	-1.9	-179.5	0	0	0	0	0	115.3	I556	I556-G558 PolarHBondContact O-N 2.74Å
559	T	89	Confident	89.8	Confident	63 Å²	63	54.9 Å²	54.9	39%	0.387	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-100.1	131.1	177.6	-49.8	0	0	0	0	110.7	I556 A557 I561	I556-T559 VanDerWaalsContact CG2-OG1 3.29Å; I556-T559 WeakPolarHBondContact CG2-OG1 3.48Å; I556-T559 PolarHBondContact O-N 3.2Å; I556-T559 VanDerWaalsContact O-N 3.08Å; A557-T559 VanDerWaalsContact C-N 3.29Å; A557-T559 PolarHBondContact O-N 3.12Å; T559-I561 PolarHBondContact O-N 2.82Å
560	P	89.3	Confident	89.3	Confident	93 Å²	93	56.9 Å²	56.9	60%	0.604	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-58.7	137	170.9	-22.9	33.8	0	0	0	111.4
561	I	89	Confident	88.9	Confident	14 Å²	14	59 Å²	59	7%	0.072	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-90.6	125.8	172.2	-50.1	180	0	0	0	108.3	L462 I465 R466 N513 L515 T559	L462-I561 HydrophobicContact CD2-CB 4.18Å; L462-I561 HydrophobicContact CD2-CG2 3.54Å; I465-I561 HydrophobicContact CG2-CD1 3.76Å; R466-I561 HydrophobicContact CG-CD1 3.55Å; N513-I561 WeakPolarHBondContact O-CA 3.42Å; N513-I561 VanDerWaalsContact O-CG2 3.31Å; N513-I561 WeakPolarHBondContact O-CG2 3.35Å; L515-I561 HydrophobicContact CD2-CD1 4.38Å; L515-I561 HydrophobicContact CD2-CG2 4.04Å; L515-I561 HydrophobicContact CG-CG2 4.47Å; T559-I561 PolarHBondContact O-N 2.82Å
562	E	88	Confident	88.5	Confident	113 Å²	113	61.1 Å²	61.1	53%	0.528	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-98.7	139.2	178.1	-63.5	-172.8	-176.1	0	0	110.6	N513 G564	N513-E562 PolarHBondContact O-N 2.93Å; N513-E562 VanDerWaalsContact O-N 3.17Å; E562-G564 PolarHBondContact O-N 2.8Å
563	A	85.5	Confident	88.2	Confident	85 Å²	85	61.9 Å²	61.9	70%	0.702	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-77.3	124.8	174.7	0	0	0	0	0	109.8	L462	L462-A563 HydrophobicContact CD1-CB 4.32Å; L462-A563 HydrophobicContact CD2-CB 4.48Å
564	G	84	Confident	88	Confident	37 Å²	37	64.1 Å²	64.1	38%	0.381	41%	0.408	S	S	.	.	S	Bend	trans	173.9	171.2	179	0	0	0	0	0	112.4	N513 E562	N513-G564 PolarHBondContact ND2-O 2.97Å; E562-G564 PolarHBondContact O-N 2.8Å
565	P	82.8	Confident	87.9	Confident	93 Å²	93	64.3 Å²	64.3	60%	0.604	41%	0.408	S	S	*	.			trans	-63.5	148.9	167	31.2	-34.3	0	0	0	109.6	N513	N513-P565 PolarHBondContact ND2-O 2.87Å
566	F	81.7	Confident	87.9	Confident	57 Å²	57	63.4 Å²	63.4	25%	0.25	40%	0.4	C	S	.	.			trans	-140.3	146.4	168.7	64	-86.7	0	0	0	107.5	F457 F460 I511 L515 L553	F457-F566 HydrophobicContact CB-CZ 4.4Å; F460-F566 AromaticContact CE1-CE1 3.55Å; F460-F566 HydrophobicContact CE1-CE1 3.55Å; F460-F566 AromaticContact CE1-CZ 3.64Å; F460-F566 HydrophobicContact CE1-CZ 3.64Å; F460-F566 HydrophobicContact CZ-CD1 4.48Å; F460-F566 AromaticContact CZ-CE1 3.46Å; F460-F566 HydrophobicContact CZ-CE1 3.46Å; F460-F566 VanDerWaalsContact CZ-CE1 3.46Å; F460-F566 AromaticContact CZ-CZ 3.82Å; F460-F566 HydrophobicContact CZ-CZ 3.82Å; I511-F566 HydrophobicContact CD1-CD2 3.53Å; I511-F566 HydrophobicContact CD1-CE2 3.95Å; I511-F566 HydrophobicContact CD1-CG 4.35Å; I511-F566 HydrophobicContact CG1-CD2 4.46Å; L515-F566 HydrophobicContact CD1-CD1 4.05Å; L515-F566 HydrophobicContact CD1-CE1 4.23Å; L515-F566 HydrophobicContact CD1-CG 4.31Å; L553-F566 HydrophobicContact CD1-CE2 4.33Å; L553-F566 HydrophobicContact CD2-CE2 4.04Å; L553-F566 HydrophobicContact CD2-CZ 3.69Å
567	D	83.5	Confident	87.9	Confident	139 Å²	139	63.8 Å²	63.8	74%	0.743	40%	0.402	S	S	*	.			trans	-155.5	157.3	173.1	63.8	-78.8	0	0	0	108.8
568	T	83.5	Confident	87.9	Confident	41 Å²	41	62.2 Å²	62.2	25%	0.252	38%	0.383	S	S	.	.			trans	-155.7	161.3	173.9	-169.8	0	0	0	0	108.9	L509 I511 L517	L509-T568 HydrophobicContact CD2-CG2 3.89Å; I511-T568 HydrophobicContact CB-CG2 4.39Å; I511-T568 HydrophobicContact CG2-CG2 3.66Å; L517-T568 HydrophobicContact CD2-CG2 4.11Å
569	V	83.4	Confident	87.8	Confident	97 Å²	97	60.8 Å²	60.8	59%	0.588	36%	0.355	S	S	*	.			trans	-120.7	125.3	177.2	179.2	0	0	0	0	109.2	L571	V569-L571 HydrophobicContact CG1-CD2 3.88Å
570	V	86.6	Confident	87.8	Confident	42 Å²	42	60.7 Å²	60.7	26%	0.255	35%	0.353	S	S	.	.			trans	-113.5	124.8	170	-178.9	0	0	0	0	107.6	F496 Y497 L509 L519 F529	F496-V570 HydrophobicContact CB-CG1 3.86Å; F496-V570 HydrophobicContact CD1-CG1 4Å; F496-V570 HydrophobicContact CG-CG1 4.4Å; Y497-V570 CarbonylContact O-C 3.56Å; Y497-V570 WeakPolarHBondContact O-CA 3.29Å; L509-V570 HydrophobicContact CD2-CG2 3.96Å; L519-V570 HydrophobicContact CD1-CG1 4.25Å; F529-V570 HydrophobicContact CD1-CG1 4.34Å; F529-V570 HydrophobicContact CE1-CG1 3.96Å; F529-V570 HydrophobicContact CE1-CG2 3.97Å
571	L	88.3	Confident	87.7	Confident	81 Å²	81	58.8 Å²	58.8	42%	0.424	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	127.3	176.1	-52.5	-179.8	0	0	0	109.2	Y497 V569 K573	Y497-L571 WeakPolarHBondContact CB-O 3.48Å; Y497-L571 HydrophobicContact CD1-CB 3.97Å; Y497-L571 HydrophobicContact CD1-CD1 3.76Å; Y497-L571 HydrophobicContact CD1-CG 4.05Å; Y497-L571 HydrophobicContact CE1-CD1 3.93Å; Y497-L571 PolarHBondContact N-O 2.91Å; Y497-L571 PolarHBondContact O-N 3.32Å; V569-L571 HydrophobicContact CG1-CD2 3.88Å; L571-K573 HydrophobicContact CB-CG 4.43Å; L571-K573 PolarHBondContact O-N 2.85Å
572	F	90.4	Very high	87.6	Confident	44 Å²	44	61.6 Å²	61.6	19%	0.193	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	107.4	167.1	-173.4	-104.7	0	0	0	108.9	F446 I476 S494 F496 Y535 I574	F446-F572 HydrophobicContact CD1-CE1 4.27Å; F446-F572 HydrophobicContact CE1-CE1 4.16Å; I476-F572 HydrophobicContact CD1-CB 4.17Å; I476-F572 HydrophobicContact CD1-CD1 3.83Å; I476-F572 HydrophobicContact CD1-CD2 3.33Å; I476-F572 HydrophobicContact CD1-CE1 3.94Å; I476-F572 HydrophobicContact CD1-CE2 3.45Å; I476-F572 VanDerWaalsContact CD1-CE2 3.45Å; I476-F572 HydrophobicContact CD1-CG 3.5Å; I476-F572 HydrophobicContact CD1-CZ 3.74Å; I476-F572 HydrophobicContact CG2-CD1 4.18Å; I476-F572 HydrophobicContact CG2-CE1 3.76Å; I476-F572 HydrophobicContact CG2-CZ 4.11Å; S494-F572 VanDerWaalsContact CB-CE2 3.41Å; S494-F572 WeakPolarHBondContact OG-CE2 3.4Å; S494-F572 WeakPolarHBondContact OG-CZ 3.32Å; F496-F572 AromaticContact CD1-CD2 3.87Å; F496-F572 HydrophobicContact CD1-CD2 3.87Å; F496-F572 AromaticContact CE1-CD2 3.52Å; F496-F572 HydrophobicContact CE1-CD2 3.52Å; F496-F572 HydrophobicContact CE1-CE2 4.15Å; F496-F572 HydrophobicContact CE1-CG 4.47Å; F496-F572 HydrophobicContact CE2-CE2 4.48Å; F496-F572 AromaticContact CZ-CD2 3.89Å; F496-F572 HydrophobicContact CZ-CD2 3.89Å; F496-F572 HydrophobicContact CZ-CE2 4.04Å; Y535-F572 HydrophobicContact CD1-CZ 4.49Å; Y535-F572 HydrophobicContact CD2-CZ 4.04Å; Y535-F572 HydrophobicContact CE2-CZ 4.07Å; Y535-F572 HydrophobicContact CG-CZ 4.26Å; F572-I574 HydrophobicContact CD1-CG2 4.13Å; F572-I574 HydrophobicContact CE1-CG2 3.7Å; F572-I574 HydrophobicContact CZ-CG2 4.47Å
573	K	91	Very high	87.6	Confident	41 Å²	41	58.2 Å²	58.2	18%	0.178	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	153.6	178.4	-66.4	-178.4	174.5	173.1	0	110.3	E282 S494 S495 Y497 Y532 L571	E282-K573 IonicContact OE1-NZ 2.64Å; E282-K573 PolarHBondContact OE1-NZ 3.04Å; E282-K573 IonicContact OE2-NZ 3.46Å; S494-K573 CarbonylContact C-O 3.57Å; S494-K573 WeakPolarHBondContact CA-O 3.42Å; S494-K573 WeakPolarHBondContact CB-O 3.44Å; S495-K573 PolarHBondContact N-O 3.25Å; S495-K573 PolarHBondContact O-N 3.07Å; Y497-K573 HydrophobicContact CD1-CD 4.26Å; Y497-K573 VanDerWaalsContact CD1-CE 3.45Å; Y497-K573 HydrophobicContact CD2-CD 4.48Å; Y497-K573 HydrophobicContact CG-CD 3.91Å; Y532-K573 HydrophobicContact CE1-CB 4.23Å; Y532-K573 WeakPolarHBondContact OH-CB 3.35Å; L571-K573 HydrophobicContact CB-CG 4.43Å; L571-K573 PolarHBondContact O-N 2.85Å
574	I	92.1	Very high	87.7	Confident	47 Å²	47	56.3 Å²	56.3	24%	0.241	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.7	178.6	66.5	-178.4	0	0	0	110.7	F446 V492 S493 F572 Y576	F446-I574 HydrophobicContact CD2-CD1 4.03Å; F446-I574 HydrophobicContact CE1-CD1 4.3Å; F446-I574 HydrophobicContact CE1-CG2 3.86Å; F446-I574 HydrophobicContact CE2-CD1 3.05Å; F446-I574 HydrophobicContact CE2-CG1 4.42Å; F446-I574 HydrophobicContact CE2-CG2 4.46Å; F446-I574 HydrophobicContact CZ-CB 4.34Å; F446-I574 HydrophobicContact CZ-CD1 3.23Å; F446-I574 HydrophobicContact CZ-CG1 4.33Å; F446-I574 HydrophobicContact CZ-CG2 3.72Å; V492-I574 HydrophobicContact CG1-CB 3.85Å; V492-I574 HydrophobicContact CG1-CG2 4.03Å; S493-I574 CarbonylContact O-C 3.58Å; S493-I574 WeakPolarHBondContact O-CA 3.38Å; F572-I574 HydrophobicContact CD1-CG2 4.13Å; F572-I574 HydrophobicContact CE1-CG2 3.7Å; F572-I574 HydrophobicContact CZ-CG2 4.47Å; I574-Y576 HydrophobicContact CD1-CE2 4.1Å
575	N	94.4	Very high	88	Confident	6 Å²	6	57.8 Å²	57.8	3%	0.032	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	145.3	161	-63	-29	0	0	0	108	W281 E282 V492 S493 Y532	W281-N575 WeakPolarHBondContact CA-OD1 3.23Å; E282-N575 PolarHBondContact N-OD1 3.33Å; E282-N575 PolarHBondContact O-ND2 2.75Å; V492-N575 WeakPolarHBondContact CA-O 3.33Å; S493-N575 PolarHBondContact N-O 3.33Å; S493-N575 PolarHBondContact O-N 3.12Å; Y532-N575 HydrophobicContact CE1-CB 4.44Å
576	Y	94.6	Very high	88.4	Confident	15 Å²	15	54.8 Å²	54.8	6%	0.059	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	138.5	169.2	-65.6	-111.6	0	0	0	108.1	F268 A269 P271 L440 V444 F490 V492 I574	F268-Y576 CarbonylContact C-O 3.55Å; F268-Y576 WeakPolarHBondContact CA-O 3.35Å; F268-Y576 WeakPolarHBondContact CB-O 3.41Å; A269-Y576 PolarHBondContact N-O 3.1Å; A269-Y576 WeakPolarHBondContact O-CB 3.28Å; P271-Y576 HydrophobicContact CB-CD1 4.11Å; P271-Y576 HydrophobicContact CB-CD2 3.97Å; P271-Y576 HydrophobicContact CB-CE1 3.74Å; P271-Y576 HydrophobicContact CB-CE2 3.61Å; P271-Y576 HydrophobicContact CB-CG 4.22Å; P271-Y576 VanDerWaalsContact CB-CZ 3.46Å; P271-Y576 HydrophobicContact CG-CD2 3.88Å; P271-Y576 HydrophobicContact CG-CE2 3.59Å; L440-Y576 HydrophobicContact CD1-CD1 3.88Å; L440-Y576 HydrophobicContact CD1-CG 4.47Å; V444-Y576 HydrophobicContact CG2-CE1 3.66Å; V444-Y576 HydrophobicContact CG2-CE2 4.45Å; V444-Y576 VanDerWaalsContact CG2-CZ 3.49Å; V444-Y576 WeakPolarHBondContact CG2-OH 3.42Å; V444-Y576 PolarHBondContact N-OH 3.26Å; F490-Y576 AromaticContact CD2-CD1 3.67Å; F490-Y576 HydrophobicContact CD2-CD1 3.67Å; F490-Y576 HydrophobicContact CD2-CE1 4.24Å; F490-Y576 AromaticContact CE2-CD1 3.71Å; F490-Y576 HydrophobicContact CE2-CD1 3.71Å; F490-Y576 AromaticContact CE2-CE1 3.79Å; F490-Y576 HydrophobicContact CE2-CE1 3.79Å; F490-Y576 HydrophobicContact CZ-CE1 4.45Å; V492-Y576 HydrophobicContact CG2-CD1 4.39Å; I574-Y576 HydrophobicContact CD1-CE2 4.1Å
577	N	91.5	Very high	89	Confident	48 Å²	48	54.6 Å²	54.6	26%	0.257	29%	0.293	S	S	.	.			trans	-124.3	0	178.3	-49.2	-66.6	0	0	0	111.1	R438 K491 S493	R438-N577 VanDerWaalsContact CZ-OXT 3.31Å; R438-N577 PolarHBondContact NE-OXT 3.38Å; R438-N577 PolarHBondContact NH2-O 3.29Å; R438-N577 PolarHBondContact NH2-OXT 3.36Å; K491-N577 HydrophobicContact CB-CB 4.36Å; K491-N577 PolarHBondContact N-O 3.08Å; K491-N577 PolarHBondContact O-N 2.89Å; S493-N577 VanDerWaalsContact CB-ND2 3.29Å; S493-N577 WeakPolarHBondContact CB-ND2 3.42Å; S493-N577 PolarHBondContact N-ND2 3.26Å; S493-N577 PolarHBondContact OG-ND2 3.29Å

Retrieved 577 of 577 residues in 619 ms (Link to these results)

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