A0A3Q0KEC7_SCHMA Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KEC7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 241 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	40.5	Very low	50.5	Low	232 Å²	232	134.6 Å²	134.6	100%	1.143	71%	0.708	S	S	*	*				0	109.1	0	-94.7	165.5	70.4	0	0	106.8	F3	M1-F3 PolarHBondContact O-N 3.24Å
2	E	39	Very low	50.9	Low	185 Å²	185	133.2 Å²	133.2	86%	0.864	70%	0.7	S	S	*	*			trans	-64.9	118.8	-176.4	-68.6	175.3	156.8	0	0	110	V4	E2-V4 PolarHBondContact O-N 2.96Å; E2-V4 VanDerWaalsContact O-N 3.08Å
3	F	43.6	Very low	51.2	Low	206 Å²	206	130.4 Å²	130.4	90%	0.904	69%	0.685	S	S	*	*			trans	-72.4	94.6	166	-79.4	-90.2	0	0	0	107.5	M1 N5	M1-F3 PolarHBondContact O-N 3.24Å; F3-N5 PolarHBondContact O-N 3.34Å; F3-N5 VanDerWaalsContact O-N 3.11Å
4	V	47	Very low	51.2	Low	133 Å²	133	129.1 Å²	129.1	81%	0.806	68%	0.678	S	S	*	*			trans	-63.6	114.5	169.9	179.6	0	0	0	0	107.6	E2 N6	E2-V4 PolarHBondContact O-N 2.96Å; E2-V4 VanDerWaalsContact O-N 3.08Å; V4-N6 PolarHBondContact O-N 3.3Å
5	N	49.7	Very low	51.2	Low	115 Å²	115	129.9 Å²	129.9	62%	0.615	67%	0.674	S	S	*	*			trans	-67	109.5	-170.4	-165.1	-4.8	0	0	0	110.8	F3 S7 C8	F3-N5 PolarHBondContact O-N 3.34Å; F3-N5 VanDerWaalsContact O-N 3.11Å; N5-S7 PolarHBondContact O-N 2.94Å; N5-S7 WeakPolarHBondContact OD1-CB 3.47Å; N5-S7 PolarHBondContact OD1-OG 3.43Å; N5-C8 PolarHBondContact O-N 3.09Å
6	N	53.2	Low	51.2	Low	129 Å²	129	128.8 Å²	128.8	69%	0.69	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-5	177.8	-113	-7.3	0	0	0	114.2	V4 C8	V4-N6 PolarHBondContact O-N 3.3Å; N6-C8 VanDerWaalsContact C-N 3.29Å; N6-C8 PolarHBondContact O-N 3.38Å
7	S	57.4	Low	50.9	Low	67 Å²	67	126.7 Å²	126.7	47%	0.469	66%	0.664	S	S	.	*	H	α-helix	trans	-67.5	-25.8	177.2	-55.7	0	0	0	0	113.3	N5 L11	N5-S7 PolarHBondContact O-N 2.94Å; N5-S7 WeakPolarHBondContact OD1-CB 3.47Å; N5-S7 PolarHBondContact OD1-OG 3.43Å; S7-L11 PolarHBondContact O-N 3.01Å
8	C	55.8	Low	50.7	Low	88 Å²	88	125.6 Å²	125.6	60%	0.595	66%	0.658	S	S	*	*	H	α-helix	trans	-75.8	-34.8	-175.7	-141.3	0	0	0	0	112.9	N5 N6 L11 L12	N5-C8 PolarHBondContact O-N 3.09Å; N6-C8 VanDerWaalsContact C-N 3.29Å; N6-C8 PolarHBondContact O-N 3.38Å; C8-L11 PolarHBondContact O-N 3.34Å; C8-L12 PolarHBondContact O-N 3.43Å
9	L	55.7	Low	50.5	Low	110 Å²	110	127.5 Å²	127.5	58%	0.576	66%	0.661	S	S	*	*	H	α-helix	trans	-69	-36.6	176.5	-95.8	133.8	0	0	0	112.2	L12 I13	L9-L12 PolarHBondContact O-N 2.88Å; L9-I13 WeakPolarHBondContact O-CG1 2.95Å; L9-I13 PolarHBondContact O-N 2.87Å; L9-I13 VanDerWaalsContact O-N 3.15Å
10	L	57.4	Low	50.5	Low	115 Å²	115	132 Å²	132	60%	0.602	67%	0.67	S	S	*	*	H	α-helix	trans	-64.4	-41.1	176.2	-121.5	87.3	0	0	0	111.6	I13 L14	L10-I13 PolarHBondContact O-N 3.12Å; L10-L14 WeakPolarHBondContact O-CB 3.45Å; L10-L14 WeakPolarHBondContact O-CD1 3.41Å; L10-L14 PolarHBondContact O-N 3.24Å
11	L	56.1	Low	50.5	Low	101 Å²	101	131.4 Å²	131.4	53%	0.529	67%	0.673	S	S	.	*	H	α-helix	trans	-65.2	-37.2	177.9	-93.3	147.7	0	0	0	112.8	S7 C8 L14 F15	S7-L11 PolarHBondContact O-N 3.01Å; C8-L11 PolarHBondContact O-N 3.34Å; L11-L14 PolarHBondContact O-N 3.23Å; L11-F15 WeakPolarHBondContact O-CB 3.26Å; L11-F15 PolarHBondContact O-N 2.67Å
12	L	54.8	Low	51.3	Low	117 Å²	117	128.7 Å²	128.7	61%	0.613	66%	0.655	S	S	*	*	H	α-helix	trans	-66.6	-39	174.3	-84.1	156.3	0	0	0	112.2	C8 L9 F15 T16	C8-L12 PolarHBondContact O-N 3.43Å; L9-L12 PolarHBondContact O-N 2.88Å; L12-F15 PolarHBondContact O-N 2.99Å; L12-T16 PolarHBondContact O-N 3.4Å; L12-T16 PolarHBondContact O-OG1 3.49Å
13	I	54.8	Low	52.9	Low	97 Å²	97	122.5 Å²	122.5	50%	0.497	63%	0.632	S	S	.	*	H	α-helix	trans	-71.4	-36.9	176.6	-63.8	165.4	0	0	0	111.3	L9 L10 F15 T16 L17	L9-I13 WeakPolarHBondContact O-CG1 2.95Å; L9-I13 PolarHBondContact O-N 2.87Å; L9-I13 VanDerWaalsContact O-N 3.15Å; L10-I13 PolarHBondContact O-N 3.12Å; I13-F15 VanDerWaalsContact C-N 3.34Å; I13-T16 WeakPolarHBondContact CA-OG1 3.48Å; I13-T16 PolarHBondContact O-N 3.06Å; I13-T16 PolarHBondContact O-OG1 2.94Å; I13-L17 HydrophobicContact CG2-CD1 4.42Å; I13-L17 PolarHBondContact O-N 2.84Å; I13-L17 VanDerWaalsContact O-N 3.15Å
14	L	52.3	Low	55	Low	113 Å²	113	114 Å²	114	59%	0.592	60%	0.596	S	S	*	*	H	α-helix	trans	-65.8	-34.1	172.6	-92.6	140.9	0	0	0	112.2	L10 L11 L17	L10-L14 WeakPolarHBondContact O-CB 3.45Å; L10-L14 WeakPolarHBondContact O-CD1 3.41Å; L10-L14 PolarHBondContact O-N 3.24Å; L11-L14 PolarHBondContact O-N 3.23Å; L14-L17 PolarHBondContact O-N 2.79Å
15	F	50.9	Low	57.2	Low	141 Å²	141	108.9 Å²	108.9	62%	0.618	56%	0.563	S	S	*	*	H	α-helix	trans	-74.3	-30	174.2	-105.2	-90	0	0	0	113.4	L11 L12 I13 L17 L18	L11-F15 WeakPolarHBondContact O-CB 3.26Å; L11-F15 PolarHBondContact O-N 2.67Å; L12-F15 PolarHBondContact O-N 2.99Å; I13-F15 VanDerWaalsContact C-N 3.34Å; F15-L17 VanDerWaalsContact C-N 3.31Å; F15-L18 HydrophobicContact CD1-CD1 3.84Å; F15-L18 HydrophobicContact CE1-CD1 4.22Å; F15-L18 WeakPolarHBondContact O-CB 3.31Å; F15-L18 WeakPolarHBondContact O-CD1 3.06Å; F15-L18 PolarHBondContact O-N 3.07Å
16	T	50.2	Low	59.3	Low	111 Å²	111	105.5 Å²	105.5	68%	0.681	55%	0.547	S	S	*	.	H	α-helix	trans	-78.6	-15	173.2	54.8	0	0	0	0	113.5	L12 I13	L12-T16 PolarHBondContact O-N 3.4Å; L12-T16 PolarHBondContact O-OG1 3.49Å; I13-T16 WeakPolarHBondContact CA-OG1 3.48Å; I13-T16 PolarHBondContact O-N 3.06Å; I13-T16 PolarHBondContact O-OG1 2.94Å
17	L	46.5	Very low	61.3	Low	94 Å²	94	101.6 Å²	101.6	49%	0.492	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	11	166.9	-77	160.6	0	0	0	113	I13 L14 F15 F19	I13-L17 HydrophobicContact CG2-CD1 4.42Å; I13-L17 PolarHBondContact O-N 2.84Å; I13-L17 VanDerWaalsContact O-N 3.15Å; L14-L17 PolarHBondContact O-N 2.79Å; F15-L17 VanDerWaalsContact C-N 3.31Å; L17-F19 HydrophobicContact CD2-CD2 4.43Å; L17-F19 HydrophobicContact CD2-CE2 3.62Å; L17-F19 HydrophobicContact CD2-CZ 3.69Å; L17-F19 VanDerWaalsContact O-CD2 3.26Å; L17-F19 WeakPolarHBondContact O-CD2 3.18Å; L17-F19 PolarHBondContact O-N 2.89Å
18	L	47.2	Very low	63.1	Low	107 Å²	107	104.4 Å²	104.4	56%	0.56	53%	0.526	S	S	*	.	S	Bend	trans	-60.6	85.9	143	-76.6	159.4	0	0	0	105.6	F15 Y20	F15-L18 HydrophobicContact CD1-CD1 3.84Å; F15-L18 HydrophobicContact CE1-CD1 4.22Å; F15-L18 WeakPolarHBondContact O-CB 3.31Å; F15-L18 WeakPolarHBondContact O-CD1 3.06Å; F15-L18 PolarHBondContact O-N 3.07Å; L18-Y20 PolarHBondContact O-N 2.93Å
19	F	48.4	Very low	65.1	Low	162 Å²	162	100.4 Å²	100.4	71%	0.711	50%	0.499	S	S	*	.			trans	-52.2	89.8	160.8	-70.4	-89.1	0	0	0	105.6	L17 T21	L17-F19 HydrophobicContact CD2-CD2 4.43Å; L17-F19 HydrophobicContact CD2-CE2 3.62Å; L17-F19 HydrophobicContact CD2-CZ 3.69Å; L17-F19 VanDerWaalsContact O-CD2 3.26Å; L17-F19 WeakPolarHBondContact O-CD2 3.18Å; L17-F19 PolarHBondContact O-N 2.89Å; F19-T21 HydrophobicContact CB-CG2 4.07Å; F19-T21 PolarHBondContact O-N 2.78Å
20	Y	49.9	Very low	67.1	Low	217 Å²	217	99.5 Å²	99.5	85%	0.851	50%	0.498	S	S	*	.			trans	-58	85.1	145.3	-90.9	-94.7	0	0	0	103.4	L18 K22	L18-Y20 PolarHBondContact O-N 2.93Å; Y20-K22 PolarHBondContact O-N 3.18Å
21	T	49.3	Very low	68.9	Low	120 Å²	120	99.1 Å²	99.1	74%	0.736	50%	0.497	S	S	*	.			trans	-64	82.4	161.4	54.5	0	0	0	0	104.3	F19 S23	F19-T21 HydrophobicContact CB-CG2 4.07Å; F19-T21 PolarHBondContact O-N 2.78Å; T21-S23 VanDerWaalsContact C-N 3.33Å; T21-S23 PolarHBondContact O-N 3.48Å
22	K	59.2	Low	70.8	Confident	174 Å²	174	97.4 Å²	97.4	76%	0.757	49%	0.486	S	S	*	.			trans	-60.8	106.3	169.8	-173.8	177.1	-178.4	179.1	0	104	Y20 N24	Y20-K22 PolarHBondContact O-N 3.18Å; K22-N24 PolarHBondContact O-N 3.41Å; K22-N24 VanDerWaalsContact O-N 3.16Å
23	S	71.4	Confident	72.7	Confident	55 Å²	55	95 Å²	95	39%	0.385	47%	0.473	S	S	.	.			trans	-45.8	123.2	-179.9	163.5	0	0	0	0	109.7	T21 F25	T21-S23 VanDerWaalsContact C-N 3.33Å; T21-S23 PolarHBondContact O-N 3.48Å; S23-F25 PolarHBondContact O-N 2.75Å; S23-F25 PolarHBondContact OG-N 3.29Å
24	N	87.6	Confident	74.6	Confident	27 Å²	27	90.7 Å²	90.7	14%	0.144	45%	0.451	C	S	.	.			trans	-66.1	-18.1	178.7	-166.9	2.5	0	0	0	112.3	K22 V26 V46 M47 T48 D123	K22-N24 PolarHBondContact O-N 3.41Å; K22-N24 VanDerWaalsContact O-N 3.16Å; N24-V26 PolarHBondContact O-N 2.95Å; N24-V46 HydrophobicContact CB-CG1 4.43Å; N24-V46 CarbonylContact O-C 3.43Å; N24-V46 VanDerWaalsContact O-CA 3.26Å; N24-V46 WeakPolarHBondContact O-CA 3.38Å; N24-M47 PolarHBondContact O-N 3.19Å; N24-M47 WeakPolarHBondContact OD1-CB 3.45Å; N24-M47 PolarHBondContact OD1-N 2.87Å; N24-M47 VanDerWaalsContact OD1-N 3.13Å; N24-T48 PolarHBondContact OD1-N 2.67Å; N24-D123 WeakPolarHBondContact CB-OD2 3.47Å; N24-D123 PolarHBondContact ND2-OD2 2.85Å
25	F	93.5	Very high	76.7	Confident	26 Å²	26	90.3 Å²	90.3	11%	0.114	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	127.8	179.4	-66.8	-80.4	0	0	0	113.1	S23 R28 C44 S45 V46 T115 D123 A125	S23-F25 PolarHBondContact O-N 2.75Å; S23-F25 PolarHBondContact OG-N 3.29Å; F25-R28 HydrophobicContact CB-CB 4.29Å; F25-R28 HydrophobicContact CG-CB 4.44Å; F25-C44 VanDerWaalsContact CE1-SG 3.56Å; F25-S45 CarbonylContact C-O 3.48Å; F25-S45 WeakPolarHBondContact CA-O 3.41Å; F25-V46 HydrophobicContact CD1-CG1 3.55Å; F25-V46 HydrophobicContact CE1-CG1 3.74Å; F25-V46 HydrophobicContact CG-CG1 4.05Å; F25-V46 HydrophobicContact CZ-CG1 4.39Å; F25-T115 HydrophobicContact CE1-CG2 3.85Å; F25-T115 HydrophobicContact CZ-CG2 4.19Å; F25-D123 HydrophobicContact CE2-CB 3.62Å; F25-D123 HydrophobicContact CZ-CB 3.71Å; F25-A125 HydrophobicContact CD1-CB 4.17Å; F25-A125 HydrophobicContact CD2-CB 3.95Å; F25-A125 HydrophobicContact CE1-CB 3.91Å; F25-A125 HydrophobicContact CE2-CB 3.66Å; F25-A125 HydrophobicContact CG-CB 4.2Å; F25-A125 HydrophobicContact CZ-CB 3.65Å
26	V	93.6	Very high	78.8	Confident	44 Å²	44	85.9 Å²	85.9	27%	0.267	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-45.2	164	179	0	0	0	0	109.9	N24 S45 M47 Y88 L93	N24-V26 PolarHBondContact O-N 2.95Å; V26-S45 PolarHBondContact N-O 3.42Å; V26-M47 HydrophobicContact CG2-CB 4.44Å; V26-M47 HydrophobicContact CG2-CG 3.56Å; V26-Y88 HydrophobicContact CG1-CD1 4.09Å; V26-Y88 HydrophobicContact CG1-CE1 3.9Å; V26-L93 HydrophobicContact CG2-CD1 3.75Å
27	L	95.3	Very high	81.1	Confident	47 Å²	47	82.8 Å²	82.8	25%	0.246	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	138.2	174.5	-59.8	175.8	0	0	0	108.6	C44 S45 Y88 I95	L27-C44 WeakPolarHBondContact O-CA 3.4Å; L27-S45 PolarHBondContact N-O 3.27Å; L27-S45 PolarHBondContact O-N 3.41Å; L27-S45 VanDerWaalsContact O-O 3.07Å; L27-Y88 HydrophobicContact CD1-CD2 4.14Å; L27-I95 HydrophobicContact CD1-CD1 3.72Å; L27-I95 HydrophobicContact CD1-CG1 4.02Å; L27-I95 HydrophobicContact CD1-CG2 4.27Å
28	R	96.3	Very high	83.5	Confident	127 Å²	127	79.9 Å²	79.9	48%	0.479	41%	0.413	S	S	.	.			trans	-141.1	153.7	179.4	63.5	-172.3	-56	169.9	7.5	109.7	F25 S43 A125	F25-R28 HydrophobicContact CB-CB 4.29Å; F25-R28 HydrophobicContact CG-CB 4.44Å; R28-S43 CarbonylContact C-O 3.55Å; R28-S43 PolarHBondContact N-O 3.2Å; R28-A125 HydrophobicContact CB-CB 3.85Å
29	P	97.8	Very high	86	Confident	4 Å²	4	78.7 Å²	78.7	3%	0.026	41%	0.41	C	S	.	.			trans	-60.6	149.8	172.2	28.3	-36.1	0	0	0	110.6	H42 W55 A127	P29-H42 HydrophobicContact CB-CB 4.2Å; P29-W55 HydrophobicContact CB-CH2 3.96Å; P29-W55 HydrophobicContact CB-CZ3 3.93Å; P29-W55 HydrophobicContact CG-CH2 4.14Å; P29-W55 HydrophobicContact CG-CZ3 3.99Å; P29-A127 HydrophobicContact CB-CB 3.73Å; P29-A127 HydrophobicContact CG-CB 4.29Å
30	T	96.3	Very high	88.3	Confident	90 Å²	90	71 Å²	71	55%	0.552	38%	0.377	S	S	*	.			trans	-123.7	144.7	-178.8	51.1	0	0	0	0	110.7	Q32 H42 A127	T30-Q32 PolarHBondContact O-N 2.9Å; T30-H42 PolarHBondContact O-CE1 2.71Å; T30-H42 VanDerWaalsContact O-CE1 3.3Å; T30-A127 VanDerWaalsContact O-CB 3.3Å; T30-A127 WeakPolarHBondContact O-CB 3.44Å
31	N	96.5	Very high	90.6	Very high	108 Å²	108	65.8 Å²	65.8	58%	0.578	36%	0.36	S	S	*	.			trans	-56.2	130.4	174.8	-73.7	-15.7	0	0	0	109.8	A127 Y128 Y221	N31-A127 WeakPolarHBondContact OD1-CA 3.41Å; N31-Y128 PolarHBondContact OD1-N 3.46Å; N31-Y221 VanDerWaalsContact C-OH 3.27Å; N31-Y221 WeakPolarHBondContact CA-OH 3.3Å; N31-Y221 HydrophobicContact CB-CE1 4.23Å; N31-Y221 VanDerWaalsContact CB-OH 3.28Å; N31-Y221 WeakPolarHBondContact CB-OH 3.4Å
32	Q	95.2	Very high	92.9	Very high	64 Å²	64	60.2 Å²	60.2	30%	0.299	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	140.6	178	-174.4	178	-10.3	0	0	111.4	T30 Y128 I129 L130 Y221	T30-Q32 PolarHBondContact O-N 2.9Å; Q32-Y128 PolarHBondContact N-O 3Å; Q32-I129 HydrophobicContact CB-CD1 3.73Å; Q32-I129 WeakPolarHBondContact O-CA 3.39Å; Q32-L130 PolarHBondContact O-N 2.85Å; Q32-Y221 VanDerWaalsContact C-OH 3.29Å; Q32-Y221 PolarHBondContact N-OH 3.37Å; Q32-Y221 PolarHBondContact O-OH 2.94Å; Q32-Y221 VanDerWaalsContact O-OH 3.08Å
33	I	94.5	Very high	94.7	Very high	67 Å²	67	53.3 Å²	53.3	34%	0.344	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	135.3	163	-54.4	177.6	0	0	0	107.5	L130 S132 Y221 V224	I33-L130 CarbonylContact C-O 3.52Å; I33-L130 WeakPolarHBondContact CA-O 3.24Å; I33-L130 HydrophobicContact CG1-CB 4.39Å; I33-L130 HydrophobicContact CG1-CD2 4.43Å; I33-L130 HydrophobicContact CG2-CD2 4.42Å; I33-S132 WeakPolarHBondContact CG2-OG 3.46Å; I33-Y221 HydrophobicContact CD1-CD1 3.6Å; I33-Y221 HydrophobicContact CD1-CD2 4.4Å; I33-Y221 HydrophobicContact CD1-CE1 4.12Å; I33-Y221 HydrophobicContact CD1-CG 3.76Å; I33-Y221 HydrophobicContact CG1-CD1 3.63Å; I33-Y221 HydrophobicContact CG1-CD2 4.05Å; I33-Y221 HydrophobicContact CG1-CE1 3.64Å; I33-Y221 HydrophobicContact CG1-CE2 4.03Å; I33-Y221 HydrophobicContact CG1-CG 3.83Å; I33-V224 HydrophobicContact CD1-CG1 3.77Å
34	T	95.8	Very high	96	Very high	6 Å²	6	50.7 Å²	50.7	4%	0.037	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	-176.1	180	-165	0	0	0	0	110.8	S38 I40 I103 I129 L130 V131 S132	T34-S38 VanDerWaalsContact OG1-CB 3.24Å; T34-S38 WeakPolarHBondContact OG1-CB 3.17Å; T34-S38 PolarHBondContact OG1-OG 2.69Å; T34-I40 HydrophobicContact CG2-CG2 4.03Å; T34-I103 HydrophobicContact CG2-CD1 4.18Å; T34-I103 HydrophobicContact CG2-CG2 3.89Å; T34-I129 HydrophobicContact CG2-CG2 4.24Å; T34-L130 PolarHBondContact N-O 3.16Å; T34-V131 HydrophobicContact CG2-CB 4.43Å; T34-V131 HydrophobicContact CG2-CG2 3.87Å; T34-S132 PolarHBondContact O-N 2.55Å; T34-S132 PolarHBondContact O-OG 2.81Å
35	H	95.5	Very high	96.4	Very high	105 Å²	105	49.4 Å²	49.4	49%	0.486	27%	0.274	S	S	.	.			trans	-127	153.9	-177.8	-26.6	86.8	0	0	0	110	G37 S38	H35-G37 PolarHBondContact O-N 2.68Å; H35-S38 WeakPolarHBondContact O-CB 3.4Å; H35-S38 PolarHBondContact O-N 2.78Å; H35-S38 VanDerWaalsContact O-N 3.12Å; H35-S38 PolarHBondContact O-OG 2.76Å
36	A	96	Very high	96.4	Very high	49 Å²	49	48.2 Å²	48.2	41%	0.405	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	140.7	177.3	0	0	0	0	0	111.6	S38 I103 F105 V131	A36-S38 VanDerWaalsContact C-N 3.29Å; A36-S38 PolarHBondContact O-N 2.7Å; A36-I103 CarbonylContact C-O 3.59Å; A36-I103 VanDerWaalsContact CA-O 3.22Å; A36-I103 WeakPolarHBondContact CA-O 3.49Å; A36-F105 HydrophobicContact CB-CE2 4.22Å; A36-F105 HydrophobicContact CB-CZ 4.44Å; A36-V131 HydrophobicContact CB-CG1 4.33Å
37	G	97.4	Very high	96.3	Very high	45 Å²	45	50.1 Å²	50.1	46%	0.464	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	-7.9	-174.9	0	0	0	0	0	115.2	H35 N102 I103	H35-G37 PolarHBondContact O-N 2.68Å; G37-N102 WeakPolarHBondContact CA-OD1 3.35Å; G37-I103 PolarHBondContact N-O 2.87Å
38	S	97.9	Very high	96	Very high	33 Å²	33	51.8 Å²	51.8	23%	0.231	29%	0.288	C	S	.	.			trans	-73.4	167.2	177.1	-54.1	0	0	0	0	112	T34 H35 A36 N102 I103	T34-S38 VanDerWaalsContact OG1-CB 3.24Å; T34-S38 WeakPolarHBondContact OG1-CB 3.17Å; T34-S38 PolarHBondContact OG1-OG 2.69Å; H35-S38 WeakPolarHBondContact O-CB 3.4Å; H35-S38 PolarHBondContact O-N 2.78Å; H35-S38 VanDerWaalsContact O-N 3.12Å; H35-S38 PolarHBondContact O-OG 2.76Å; A36-S38 VanDerWaalsContact C-N 3.29Å; A36-S38 PolarHBondContact O-N 2.7Å; S38-N102 PolarHBondContact O-N 2.65Å; S38-I103 WeakPolarHBondContact O-CG2 3.43Å; S38-I103 PolarHBondContact O-N 3.32Å
39	T	98.3	Very high	95.7	Very high	82 Å²	82	49.7 Å²	49.7	50%	0.503	29%	0.289	S	S	.	.			trans	-110.3	132.8	167.6	-62.6	0	0	0	0	109.4	I99 V100 T101	T39-I99 HydrophobicContact CG2-CG2 3.69Å; T39-V100 CarbonylContact C-O 3.49Å; T39-V100 VanDerWaalsContact CA-O 3.26Å; T39-V100 WeakPolarHBondContact CA-O 3.46Å; T39-T101 HydrophobicContact CG2-CG2 4.01Å
40	I	98.1	Very high	95.6	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.01	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	150.6	170	63.4	167.9	0	0	0	110	T34 I99 V100 I103 Y111 I129	T34-I40 HydrophobicContact CG2-CG2 4.03Å; I40-I99 WeakPolarHBondContact O-CA 3.48Å; I40-V100 HydrophobicContact CD1-CB 4.12Å; I40-V100 HydrophobicContact CD1-CG2 4.05Å; I40-V100 HydrophobicContact CG1-CB 3.67Å; I40-V100 HydrophobicContact CG1-CG2 4Å; I40-V100 PolarHBondContact N-O 2.85Å; I40-V100 PolarHBondContact O-N 2.87Å; I40-I103 HydrophobicContact CD1-CD1 3.67Å; I40-I103 HydrophobicContact CG1-CD1 4Å; I40-I103 HydrophobicContact CG2-CD1 4.14Å; I40-Y111 HydrophobicContact CD1-CE1 4.36Å; I40-Y111 HydrophobicContact CD1-CE2 4.37Å; I40-I129 HydrophobicContact CD1-CG1 4.26Å; I40-I129 HydrophobicContact CD1-CG2 4.13Å
41	Q	97.9	Very high	95.5	Very high	106 Å²	106	46.3 Å²	46.3	50%	0.495	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	123.8	176.4	179.9	174.6	-8.9	0	0	109.6	L98 I99	Q41-L98 CarbonylContact C-O 3.45Å; Q41-L98 WeakPolarHBondContact CA-O 3.38Å; Q41-I99 HydrophobicContact CB-CG1 4.41Å; Q41-I99 HydrophobicContact CG-CG1 4.01Å
42	H	98	Very high	95.5	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.019	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	145.8	173.9	-66.7	-64.3	0	0	0	110.4	P29 T30 W55 Q97 L98 I129	P29-H42 HydrophobicContact CB-CB 4.2Å; T30-H42 PolarHBondContact O-CE1 2.71Å; T30-H42 VanDerWaalsContact O-CE1 3.3Å; H42-W55 HydrophobicContact CB-CH2 3.61Å; H42-W55 HydrophobicContact CB-CZ2 4.2Å; H42-W55 HydrophobicContact CB-CZ3 4.16Å; H42-Q97 CarbonylContact O-C 3.59Å; H42-Q97 VanDerWaalsContact O-CA 3.31Å; H42-Q97 WeakPolarHBondContact O-CA 3.43Å; H42-L98 PolarHBondContact N-O 2.89Å; H42-L98 PolarHBondContact O-N 3.21Å; H42-I129 VanDerWaalsContact CE1-CD1 3.44Å; H42-I129 WeakPolarHBondContact CE1-CD1 3.35Å; H42-I129 WeakPolarHBondContact NE2-CD1 3.17Å
43	S	96.9	Very high	95.6	Very high	28 Å²	28	40.7 Å²	40.7	20%	0.196	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	139.9	178.9	-63.8	0	0	0	0	109.2	R28 Q97	R28-S43 CarbonylContact C-O 3.55Å; R28-S43 PolarHBondContact N-O 3.2Å; S43-Q97 PolarHBondContact OG-NE2 3.02Å; S43-Q97 VanDerWaalsContact OG-NE2 3.15Å
44	C	97.4	Very high	95.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	130.1	175.8	-168.9	0	0	0	0	110.3	F25 L27 I53 W55 I95 C96 C113	F25-C44 VanDerWaalsContact CE1-SG 3.56Å; L27-C44 WeakPolarHBondContact O-CA 3.4Å; C44-I53 HydrophobicContact CB-CD1 4.49Å; C44-I53 HydrophobicContact CB-CG2 4.37Å; C44-W55 HydrophobicContact CB-CH2 4Å; C44-W55 HydrophobicContact CB-CZ2 3.53Å; C44-I95 WeakPolarHBondContact O-CA 3.46Å; C44-C96 PolarHBondContact N-O 2.88Å; C44-C96 PolarHBondContact O-N 3.45Å; C44-C113 HydrophobicContact CB-CB 3.61Å; C44-C113 WeakPolarHBondContact CB-SG 3.34Å; C44-C113 WeakPolarHBondContact SG-CB 3.31Å; C44-C113 CovalentContact SG-SG 2.01Å; C44-C113 PolarHBondContact SG-SG 2.97Å
45	S	95.6	Very high	95.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	145.8	179.7	-171.6	0	0	0	0	109.4	F25 V26 L27 P94	F25-S45 CarbonylContact C-O 3.48Å; F25-S45 WeakPolarHBondContact CA-O 3.41Å; V26-S45 PolarHBondContact N-O 3.42Å; L27-S45 PolarHBondContact N-O 3.27Å; L27-S45 PolarHBondContact O-N 3.41Å; L27-S45 VanDerWaalsContact O-O 3.07Å; S45-P94 WeakPolarHBondContact CB-O 3.4Å; S45-P94 PolarHBondContact OG-O 3.1Å
46	V	93.9	Very high	96.1	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.012	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	158.5	-177.8	-75.6	0	0	0	0	109.9	N24 F25 T48 P50 T115	N24-V46 HydrophobicContact CB-CG1 4.43Å; N24-V46 CarbonylContact O-C 3.43Å; N24-V46 VanDerWaalsContact O-CA 3.26Å; N24-V46 WeakPolarHBondContact O-CA 3.38Å; F25-V46 HydrophobicContact CD1-CG1 3.55Å; F25-V46 HydrophobicContact CE1-CG1 3.74Å; F25-V46 HydrophobicContact CG-CG1 4.05Å; F25-V46 HydrophobicContact CZ-CG1 4.39Å; V46-T48 WeakPolarHBondContact CG2-O 3.4Å; V46-P50 HydrophobicContact CG2-CB 4.37Å; V46-P50 HydrophobicContact CG2-CG 3.78Å; V46-T115 HydrophobicContact CG1-CG2 3.61Å; V46-T115 HydrophobicContact CG2-CG2 4.12Å
47	M	91.8	Very high	96.2	Very high	83 Å²	83	33.6 Å²	33.6	41%	0.409	19%	0.193	S	C	.	.	S	Bend	trans	-68.9	-39.8	-177.7	-66.1	-176.1	-73.7	0	0	112.1	N24 V26 L93	N24-M47 PolarHBondContact O-N 3.19Å; N24-M47 WeakPolarHBondContact OD1-CB 3.45Å; N24-M47 PolarHBondContact OD1-N 2.87Å; N24-M47 VanDerWaalsContact OD1-N 3.13Å; V26-M47 HydrophobicContact CG2-CB 4.44Å; V26-M47 HydrophobicContact CG2-CG 3.56Å; M47-L93 WeakPolarHBondContact O-CD2 3.31Å
48	T	90.1	Very high	96.1	Very high	83 Å²	83	34.5 Å²	34.5	51%	0.509	19%	0.188	S	C	.	.	S	Bend	trans	-87.9	127.1	172.6	-54.1	0	0	0	0	109.2	N24 V46 P50 H117	N24-T48 PolarHBondContact OD1-N 2.67Å; V46-T48 WeakPolarHBondContact CG2-O 3.4Å; T48-P50 VanDerWaalsContact O-CD 3.3Å; T48-P50 WeakPolarHBondContact O-CD 2.9Å; T48-H117 PolarHBondContact O-CE1 2.85Å; T48-H117 VanDerWaalsContact O-CE1 3.27Å
49	V	89.8	Confident	96.1	Very high	82 Å²	82	38.4 Å²	38.4	50%	0.497	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-61.3	119.6	179.3	176.2	0	0	0	0	110	L93 P94	V49-L93 HydrophobicContact CG2-CD2 4.41Å; V49-P94 HydrophobicContact CG1-CG 4.08Å; V49-P94 HydrophobicContact CG2-CG 4.37Å
50	P	94.2	Very high	96	Very high	4 Å²	4	39 Å²	39	3%	0.026	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-83.9	164.5	176.5	34.7	-31.5	0	0	0	110.4	V46 T48 I53 F67 I116	V46-P50 HydrophobicContact CG2-CB 4.37Å; V46-P50 HydrophobicContact CG2-CG 3.78Å; T48-P50 VanDerWaalsContact O-CD 3.3Å; T48-P50 WeakPolarHBondContact O-CD 2.9Å; P50-I53 HydrophobicContact CG-CD1 4.06Å; P50-I53 HydrophobicContact CG-CG1 3.88Å; P50-F67 HydrophobicContact CG-CD2 3.98Å; P50-F67 HydrophobicContact CG-CE2 3.73Å; P50-F67 WeakPolarHBondContact O-CD2 3.4Å; P50-I116 WeakPolarHBondContact CB-O 3.06Å
51	V	95.3	Very high	96	Very high	20 Å²	20	41.8 Å²	41.8	12%	0.121	22%	0.222	C	C	.	.	S	Bend	trans	-67.2	-49.3	171.4	-176.6	0	0	0	0	109.4	L66 F67 Q68 I116 H118	V51-L66 HydrophobicContact CG1-CD1 4.22Å; V51-F67 PolarHBondContact O-N 2.84Å; V51-F67 VanDerWaalsContact O-N 3.11Å; V51-Q68 HydrophobicContact CG1-CG 4.41Å; V51-I116 PolarHBondContact N-O 3.49Å; V51-H118 HydrophobicContact CG2-CB 4.46Å
52	F	96.4	Very high	96	Very high	53 Å²	53	36.8 Å²	36.8	23%	0.232	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	160.4	175.8	58.6	-87.6	0	0	0	111.9	E54 C65 L66 I116	F52-E54 HydrophobicContact CD2-CG 3.64Å; F52-E54 HydrophobicContact CE2-CG 3.73Å; F52-C65 CarbonylContact C-O 3.6Å; F52-C65 WeakPolarHBondContact CA-O 2.88Å; F52-C65 WeakPolarHBondContact CB-O 3.29Å; F52-L66 HydrophobicContact CB-CD1 4.01Å; F52-L66 HydrophobicContact CD1-CD1 4.41Å; F52-I116 HydrophobicContact CD1-CB 4.29Å; F52-I116 HydrophobicContact CD2-CB 4.28Å; F52-I116 HydrophobicContact CD2-CD1 3.69Å; F52-I116 HydrophobicContact CD2-CG1 4.26Å; F52-I116 HydrophobicContact CE1-CB 3.85Å; F52-I116 HydrophobicContact CE1-CG1 4.33Å; F52-I116 HydrophobicContact CE1-CG2 3.81Å; F52-I116 HydrophobicContact CE2-CB 3.86Å; F52-I116 HydrophobicContact CE2-CD1 3.22Å; F52-I116 HydrophobicContact CE2-CG1 3.54Å; F52-I116 HydrophobicContact CG-CB 4.48Å; F52-I116 HydrophobicContact CZ-CB 3.61Å; F52-I116 HydrophobicContact CZ-CD1 3.84Å; F52-I116 HydrophobicContact CZ-CG1 3.57Å; F52-I116 HydrophobicContact CZ-CG2 3.77Å; F52-I116 PolarHBondContact O-N 2.79Å
53	I	97.8	Very high	96	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137.5	170.3	-75.4	172.8	0	0	0	108.7	C44 P50 S64 C65 F67 C96 C113 K114 T115	C44-I53 HydrophobicContact CB-CD1 4.49Å; C44-I53 HydrophobicContact CB-CG2 4.37Å; P50-I53 HydrophobicContact CG-CD1 4.06Å; P50-I53 HydrophobicContact CG-CG1 3.88Å; I53-S64 CarbonylContact O-C 3.31Å; I53-S64 WeakPolarHBondContact O-CA 3.43Å; I53-S64 VanDerWaalsContact O-CB 3.22Å; I53-S64 WeakPolarHBondContact O-CB 3.41Å; I53-C65 PolarHBondContact N-O 2.85Å; I53-C65 PolarHBondContact O-N 2.86Å; I53-F67 HydrophobicContact CB-CE2 4.19Å; I53-F67 HydrophobicContact CB-CZ 4.4Å; I53-F67 HydrophobicContact CD1-CE2 3.85Å; I53-F67 HydrophobicContact CD1-CZ 3.95Å; I53-F67 HydrophobicContact CG1-CE2 3.84Å; I53-F67 HydrophobicContact CG1-CZ 4.28Å; I53-C96 HydrophobicContact CB-CB 3.77Å; I53-C96 HydrophobicContact CD1-CB 4.07Å; I53-C96 HydrophobicContact CG2-CB 3.58Å; I53-C113 WeakPolarHBondContact CG2-SG 3.43Å; I53-K114 CarbonylContact C-O 3.51Å; I53-K114 WeakPolarHBondContact CA-O 3.39Å; I53-T115 HydrophobicContact CD1-CG2 4.21Å; I53-T115 HydrophobicContact CG1-CG2 3.88Å
54	E	97.8	Very high	96	Very high	21 Å²	21	35.7 Å²	35.7	10%	0.098	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	136.6	176.8	-57.6	-175.5	125.2	0	0	110.9	F52 Y56 K61 G63 C113 K114 I116	F52-E54 HydrophobicContact CD2-CG 3.64Å; F52-E54 HydrophobicContact CE2-CG 3.73Å; E54-Y56 HydrophobicContact CB-CD2 4.27Å; E54-Y56 HydrophobicContact CB-CE2 3.55Å; E54-Y56 PolarHBondContact OE2-OH 3.09Å; E54-K61 VanDerWaalsContact OE1-CE 3.3Å; E54-K61 WeakPolarHBondContact OE1-CE 3.46Å; E54-K61 IonicContact OE1-NZ 3.66Å; E54-K61 PolarHBondContact OE1-NZ 3.49Å; E54-G63 WeakPolarHBondContact CA-O 3.47Å; E54-C113 CarbonylContact O-C 3.51Å; E54-C113 WeakPolarHBondContact O-CA 3.33Å; E54-K114 PolarHBondContact N-O 2.83Å; E54-K114 PolarHBondContact O-N 2.88Å; E54-I116 HydrophobicContact CG-CD1 4.16Å
55	W	98.4	Very high	96.1	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	139.3	171.2	-76.9	104.1	0	0	0	110.6	P29 H42 C44 I62 G63 I83 C96 L98 K112 C113	P29-W55 HydrophobicContact CB-CH2 3.96Å; P29-W55 HydrophobicContact CB-CZ3 3.93Å; P29-W55 HydrophobicContact CG-CH2 4.14Å; P29-W55 HydrophobicContact CG-CZ3 3.99Å; H42-W55 HydrophobicContact CB-CH2 3.61Å; H42-W55 HydrophobicContact CB-CZ2 4.2Å; H42-W55 HydrophobicContact CB-CZ3 4.16Å; C44-W55 HydrophobicContact CB-CH2 4Å; C44-W55 HydrophobicContact CB-CZ2 3.53Å; W55-I62 HydrophobicContact CB-CB 4.16Å; W55-I62 HydrophobicContact CB-CD1 4.29Å; W55-I62 PolarHBondContact O-N 3.48Å; W55-G63 PolarHBondContact N-O 2.83Å; W55-G63 PolarHBondContact O-N 2.94Å; W55-I83 HydrophobicContact CB-CD1 4.38Å; W55-C96 PolarHBondContact NE1-O 2.94Å; W55-L98 HydrophobicContact CB-CD2 4.29Å; W55-L98 HydrophobicContact CD2-CB 3.73Å; W55-L98 HydrophobicContact CD2-CD2 3.92Å; W55-L98 HydrophobicContact CD2-CG 4.42Å; W55-L98 HydrophobicContact CE3-CB 4.28Å; W55-L98 HydrophobicContact CE3-CD2 3.82Å; W55-L98 HydrophobicContact CG-CB 3.94Å; W55-L98 HydrophobicContact CG-CD2 4.14Å; W55-L98 HydrophobicContact CG-CG 4.47Å; W55-L98 HydrophobicContact CZ2-CB 4.09Å; W55-L98 HydrophobicContact CZ3-CD2 4.45Å; W55-K112 CarbonylContact C-O 3.49Å; W55-K112 WeakPolarHBondContact CA-O 3.27Å; W55-C113 HydrophobicContact CD2-CB 4.39Å; W55-C113 HydrophobicContact CE3-CB 4.09Å; W55-C113 HydrophobicContact CH2-CB 3.91Å; W55-C113 HydrophobicContact CZ2-CB 4.23Å; W55-C113 HydrophobicContact CZ3-CB 3.84Å
56	Y	98.4	Very high	96.1	Very high	48 Å²	48	38 Å²	38	19%	0.188	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	145.5	175.9	-65.2	-101.6	0	0	0	110.6	E54 N60 K61 Y111 K112 K114	E54-Y56 HydrophobicContact CB-CD2 4.27Å; E54-Y56 HydrophobicContact CB-CE2 3.55Å; E54-Y56 PolarHBondContact OE2-OH 3.09Å; Y56-N60 CarbonylContact C-O 3.56Å; Y56-N60 VanDerWaalsContact CA-O 3.23Å; Y56-N60 WeakPolarHBondContact CA-O 3.49Å; Y56-K61 VanDerWaalsContact CD1-CA 3.49Å; Y56-K61 HydrophobicContact CD1-CB 3.93Å; Y56-K61 HydrophobicContact CE1-CB 3.61Å; Y56-K61 HydrophobicContact CE1-CG 4.24Å; Y56-Y111 CarbonylContact O-C 3.55Å; Y56-Y111 VanDerWaalsContact O-CA 3.3Å; Y56-Y111 WeakPolarHBondContact O-CA 3.26Å; Y56-K112 PolarHBondContact N-O 3.2Å; Y56-K112 PolarHBondContact O-N 3.23Å; Y56-K114 HydrophobicContact CE2-CB 4.17Å
57	L	98	Very high	96.1	Very high	9 Å²	9	39.5 Å²	39.5	5%	0.047	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	116.7	160.6	172.1	57.3	0	0	0	107.8	T59 N60 I62 F76 F81 Y111	L57-T59 PolarHBondContact O-N 2.8Å; L57-N60 PolarHBondContact N-O 2.96Å; L57-N60 PolarHBondContact O-N 2.81Å; L57-I62 HydrophobicContact CB-CD1 3.98Å; L57-I62 HydrophobicContact CB-CG1 4.17Å; L57-F76 HydrophobicContact CB-CZ 4.19Å; L57-F76 HydrophobicContact CD2-CE1 4.44Å; L57-F76 HydrophobicContact CD2-CZ 4.43Å; L57-F81 HydrophobicContact CD2-CZ 4.36Å; L57-Y111 HydrophobicContact CD1-CD2 3.93Å; L57-Y111 HydrophobicContact CD1-CE1 4.38Å; L57-Y111 HydrophobicContact CD1-CE2 3.62Å; L57-Y111 HydrophobicContact CD1-CG 4.47Å
58	N	96.6	Very high	96.1	Very high	64 Å²	64	41.4 Å²	41.4	34%	0.342	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	-103.1	-169.8	-56.6	-48.2	0	0	0	110.6	G109 E110 K112	N58-G109 WeakPolarHBondContact OD1-CA 3.41Å; N58-E110 PolarHBondContact N-O 2.92Å; N58-E110 PolarHBondContact OD1-N 3.37Å; N58-K112 WeakPolarHBondContact O-CE 3.2Å; N58-K112 PolarHBondContact O-NZ 2.77Å
59	T	96.7	Very high	96.3	Very high	115 Å²	115	41.4 Å²	41.4	71%	0.706	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.4	-10	177.1	52.7	0	0	0	0	113.3	L57	L57-T59 PolarHBondContact O-N 2.8Å
60	N	97.2	Very high	96.6	Very high	93 Å²	93	42.9 Å²	42.9	50%	0.497	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	126.1	-171	-58.6	-37.1	0	0	0	110.1	Y56 L57 I62 F76	Y56-N60 CarbonylContact C-O 3.56Å; Y56-N60 VanDerWaalsContact CA-O 3.23Å; Y56-N60 WeakPolarHBondContact CA-O 3.49Å; L57-N60 PolarHBondContact N-O 2.96Å; L57-N60 PolarHBondContact O-N 2.81Å; N60-I62 PolarHBondContact O-N 2.83Å; N60-F76 HydrophobicContact CB-CE2 3.58Å; N60-F76 HydrophobicContact CB-CZ 3.9Å
61	K	97.5	Very high	96.7	Very high	61 Å²	61	45.8 Å²	45.8	27%	0.265	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	121.1	177	-179	174.2	171.6	174.1	0	109.7	E54 Y56 T75 F76	E54-K61 VanDerWaalsContact OE1-CE 3.3Å; E54-K61 WeakPolarHBondContact OE1-CE 3.46Å; E54-K61 IonicContact OE1-NZ 3.66Å; E54-K61 PolarHBondContact OE1-NZ 3.49Å; Y56-K61 VanDerWaalsContact CD1-CA 3.49Å; Y56-K61 HydrophobicContact CD1-CB 3.93Å; Y56-K61 HydrophobicContact CE1-CB 3.61Å; Y56-K61 HydrophobicContact CE1-CG 4.24Å; K61-T75 WeakPolarHBondContact O-CB 3.26Å; K61-F76 WeakPolarHBondContact O-CD2 3.39Å; K61-F76 WeakPolarHBondContact O-CE2 3.01Å
62	I	98	Very high	96.8	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	-46.7	173.7	-58.6	171.9	0	0	0	109.4	W55 L57 N60 T75 F76 F81 I83 L98 Y111	W55-I62 HydrophobicContact CB-CB 4.16Å; W55-I62 HydrophobicContact CB-CD1 4.29Å; W55-I62 PolarHBondContact O-N 3.48Å; L57-I62 HydrophobicContact CB-CD1 3.98Å; L57-I62 HydrophobicContact CB-CG1 4.17Å; N60-I62 PolarHBondContact O-N 2.83Å; I62-T75 PolarHBondContact O-N 2.84Å; I62-F76 HydrophobicContact CB-CD2 4.4Å; I62-F76 HydrophobicContact CG1-CD2 4.28Å; I62-F76 HydrophobicContact CG1-CE2 4.02Å; I62-F76 HydrophobicContact CG1-CZ 4.24Å; I62-F76 PolarHBondContact O-N 3.27Å; I62-F81 HydrophobicContact CD1-CD1 4.03Å; I62-F81 HydrophobicContact CD1-CE1 4.18Å; I62-F81 HydrophobicContact CG1-CD1 4.35Å; I62-F81 HydrophobicContact CG2-CB 3.7Å; I62-F81 HydrophobicContact CG2-CD1 3.79Å; I62-F81 HydrophobicContact CG2-CG 3.95Å; I62-I83 HydrophobicContact CG2-CD1 4.15Å; I62-L98 HydrophobicContact CD1-CD1 4.26Å; I62-L98 HydrophobicContact CD1-CD2 3.72Å; I62-L98 HydrophobicContact CG2-CD1 3.95Å; I62-Y111 HydrophobicContact CD1-CD1 4.09Å; I62-Y111 HydrophobicContact CD1-CE1 4.04Å
63	G	97.8	Very high	96.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163	-166.1	-178.6	0	0	0	0	0	111.7	E54 W55 T73	E54-G63 WeakPolarHBondContact CA-O 3.47Å; W55-G63 PolarHBondContact N-O 2.83Å; W55-G63 PolarHBondContact O-N 2.94Å; G63-T73 VanDerWaalsContact CA-O 3.22Å; G63-T73 WeakPolarHBondContact CA-O 3.29Å
64	S	97.8	Very high	96.5	Very high	9 Å²	9	52 Å²	52	6%	0.063	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	156.2	-172.7	65.3	0	0	0	0	114.1	I53 T72 T73	I53-S64 CarbonylContact O-C 3.31Å; I53-S64 WeakPolarHBondContact O-CA 3.43Å; I53-S64 VanDerWaalsContact O-CB 3.22Å; I53-S64 WeakPolarHBondContact O-CB 3.41Å; S64-T72 CarbonylContact O-C 3.57Å; S64-T72 WeakPolarHBondContact O-CA 3.37Å; S64-T73 PolarHBondContact N-O 2.85Å; S64-T73 PolarHBondContact N-OG1 2.87Å; S64-T73 PolarHBondContact O-N 3.03Å; S64-T73 PolarHBondContact OG-OG1 2.81Å
65	C	98.2	Very high	96.3	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	120.3	164.5	-62.9	0	0	0	0	109.1	F52 I53 F67 I83 I85 C96	F52-C65 CarbonylContact C-O 3.6Å; F52-C65 WeakPolarHBondContact CA-O 2.88Å; F52-C65 WeakPolarHBondContact CB-O 3.29Å; I53-C65 PolarHBondContact N-O 2.85Å; I53-C65 PolarHBondContact O-N 2.86Å; C65-F67 HydrophobicContact CB-CE1 3.8Å; C65-F67 HydrophobicContact CB-CE2 4.42Å; C65-F67 HydrophobicContact CB-CZ 3.76Å; C65-I83 WeakPolarHBondContact SG-CG2 3.41Å; C65-I85 HydrophobicContact CB-CD1 4.11Å; C65-I85 HydrophobicContact CB-CG1 3.7Å; C65-C96 HydrophobicContact CB-CB 3.64Å; C65-C96 WeakPolarHBondContact CB-SG 3.38Å; C65-C96 WeakPolarHBondContact SG-CA 3.38Å; C65-C96 WeakPolarHBondContact SG-CB 3.43Å; C65-C96 CovalentContact SG-SG 2.04Å; C65-C96 PolarHBondContact SG-SG 2.71Å
66	L	96.9	Very high	95.8	Very high	50 Å²	50	58.1 Å²	58.1	26%	0.262	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	108.2	174.9	-179.5	60.8	0	0	0	109.2	V51 F52 T69 N70 T71	V51-L66 HydrophobicContact CG1-CD1 4.22Å; F52-L66 HydrophobicContact CB-CD1 4.01Å; F52-L66 HydrophobicContact CD1-CD1 4.41Å; L66-T69 HydrophobicContact CD2-CG2 4.21Å; L66-T69 WeakPolarHBondContact CD2-OG1 3.11Å; L66-T69 WeakPolarHBondContact CG-OG1 3.24Å; L66-N70 WeakPolarHBondContact O-CA 3.15Å; L66-N70 PolarHBondContact O-N 2.9Å; L66-T71 PolarHBondContact N-O 3.03Å; L66-T71 PolarHBondContact O-N 2.95Å; L66-T71 VanDerWaalsContact O-N 3.08Å
67	F	94	Very high	95.2	Very high	32 Å²	32	58.9 Å²	58.9	14%	0.14	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-28.2	-169.1	-61.6	-60.4	0	0	0	113.6	P50 V51 I53 C65 T69 N70 I85 P94 C96	P50-F67 HydrophobicContact CG-CD2 3.98Å; P50-F67 HydrophobicContact CG-CE2 3.73Å; P50-F67 WeakPolarHBondContact O-CD2 3.4Å; V51-F67 PolarHBondContact O-N 2.84Å; V51-F67 VanDerWaalsContact O-N 3.11Å; I53-F67 HydrophobicContact CB-CE2 4.19Å; I53-F67 HydrophobicContact CB-CZ 4.4Å; I53-F67 HydrophobicContact CD1-CE2 3.85Å; I53-F67 HydrophobicContact CD1-CZ 3.95Å; I53-F67 HydrophobicContact CG1-CE2 3.84Å; I53-F67 HydrophobicContact CG1-CZ 4.28Å; C65-F67 HydrophobicContact CB-CE1 3.8Å; C65-F67 HydrophobicContact CB-CE2 4.42Å; C65-F67 HydrophobicContact CB-CZ 3.76Å; F67-T69 VanDerWaalsContact C-N 3.3Å; F67-T69 PolarHBondContact O-N 2.91Å; F67-N70 PolarHBondContact O-N 3.39Å; F67-I85 HydrophobicContact CD1-CD1 4.26Å; F67-I85 HydrophobicContact CD1-CG1 4.41Å; F67-I85 HydrophobicContact CD1-CG2 4.13Å; F67-I85 HydrophobicContact CE1-CD1 4.43Å; F67-I85 HydrophobicContact CE1-CG1 4.11Å; F67-I85 HydrophobicContact CE1-CG2 4.03Å; F67-P94 HydrophobicContact CD1-CB 3.51Å; F67-P94 HydrophobicContact CD1-CG 4.27Å; F67-P94 HydrophobicContact CD2-CB 4.42Å; F67-P94 HydrophobicContact CD2-CG 4.38Å; F67-P94 HydrophobicContact CE1-CB 3.48Å; F67-P94 VanDerWaalsContact CE1-CB 3.48Å; F67-P94 HydrophobicContact CE1-CG 4.37Å; F67-P94 HydrophobicContact CE2-CB 4.38Å; F67-P94 HydrophobicContact CE2-CG 4.45Å; F67-P94 HydrophobicContact CG-CB 4Å; F67-P94 HydrophobicContact CG-CG 4.27Å; F67-P94 HydrophobicContact CZ-CB 3.91Å; F67-P94 HydrophobicContact CZ-CG 4.43Å; F67-C96 HydrophobicContact CZ-CB 4.11Å
68	Q	91.7	Very high	94.9	Very high	123 Å²	123	61.2 Å²	61.2	58%	0.575	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-37.5	177.4	-69	-179.4	-10.5	0	0	112.8	V51 H118	V51-Q68 HydrophobicContact CG1-CG 4.41Å; Q68-H118 PolarHBondContact NE2-CE1 3.39Å; Q68-H118 PolarHBondContact NE2-NE2 2.01Å
69	T	94.8	Very high	94.8	Very high	83 Å²	83	63 Å²	63	51%	0.509	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-3.3	-179.9	59.3	0	0	0	0	112.9	L66 F67 T71	L66-T69 HydrophobicContact CD2-CG2 4.21Å; L66-T69 WeakPolarHBondContact CD2-OG1 3.11Å; L66-T69 WeakPolarHBondContact CG-OG1 3.24Å; F67-T69 VanDerWaalsContact C-N 3.3Å; F67-T69 PolarHBondContact O-N 2.91Å; T69-T71 VanDerWaalsContact C-N 3.32Å; T69-T71 PolarHBondContact O-N 3.5Å; T69-T71 PolarHBondContact OG1-OG1 2.8Å
70	N	94.2	Very high	94.8	Very high	114 Å²	114	59.3 Å²	59.3	61%	0.61	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	48.7	-173.3	-167	28.5	0	0	0	112.6	L66 F67 I85	L66-N70 WeakPolarHBondContact O-CA 3.15Å; L66-N70 PolarHBondContact O-N 2.9Å; F67-N70 PolarHBondContact O-N 3.39Å; N70-I85 WeakPolarHBondContact OD1-CD1 3.3Å; N70-I85 WeakPolarHBondContact OD1-CG2 3.44Å
71	T	97.1	Very high	94.8	Very high	65 Å²	65	55 Å²	55	40%	0.399	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	156.1	-179.6	57.5	0	0	0	0	111.6	L66 T69 I85	L66-T71 PolarHBondContact N-O 3.03Å; L66-T71 PolarHBondContact O-N 2.95Å; L66-T71 VanDerWaalsContact O-N 3.08Å; T69-T71 VanDerWaalsContact C-N 3.32Å; T69-T71 PolarHBondContact O-N 3.5Å; T69-T71 PolarHBondContact OG1-OG1 2.8Å; T71-I85 WeakPolarHBondContact O-CD1 3.44Å
72	T	97.1	Very high	94.8	Very high	69 Å²	69	56.2 Å²	56.2	42%	0.423	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	155.2	174.2	61.7	0	0	0	0	111	S64 I83 I85	S64-T72 CarbonylContact O-C 3.57Å; S64-T72 WeakPolarHBondContact O-CA 3.37Å; T72-I83 HydrophobicContact CG2-CG2 4.05Å; T72-I83 WeakPolarHBondContact CG2-O 3.32Å; T72-I85 HydrophobicContact CG2-CD1 4.11Å; T72-I85 HydrophobicContact CG2-CG1 3.88Å
73	T	95.9	Very high	94.8	Very high	58 Å²	58	57 Å²	57	36%	0.356	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	145.9	171.7	73.6	0	0	0	0	109.5	G63 S64	G63-T73 VanDerWaalsContact CA-O 3.22Å; G63-T73 WeakPolarHBondContact CA-O 3.29Å; S64-T73 PolarHBondContact N-O 2.85Å; S64-T73 PolarHBondContact N-OG1 2.87Å; S64-T73 PolarHBondContact O-N 3.03Å; S64-T73 PolarHBondContact OG-OG1 2.81Å
74	N	93.1	Very high	94.7	Very high	77 Å²	77	60.5 Å²	60.5	41%	0.412	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	110.9	168.9	-175.6	-21.9	0	0	0	107.9	F76 G77 F81	N74-F76 PolarHBondContact OD1-N 3.15Å; N74-F76 VanDerWaalsContact OD1-N 3.08Å; N74-G77 PolarHBondContact OD1-N 3.25Å; N74-F81 PolarHBondContact ND2-O 2.84Å; N74-F81 VanDerWaalsContact ND2-O 3.13Å
75	T	93.6	Very high	94.7	Very high	84 Å²	84	61.9 Å²	61.9	52%	0.515	35%	0.351	S	S	.	.	S	Bend	trans	-92	-26.9	-180	-53.5	0	0	0	0	111.7	K61 I62 G77	K61-T75 WeakPolarHBondContact O-CB 3.26Å; I62-T75 PolarHBondContact O-N 2.84Å; T75-G77 VanDerWaalsContact C-N 3.31Å; T75-G77 PolarHBondContact O-N 2.93Å
76	F	86.3	Confident	94.5	Very high	66 Å²	66	63 Å²	63	29%	0.289	36%	0.361	S	S	.	.	S	Bend	trans	-68.2	-29.9	178.4	-104.3	-134.7	0	0	0	112.9	L57 N60 K61 I62 N74 D78 F81	L57-F76 HydrophobicContact CB-CZ 4.19Å; L57-F76 HydrophobicContact CD2-CE1 4.44Å; L57-F76 HydrophobicContact CD2-CZ 4.43Å; N60-F76 HydrophobicContact CB-CE2 3.58Å; N60-F76 HydrophobicContact CB-CZ 3.9Å; K61-F76 WeakPolarHBondContact O-CD2 3.39Å; K61-F76 WeakPolarHBondContact O-CE2 3.01Å; I62-F76 HydrophobicContact CB-CD2 4.4Å; I62-F76 HydrophobicContact CG1-CD2 4.28Å; I62-F76 HydrophobicContact CG1-CE2 4.02Å; I62-F76 HydrophobicContact CG1-CZ 4.24Å; I62-F76 PolarHBondContact O-N 3.27Å; N74-F76 PolarHBondContact OD1-N 3.15Å; N74-F76 VanDerWaalsContact OD1-N 3.08Å; F76-D78 PolarHBondContact O-N 3.26Å; F76-F81 HydrophobicContact CB-CD2 4.39Å; F76-F81 AromaticContact CD1-CD2 3.58Å; F76-F81 HydrophobicContact CD1-CD2 3.58Å; F76-F81 HydrophobicContact CD1-CE1 4.42Å; F76-F81 AromaticContact CD1-CE2 3.4Å; F76-F81 HydrophobicContact CD1-CE2 3.4Å; F76-F81 VanDerWaalsContact CD1-CE2 3.4Å; F76-F81 HydrophobicContact CD1-CG 4.2Å; F76-F81 AromaticContact CD1-CZ 3.87Å; F76-F81 HydrophobicContact CD1-CZ 3.87Å; F76-F81 HydrophobicContact CE1-CD2 4.3Å; F76-F81 HydrophobicContact CE1-CE1 4.3Å; F76-F81 AromaticContact CE1-CE2 3.72Å; F76-F81 HydrophobicContact CE1-CE2 3.72Å; F76-F81 AromaticContact CE1-CZ 3.73Å; F76-F81 HydrophobicContact CE1-CZ 3.73Å; F76-F81 HydrophobicContact CG-CD2 4.35Å
77	G	86.5	Confident	94.3	Very high	64 Å²	64	66.1 Å²	66.1	66%	0.66	38%	0.375	S	S	*	.			trans	69.6	-13.6	-175.4	0	0	0	0	0	114.2	N74 T75	N74-G77 PolarHBondContact OD1-N 3.25Å; T75-G77 VanDerWaalsContact C-N 3.31Å; T75-G77 PolarHBondContact O-N 2.93Å
78	D	91.5	Very high	93.8	Very high	58 Å²	58	67.3 Å²	67.3	31%	0.31	38%	0.379	S	S	.	.			trans	-75.6	121	172.7	-173	-28.7	0	0	0	110	F76 K80 F81	F76-D78 PolarHBondContact O-N 3.26Å; D78-K80 PolarHBondContact O-N 3.3Å; D78-K80 VanDerWaalsContact O-N 3.15Å; D78-K80 VanDerWaalsContact OD1-CB 3.31Å; D78-K80 WeakPolarHBondContact OD1-CB 3.03Å; D78-K80 VanDerWaalsContact OD1-CG 3.31Å; D78-K80 WeakPolarHBondContact OD1-CG 3.22Å; D78-K80 PolarHBondContact OD1-N 3.15Å; D78-K80 WeakPolarHBondContact OD2-CE 3.45Å; D78-K80 IonicContact OD2-NZ 2.85Å; D78-F81 HydrophobicContact CB-CD2 4.01Å; D78-F81 HydrophobicContact CB-CE2 4.39Å; D78-F81 PolarHBondContact O-N 2.8Å
79	P	94.3	Very high	93.2	Very high	102 Å²	102	67.1 Å²	67.1	66%	0.662	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-13	-177.2	29	-37	0	0	0	113.7	F81	P79-F81 PolarHBondContact O-N 2.87Å
80	K	96.5	Very high	92.3	Very high	36 Å²	36	70.3 Å²	70.3	16%	0.157	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-29.8	177.4	87.7	167.3	78.3	164.7	0	112	D78 V100 T101 D107	D78-K80 PolarHBondContact O-N 3.3Å; D78-K80 VanDerWaalsContact O-N 3.15Å; D78-K80 VanDerWaalsContact OD1-CB 3.31Å; D78-K80 WeakPolarHBondContact OD1-CB 3.03Å; D78-K80 VanDerWaalsContact OD1-CG 3.31Å; D78-K80 WeakPolarHBondContact OD1-CG 3.22Å; D78-K80 PolarHBondContact OD1-N 3.15Å; D78-K80 WeakPolarHBondContact OD2-CE 3.45Å; D78-K80 IonicContact OD2-NZ 2.85Å; K80-V100 HydrophobicContact CD-CG1 3.99Å; K80-V100 HydrophobicContact CG-CG1 4.12Å; K80-V100 WeakPolarHBondContact O-CA 3.44Å; K80-T101 WeakPolarHBondContact CB-O 3.39Å; K80-T101 PolarHBondContact O-N 2.63Å; K80-T101 PolarHBondContact O-OG1 2.89Å; K80-D107 VanDerWaalsContact NZ-CG 3.34Å; K80-D107 IonicContact NZ-OD1 2.78Å; K80-D107 PolarHBondContact NZ-OD1 3.34Å; K80-D107 IonicContact NZ-OD2 3.56Å; K80-D107 PolarHBondContact NZ-OD2 2.93Å
81	F	97.9	Very high	91.5	Very high	2 Å²	2	71 Å²	71	1%	0.009	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	115.1	178.8	-63.5	-91.5	0	0	0	109.7	L57 I62 N74 F76 D78 P79 L98 V100 Y111	L57-F81 HydrophobicContact CD2-CZ 4.36Å; I62-F81 HydrophobicContact CD1-CD1 4.03Å; I62-F81 HydrophobicContact CD1-CE1 4.18Å; I62-F81 HydrophobicContact CG1-CD1 4.35Å; I62-F81 HydrophobicContact CG2-CB 3.7Å; I62-F81 HydrophobicContact CG2-CD1 3.79Å; I62-F81 HydrophobicContact CG2-CG 3.95Å; N74-F81 PolarHBondContact ND2-O 2.84Å; N74-F81 VanDerWaalsContact ND2-O 3.13Å; F76-F81 HydrophobicContact CB-CD2 4.39Å; F76-F81 AromaticContact CD1-CD2 3.58Å; F76-F81 HydrophobicContact CD1-CD2 3.58Å; F76-F81 HydrophobicContact CD1-CE1 4.42Å; F76-F81 AromaticContact CD1-CE2 3.4Å; F76-F81 HydrophobicContact CD1-CE2 3.4Å; F76-F81 VanDerWaalsContact CD1-CE2 3.4Å; F76-F81 HydrophobicContact CD1-CG 4.2Å; F76-F81 AromaticContact CD1-CZ 3.87Å; F76-F81 HydrophobicContact CD1-CZ 3.87Å; F76-F81 HydrophobicContact CE1-CD2 4.3Å; F76-F81 HydrophobicContact CE1-CE1 4.3Å; F76-F81 AromaticContact CE1-CE2 3.72Å; F76-F81 HydrophobicContact CE1-CE2 3.72Å; F76-F81 AromaticContact CE1-CZ 3.73Å; F76-F81 HydrophobicContact CE1-CZ 3.73Å; F76-F81 HydrophobicContact CG-CD2 4.35Å; D78-F81 HydrophobicContact CB-CD2 4.01Å; D78-F81 HydrophobicContact CB-CE2 4.39Å; D78-F81 PolarHBondContact O-N 2.8Å; P79-F81 PolarHBondContact O-N 2.87Å; F81-L98 HydrophobicContact CD1-CD1 4.43Å; F81-V100 HydrophobicContact CD1-CB 4.4Å; F81-V100 HydrophobicContact CD1-CG1 4Å; F81-V100 HydrophobicContact CD1-CG2 3.61Å; F81-V100 HydrophobicContact CE1-CB 4.48Å; F81-V100 HydrophobicContact CE1-CG1 3.8Å; F81-V100 HydrophobicContact CE1-CG2 3.81Å; F81-V100 HydrophobicContact CZ-CG1 4.15Å; F81-Y111 HydrophobicContact CE1-CE1 4.31Å
82	Q	97.4	Very high	91	Very high	87 Å²	87	73.6 Å²	73.6	41%	0.407	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.5	-179	-62.5	177.4	2.8	0	0	109.5	I99	Q82-I99 HydrophobicContact CB-CB 4.31Å; Q82-I99 PolarHBondContact N-O 2.82Å; Q82-I99 PolarHBondContact O-N 3.24Å
83	I	97.8	Very high	90.7	Very high	19 Å²	19	71.1 Å²	71.1	10%	0.097	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128.6	178.3	-63.7	177	0	0	0	108.4	W55 I62 C65 T72 Q97 L98	W55-I83 HydrophobicContact CB-CD1 4.38Å; I62-I83 HydrophobicContact CG2-CD1 4.15Å; C65-I83 WeakPolarHBondContact SG-CG2 3.41Å; T72-I83 HydrophobicContact CG2-CG2 4.05Å; T72-I83 WeakPolarHBondContact CG2-O 3.32Å; I83-Q97 VanDerWaalsContact CA-O 3.29Å; I83-Q97 WeakPolarHBondContact CA-O 3.47Å; I83-L98 HydrophobicContact CG1-CD1 4.03Å
84	I	97.1	Very high	90.7	Very high	72 Å²	72	69.3 Å²	69.3	37%	0.369	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	138.3	-174.5	-54.2	177.6	0	0	0	109.2	Q97 I99	I84-Q97 PolarHBondContact N-O 3.46Å; I84-Q97 PolarHBondContact O-N 3.15Å; I84-I99 HydrophobicContact CD1-CD1 3.68Å
85	I	97.1	Very high	90.8	Very high	39 Å²	39	66.2 Å²	66.2	20%	0.2	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	123.7	169	-65.9	171.8	0	0	0	108.4	C65 F67 N70 T71 T72 I95	C65-I85 HydrophobicContact CB-CD1 4.11Å; C65-I85 HydrophobicContact CB-CG1 3.7Å; F67-I85 HydrophobicContact CD1-CD1 4.26Å; F67-I85 HydrophobicContact CD1-CG1 4.41Å; F67-I85 HydrophobicContact CD1-CG2 4.13Å; F67-I85 HydrophobicContact CE1-CD1 4.43Å; F67-I85 HydrophobicContact CE1-CG1 4.11Å; F67-I85 HydrophobicContact CE1-CG2 4.03Å; N70-I85 WeakPolarHBondContact OD1-CD1 3.3Å; N70-I85 WeakPolarHBondContact OD1-CG2 3.44Å; T71-I85 WeakPolarHBondContact O-CD1 3.44Å; T72-I85 HydrophobicContact CG2-CD1 4.11Å; T72-I85 HydrophobicContact CG2-CG1 3.88Å; I85-I95 WeakPolarHBondContact CA-O 3.47Å
86	G	94.3	Very high	91	Very high	22 Å²	22	62.2 Å²	62.2	23%	0.227	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	-174.7	172.2	0	0	0	0	0	111.5	I95	G86-I95 PolarHBondContact N-O 3.47Å; G86-I95 PolarHBondContact O-N 3.07Å
87	Q	91.6	Very high	91.6	Very high	117 Å²	117	61 Å²	61	55%	0.547	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	135.3	177.2	-168	171.8	34.7	0	0	110.4	T89 L92 L93	Q87-T89 PolarHBondContact O-N 3.4Å; Q87-L92 PolarHBondContact NE2-O 2.84Å; Q87-L93 CarbonylContact C-O 3.46Å; Q87-L93 WeakPolarHBondContact CA-O 3.44Å
88	Y	83.7	Confident	92.1	Very high	56 Å²	56	58 Å²	58	22%	0.22	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	108.8	174.3	-172.5	-116.9	0	0	0	109	V26 L27 E90 K91 L92 L93 I95	V26-Y88 HydrophobicContact CG1-CD1 4.09Å; V26-Y88 HydrophobicContact CG1-CE1 3.9Å; L27-Y88 HydrophobicContact CD1-CD2 4.14Å; Y88-E90 VanDerWaalsContact C-N 3.32Å; Y88-E90 HydrophobicContact CD1-CB 4.35Å; Y88-E90 HydrophobicContact CE1-CB 3.83Å; Y88-E90 HydrophobicContact CE1-CG 4.35Å; Y88-E90 PolarHBondContact O-N 3.18Å; Y88-E90 PolarHBondContact OH-OE2 3.32Å; Y88-K91 HydrophobicContact CD1-CB 4.36Å; Y88-K91 PolarHBondContact O-N 3.26Å; Y88-L92 WeakPolarHBondContact O-CA 3.26Å; Y88-L92 PolarHBondContact O-N 2.76Å; Y88-L93 PolarHBondContact N-O 3.16Å; Y88-L93 PolarHBondContact O-N 2.88Å; Y88-I95 HydrophobicContact CD2-CD1 4.32Å
89	T	78.4	Confident	92.4	Very high	120 Å²	120	56.5 Å²	56.5	74%	0.736	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-36	-165.9	49.5	0	0	0	0	114	Q87 K91	Q87-T89 PolarHBondContact O-N 3.4Å; T89-K91 VanDerWaalsContact C-N 3.29Å; T89-K91 PolarHBondContact O-N 3Å
90	E	76.7	Confident	92.6	Very high	150 Å²	150	51.6 Å²	51.6	70%	0.701	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-26.8	-176	-64.7	-177.9	-164.2	0	0	113.7	Y88	Y88-E90 VanDerWaalsContact C-N 3.32Å; Y88-E90 HydrophobicContact CD1-CB 4.35Å; Y88-E90 HydrophobicContact CE1-CB 3.83Å; Y88-E90 HydrophobicContact CE1-CG 4.35Å; Y88-E90 PolarHBondContact O-N 3.18Å; Y88-E90 PolarHBondContact OH-OE2 3.32Å
91	K	78.4	Confident	92.7	Very high	128 Å²	128	51.9 Å²	51.9	56%	0.557	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.4	4.1	-173.9	-64.3	-173.3	178.5	179.9	0	114.3	Y88 T89 L93	Y88-K91 HydrophobicContact CD1-CB 4.36Å; Y88-K91 PolarHBondContact O-N 3.26Å; T89-K91 VanDerWaalsContact C-N 3.29Å; T89-K91 PolarHBondContact O-N 3Å; K91-L93 HydrophobicContact CB-CD1 3.74Å; K91-L93 HydrophobicContact CB-CG 3.71Å; K91-L93 HydrophobicContact CD-CD1 3.94Å; K91-L93 HydrophobicContact CG-CD1 4.48Å; K91-L93 PolarHBondContact O-N 2.84Å; K91-L93 VanDerWaalsContact O-N 3.09Å
92	L	85.9	Confident	92.7	Very high	119 Å²	119	57.2 Å²	57.2	62%	0.623	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	24	-173.7	-61.7	170.9	0	0	0	113.6	Q87 Y88	Q87-L92 PolarHBondContact NE2-O 2.84Å; Y88-L92 WeakPolarHBondContact O-CA 3.26Å; Y88-L92 PolarHBondContact O-N 2.76Å
93	L	91.4	Very high	92.7	Very high	17 Å²	17	53.1 Å²	53.1	9%	0.089	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	140.6	-178.6	-67.1	170.4	0	0	0	110.5	V26 M47 V49 Q87 Y88 K91	V26-L93 HydrophobicContact CG2-CD1 3.75Å; M47-L93 WeakPolarHBondContact O-CD2 3.31Å; V49-L93 HydrophobicContact CG2-CD2 4.41Å; Q87-L93 CarbonylContact C-O 3.46Å; Q87-L93 WeakPolarHBondContact CA-O 3.44Å; Y88-L93 PolarHBondContact N-O 3.16Å; Y88-L93 PolarHBondContact O-N 2.88Å; K91-L93 HydrophobicContact CB-CD1 3.74Å; K91-L93 HydrophobicContact CB-CG 3.71Å; K91-L93 HydrophobicContact CD-CD1 3.94Å; K91-L93 HydrophobicContact CG-CD1 4.48Å; K91-L93 PolarHBondContact O-N 2.84Å; K91-L93 VanDerWaalsContact O-N 3.09Å
94	P	94.6	Very high	92.6	Very high	20 Å²	20	55.6 Å²	55.6	13%	0.13	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	142.6	176.1	27.2	-32.6	0	0	0	111.1	S45 V49 F67	S45-P94 WeakPolarHBondContact CB-O 3.4Å; S45-P94 PolarHBondContact OG-O 3.1Å; V49-P94 HydrophobicContact CG1-CG 4.08Å; V49-P94 HydrophobicContact CG2-CG 4.37Å; F67-P94 HydrophobicContact CD1-CB 3.51Å; F67-P94 HydrophobicContact CD1-CG 4.27Å; F67-P94 HydrophobicContact CD2-CB 4.42Å; F67-P94 HydrophobicContact CD2-CG 4.38Å; F67-P94 HydrophobicContact CE1-CB 3.48Å; F67-P94 VanDerWaalsContact CE1-CB 3.48Å; F67-P94 HydrophobicContact CE1-CG 4.37Å; F67-P94 HydrophobicContact CE2-CB 4.38Å; F67-P94 HydrophobicContact CE2-CG 4.45Å; F67-P94 HydrophobicContact CG-CB 4Å; F67-P94 HydrophobicContact CG-CG 4.27Å; F67-P94 HydrophobicContact CZ-CB 3.91Å; F67-P94 HydrophobicContact CZ-CG 4.43Å
95	I	95.9	Very high	92.5	Very high	13 Å²	13	55 Å²	55	7%	0.067	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	132.8	173.2	-54.9	176.7	0	0	0	108	L27 C44 I85 G86 Y88 Q97	L27-I95 HydrophobicContact CD1-CD1 3.72Å; L27-I95 HydrophobicContact CD1-CG1 4.02Å; L27-I95 HydrophobicContact CD1-CG2 4.27Å; C44-I95 WeakPolarHBondContact O-CA 3.46Å; I85-I95 WeakPolarHBondContact CA-O 3.47Å; G86-I95 PolarHBondContact N-O 3.47Å; G86-I95 PolarHBondContact O-N 3.07Å; Y88-I95 HydrophobicContact CD2-CD1 4.32Å; I95-Q97 HydrophobicContact CB-CG 4.42Å; I95-Q97 HydrophobicContact CG2-CG 3.51Å
96	C	97.7	Very high	92.4	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	111.1	162.6	-166.3	0	0	0	0	109.3	C44 I53 W55 C65 F67	C44-C96 PolarHBondContact N-O 2.88Å; C44-C96 PolarHBondContact O-N 3.45Å; I53-C96 HydrophobicContact CB-CB 3.77Å; I53-C96 HydrophobicContact CD1-CB 4.07Å; I53-C96 HydrophobicContact CG2-CB 3.58Å; W55-C96 PolarHBondContact NE1-O 2.94Å; C65-C96 HydrophobicContact CB-CB 3.64Å; C65-C96 WeakPolarHBondContact CB-SG 3.38Å; C65-C96 WeakPolarHBondContact SG-CA 3.38Å; C65-C96 WeakPolarHBondContact SG-CB 3.43Å; C65-C96 CovalentContact SG-SG 2.04Å; C65-C96 PolarHBondContact SG-SG 2.71Å; F67-C96 HydrophobicContact CZ-CB 4.11Å
97	Q	97.9	Very high	92.5	Very high	41 Å²	41	57.9 Å²	57.9	19%	0.192	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	133.2	-179.8	-58.4	-167.9	-69.1	0	0	110.3	H42 S43 I83 I84 I95	H42-Q97 CarbonylContact O-C 3.59Å; H42-Q97 VanDerWaalsContact O-CA 3.31Å; H42-Q97 WeakPolarHBondContact O-CA 3.43Å; S43-Q97 PolarHBondContact OG-NE2 3.02Å; S43-Q97 VanDerWaalsContact OG-NE2 3.15Å; I83-Q97 VanDerWaalsContact CA-O 3.29Å; I83-Q97 WeakPolarHBondContact CA-O 3.47Å; I84-Q97 PolarHBondContact N-O 3.46Å; I84-Q97 PolarHBondContact O-N 3.15Å; I95-Q97 HydrophobicContact CB-CG 4.42Å; I95-Q97 HydrophobicContact CG2-CG 3.51Å
98	L	98.3	Very high	92.7	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	123.7	168.9	173.8	65.6	0	0	0	108.5	Q41 H42 W55 I62 F81 I83 V100 Y111	Q41-L98 CarbonylContact C-O 3.45Å; Q41-L98 WeakPolarHBondContact CA-O 3.38Å; H42-L98 PolarHBondContact N-O 2.89Å; H42-L98 PolarHBondContact O-N 3.21Å; W55-L98 HydrophobicContact CB-CD2 4.29Å; W55-L98 HydrophobicContact CD2-CB 3.73Å; W55-L98 HydrophobicContact CD2-CD2 3.92Å; W55-L98 HydrophobicContact CD2-CG 4.42Å; W55-L98 HydrophobicContact CE3-CB 4.28Å; W55-L98 HydrophobicContact CE3-CD2 3.82Å; W55-L98 HydrophobicContact CG-CB 3.94Å; W55-L98 HydrophobicContact CG-CD2 4.14Å; W55-L98 HydrophobicContact CG-CG 4.47Å; W55-L98 HydrophobicContact CZ2-CB 4.09Å; W55-L98 HydrophobicContact CZ3-CD2 4.45Å; I62-L98 HydrophobicContact CD1-CD1 4.26Å; I62-L98 HydrophobicContact CD1-CD2 3.72Å; I62-L98 HydrophobicContact CG2-CD1 3.95Å; F81-L98 HydrophobicContact CD1-CD1 4.43Å; I83-L98 HydrophobicContact CG1-CD1 4.03Å; L98-V100 HydrophobicContact CD1-CG2 4.19Å; L98-V100 HydrophobicContact CD2-CG2 4.28Å; L98-V100 HydrophobicContact CG-CG2 4.04Å; L98-Y111 HydrophobicContact CD2-CD1 3.52Å; L98-Y111 HydrophobicContact CD2-CE1 3.84Å
99	I	98.1	Very high	93.3	Very high	25 Å²	25	50.9 Å²	50.9	13%	0.128	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	127.6	172.5	-58.1	172.2	0	0	0	107.2	T39 I40 Q41 Q82 I84 T101	T39-I99 HydrophobicContact CG2-CG2 3.69Å; I40-I99 WeakPolarHBondContact O-CA 3.48Å; Q41-I99 HydrophobicContact CB-CG1 4.41Å; Q41-I99 HydrophobicContact CG-CG1 4.01Å; Q82-I99 HydrophobicContact CB-CB 4.31Å; Q82-I99 PolarHBondContact N-O 2.82Å; Q82-I99 PolarHBondContact O-N 3.24Å; I84-I99 HydrophobicContact CD1-CD1 3.68Å; I99-T101 HydrophobicContact CG2-CG2 4.05Å
100	V	98	Very high	94.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	110.4	173.5	-169.1	0	0	0	0	107.6	T39 I40 K80 F81 L98 I103 Y111	T39-V100 CarbonylContact C-O 3.49Å; T39-V100 VanDerWaalsContact CA-O 3.26Å; T39-V100 WeakPolarHBondContact CA-O 3.46Å; I40-V100 HydrophobicContact CD1-CB 4.12Å; I40-V100 HydrophobicContact CD1-CG2 4.05Å; I40-V100 HydrophobicContact CG1-CB 3.67Å; I40-V100 HydrophobicContact CG1-CG2 4Å; I40-V100 PolarHBondContact N-O 2.85Å; I40-V100 PolarHBondContact O-N 2.87Å; K80-V100 HydrophobicContact CD-CG1 3.99Å; K80-V100 HydrophobicContact CG-CG1 4.12Å; K80-V100 WeakPolarHBondContact O-CA 3.44Å; F81-V100 HydrophobicContact CD1-CB 4.4Å; F81-V100 HydrophobicContact CD1-CG1 4Å; F81-V100 HydrophobicContact CD1-CG2 3.61Å; F81-V100 HydrophobicContact CE1-CB 4.48Å; F81-V100 HydrophobicContact CE1-CG1 3.8Å; F81-V100 HydrophobicContact CE1-CG2 3.81Å; F81-V100 HydrophobicContact CZ-CG1 4.15Å; L98-V100 HydrophobicContact CD1-CG2 4.19Å; L98-V100 HydrophobicContact CD2-CG2 4.28Å; L98-V100 HydrophobicContact CG-CG2 4.04Å; V100-I103 HydrophobicContact CG1-CG1 4.3Å; V100-Y111 HydrophobicContact CG2-CE1 4.01Å
101	T	98.1	Very high	95.3	Very high	42 Å²	42	41 Å²	41	26%	0.258	21%	0.214	S	C	.	.			trans	-91.1	154.4	-179.9	57.3	0	0	0	0	111	T39 K80 I99 I103	T39-T101 HydrophobicContact CG2-CG2 4.01Å; K80-T101 WeakPolarHBondContact CB-O 3.39Å; K80-T101 PolarHBondContact O-N 2.63Å; K80-T101 PolarHBondContact O-OG1 2.89Å; I99-T101 HydrophobicContact CG2-CG2 4.05Å; T101-I103 PolarHBondContact O-N 2.86Å; T101-I103 VanDerWaalsContact O-N 3.16Å
102	N	97.8	Very high	96.3	Very high	114 Å²	114	37 Å²	37	61%	0.61	20%	0.197	S	C	*	.	S	Bend	trans	46.5	48.3	177.9	-169.1	43.9	0	0	0	112.5	G37 S38	G37-N102 WeakPolarHBondContact CA-OD1 3.35Å; S38-N102 PolarHBondContact O-N 2.65Å
103	I	97.5	Very high	96.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.167	C	C	.	.			trans	-61.7	145	-175.2	-159.1	174.2	0	0	0	110.5	T34 A36 G37 S38 I40 V100 T101 D107 I129 V131	T34-I103 HydrophobicContact CG2-CD1 4.18Å; T34-I103 HydrophobicContact CG2-CG2 3.89Å; A36-I103 CarbonylContact C-O 3.59Å; A36-I103 VanDerWaalsContact CA-O 3.22Å; A36-I103 WeakPolarHBondContact CA-O 3.49Å; G37-I103 PolarHBondContact N-O 2.87Å; S38-I103 WeakPolarHBondContact O-CG2 3.43Å; S38-I103 PolarHBondContact O-N 3.32Å; I40-I103 HydrophobicContact CD1-CD1 3.67Å; I40-I103 HydrophobicContact CG1-CD1 4Å; I40-I103 HydrophobicContact CG2-CD1 4.14Å; V100-I103 HydrophobicContact CG1-CG1 4.3Å; T101-I103 PolarHBondContact O-N 2.86Å; T101-I103 VanDerWaalsContact O-N 3.16Å; I103-D107 HydrophobicContact CD1-CB 4.13Å; I103-D107 HydrophobicContact CG1-CB 3.54Å; I103-I129 HydrophobicContact CD1-CG2 4.35Å; I103-V131 HydrophobicContact CD1-CG2 3.62Å; I103-V131 HydrophobicContact CG1-CG2 3.73Å; I103-V131 HydrophobicContact CG2-CG2 4.18Å
104	D	95.9	Very high	97.1	Very high	71 Å²	71	33.9 Å²	33.9	38%	0.38	18%	0.177	S	C	.	.			trans	-133.2	172.1	179.6	-165.4	11.1	0	0	0	111.6	V106 D107 V131	D104-V106 HydrophobicContact CB-CG2 4.49Å; D104-V106 PolarHBondContact O-N 3.29Å; D104-V106 VanDerWaalsContact O-N 3.07Å; D104-D107 PolarHBondContact N-OD2 3.27Å; D104-D107 WeakPolarHBondContact O-CB 3.39Å; D104-D107 PolarHBondContact O-N 2.87Å; D104-V131 WeakPolarHBondContact O-CG2 3.32Å
105	F	94.7	Very high	97.2	Very high	60 Å²	60	33 Å²	33	26%	0.263	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-54	-32.4	-175.4	-63.7	-73.4	0	0	0	113.8	A36 D107 T108 V131 K164	A36-F105 HydrophobicContact CB-CE2 4.22Å; A36-F105 HydrophobicContact CB-CZ 4.44Å; F105-D107 PolarHBondContact O-N 2.76Å; F105-T108 WeakPolarHBondContact O-CB 3.5Å; F105-T108 PolarHBondContact O-N 2.98Å; F105-T108 PolarHBondContact O-OG1 3.49Å; F105-V131 HydrophobicContact CD1-CG1 4.26Å; F105-V131 WeakPolarHBondContact CD1-O 3.25Å; F105-V131 HydrophobicContact CE1-CG1 4.49Å; F105-K164 HydrophobicContact CD1-CD 3.76Å; F105-K164 HydrophobicContact CD1-CG 4.01Å; F105-K164 HydrophobicContact CD2-CD 4.31Å; F105-K164 HydrophobicContact CE1-CB 4.04Å; F105-K164 HydrophobicContact CE1-CD 3.53Å; F105-K164 HydrophobicContact CE1-CG 3.77Å; F105-K164 HydrophobicContact CE2-CD 4.09Å; F105-K164 HydrophobicContact CG-CD 4.16Å; F105-K164 HydrophobicContact CZ-CD 3.7Å; F105-K164 HydrophobicContact CZ-CG 4.38Å
106	V	94.8	Very high	97.1	Very high	114 Å²	114	33.6 Å²	33.6	69%	0.691	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	-68.3	-20.3	177.4	-61.4	0	0	0	0	113.5	D104 T108	D104-V106 HydrophobicContact CB-CG2 4.49Å; D104-V106 PolarHBondContact O-N 3.29Å; D104-V106 VanDerWaalsContact O-N 3.07Å; V106-T108 VanDerWaalsContact C-N 3.27Å
107	D	96.3	Very high	96.9	Very high	7 Å²	7	34.2 Å²	34.2	4%	0.037	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-86.4	0.1	178.7	-52.5	-49.4	0	0	0	111.7	K80 I103 D104 F105 G109 Y111	K80-D107 VanDerWaalsContact NZ-CG 3.34Å; K80-D107 IonicContact NZ-OD1 2.78Å; K80-D107 PolarHBondContact NZ-OD1 3.34Å; K80-D107 IonicContact NZ-OD2 3.56Å; K80-D107 PolarHBondContact NZ-OD2 2.93Å; I103-D107 HydrophobicContact CD1-CB 4.13Å; I103-D107 HydrophobicContact CG1-CB 3.54Å; D104-D107 PolarHBondContact N-OD2 3.27Å; D104-D107 WeakPolarHBondContact O-CB 3.39Å; D104-D107 PolarHBondContact O-N 2.87Å; F105-D107 PolarHBondContact O-N 2.76Å; D107-G109 PolarHBondContact O-N 3.33Å; D107-Y111 WeakPolarHBondContact O-CE2 3.45Å; D107-Y111 PolarHBondContact O-OH 2.78Å
108	T	97	Very high	96.6	Very high	24 Å²	24	39.1 Å²	39.1	15%	0.147	20%	0.2	C	C	.	.			trans	-63.9	130.6	171.4	-67.8	0	0	0	0	110.5	F105 V106 Y128 I129 L130 V131	F105-T108 WeakPolarHBondContact O-CB 3.5Å; F105-T108 PolarHBondContact O-N 2.98Å; F105-T108 PolarHBondContact O-OG1 3.49Å; V106-T108 VanDerWaalsContact C-N 3.27Å; T108-Y128 HydrophobicContact CG2-CE1 4.23Å; T108-I129 WeakPolarHBondContact CA-O 3.17Å; T108-I129 WeakPolarHBondContact CG2-O 3.27Å; T108-L130 HydrophobicContact CG2-CD1 3.91Å; T108-V131 WeakPolarHBondContact OG1-CB 3.46Å; T108-V131 PolarHBondContact OG1-N 2.83Å
109	G	97	Very high	96.2	Very high	2 Å²	2	44 Å²	44	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.1	-170.5	178.5	0	0	0	0	0	114.7	N58 D107 Y128 I129	N58-G109 WeakPolarHBondContact OD1-CA 3.41Å; D107-G109 PolarHBondContact O-N 3.33Å; G109-Y128 CarbonylContact O-C 3.55Å; G109-Y128 WeakPolarHBondContact O-CA 3.45Å; G109-I129 PolarHBondContact N-O 3.48Å; G109-I129 PolarHBondContact O-N 3.26Å
110	E	97.9	Very high	95.5	Very high	63 Å²	63	47.6 Å²	47.6	29%	0.294	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	112.7	176.8	-171.3	-166.2	-161.7	0	0	110.4	N58 K112 S126 A127 Y128	N58-E110 PolarHBondContact N-O 2.92Å; N58-E110 PolarHBondContact OD1-N 3.37Å; E110-K112 HydrophobicContact CG-CD 4.35Å; E110-K112 HydrophobicContact CG-CG 3.84Å; E110-K112 WeakPolarHBondContact OE2-CD 3.45Å; E110-K112 IonicContact OE2-NZ 2.65Å; E110-K112 PolarHBondContact OE2-NZ 3.13Å; E110-S126 WeakPolarHBondContact OE1-CB 3.12Å; E110-S126 PolarHBondContact OE1-OG 3.2Å; E110-A127 CarbonylContact C-O 3.45Å; E110-A127 WeakPolarHBondContact CA-O 3.37Å; E110-Y128 HydrophobicContact CB-CD2 4.36Å
111	Y	98.4	Very high	95	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	120.3	170.4	-75.2	-101.2	0	0	0	109.9	I40 Y56 L57 I62 F81 L98 V100 D107 S126 A127 I129	I40-Y111 HydrophobicContact CD1-CE1 4.36Å; I40-Y111 HydrophobicContact CD1-CE2 4.37Å; Y56-Y111 CarbonylContact O-C 3.55Å; Y56-Y111 VanDerWaalsContact O-CA 3.3Å; Y56-Y111 WeakPolarHBondContact O-CA 3.26Å; L57-Y111 HydrophobicContact CD1-CD2 3.93Å; L57-Y111 HydrophobicContact CD1-CE1 4.38Å; L57-Y111 HydrophobicContact CD1-CE2 3.62Å; L57-Y111 HydrophobicContact CD1-CG 4.47Å; I62-Y111 HydrophobicContact CD1-CD1 4.09Å; I62-Y111 HydrophobicContact CD1-CE1 4.04Å; F81-Y111 HydrophobicContact CE1-CE1 4.31Å; L98-Y111 HydrophobicContact CD2-CD1 3.52Å; L98-Y111 HydrophobicContact CD2-CE1 3.84Å; V100-Y111 HydrophobicContact CG2-CE1 4.01Å; D107-Y111 WeakPolarHBondContact O-CE2 3.45Å; D107-Y111 PolarHBondContact O-OH 2.78Å; Y111-S126 CarbonylContact O-C 3.57Å; Y111-S126 VanDerWaalsContact O-CA 3.3Å; Y111-S126 WeakPolarHBondContact O-CA 3.36Å; Y111-A127 PolarHBondContact N-O 3.27Å; Y111-A127 PolarHBondContact O-N 2.92Å; Y111-I129 HydrophobicContact CD2-CB 3.84Å; Y111-I129 HydrophobicContact CD2-CG1 3.34Å; Y111-I129 HydrophobicContact CE2-CB 3.77Å; Y111-I129 HydrophobicContact CE2-CG1 3.7Å; Y111-I129 HydrophobicContact CG-CG1 4.11Å
112	K	98.4	Very high	94.7	Very high	45 Å²	45	54.7 Å²	54.7	20%	0.196	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	134.3	-178.7	-55.9	-169.4	-86.8	-121.4	0	111.4	W55 Y56 N58 E110 T124 A125 S126	W55-K112 CarbonylContact C-O 3.49Å; W55-K112 WeakPolarHBondContact CA-O 3.27Å; Y56-K112 PolarHBondContact N-O 3.2Å; Y56-K112 PolarHBondContact O-N 3.23Å; N58-K112 WeakPolarHBondContact O-CE 3.2Å; N58-K112 PolarHBondContact O-NZ 2.77Å; E110-K112 HydrophobicContact CG-CD 4.35Å; E110-K112 HydrophobicContact CG-CG 3.84Å; E110-K112 WeakPolarHBondContact OE2-CD 3.45Å; E110-K112 IonicContact OE2-NZ 2.65Å; E110-K112 PolarHBondContact OE2-NZ 3.13Å; K112-T124 HydrophobicContact CB-CG2 4.38Å; K112-T124 HydrophobicContact CD-CG2 4.37Å; K112-A125 WeakPolarHBondContact CA-O 3.37Å; K112-S126 WeakPolarHBondContact CG-OG 3.43Å
113	C	97.9	Very high	94.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	125.2	163	171.2	0	0	0	0	108.9	C44 I53 E54 W55 T124 A125	C44-C113 HydrophobicContact CB-CB 3.61Å; C44-C113 WeakPolarHBondContact CB-SG 3.34Å; C44-C113 WeakPolarHBondContact SG-CB 3.31Å; C44-C113 CovalentContact SG-SG 2.01Å; C44-C113 PolarHBondContact SG-SG 2.97Å; I53-C113 WeakPolarHBondContact CG2-SG 3.43Å; E54-C113 CarbonylContact O-C 3.51Å; E54-C113 WeakPolarHBondContact O-CA 3.33Å; W55-C113 HydrophobicContact CD2-CB 4.39Å; W55-C113 HydrophobicContact CE3-CB 4.09Å; W55-C113 HydrophobicContact CH2-CB 3.91Å; W55-C113 HydrophobicContact CZ2-CB 4.23Å; W55-C113 HydrophobicContact CZ3-CB 3.84Å; C113-T124 WeakPolarHBondContact O-CA 3.23Å; C113-A125 PolarHBondContact N-O 3.05Å; C113-A125 PolarHBondContact O-N 2.93Å
114	K	97.3	Very high	94.4	Very high	70 Å²	70	55.3 Å²	55.3	30%	0.304	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	129.9	173.5	-173.3	-177.6	178.4	-174.8	0	109.9	I53 E54 Y56 I116 D123	I53-K114 CarbonylContact C-O 3.51Å; I53-K114 WeakPolarHBondContact CA-O 3.39Å; E54-K114 PolarHBondContact N-O 2.83Å; E54-K114 PolarHBondContact O-N 2.88Å; Y56-K114 HydrophobicContact CE2-CB 4.17Å; K114-I116 HydrophobicContact CD-CD1 4.35Å; K114-I116 HydrophobicContact CG-CD1 4.12Å; K114-D123 CarbonylContact C-O 3.58Å; K114-D123 WeakPolarHBondContact CA-O 3.49Å
115	T	96.1	Very high	94.5	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	147.9	175.3	71.3	0	0	0	0	110.3	F25 V46 I53 H117 S122 D123	F25-T115 HydrophobicContact CE1-CG2 3.85Å; F25-T115 HydrophobicContact CZ-CG2 4.19Å; V46-T115 HydrophobicContact CG1-CG2 3.61Å; V46-T115 HydrophobicContact CG2-CG2 4.12Å; I53-T115 HydrophobicContact CD1-CG2 4.21Å; I53-T115 HydrophobicContact CG1-CG2 3.88Å; T115-H117 PolarHBondContact OG1-NE2 3.07Å; T115-S122 WeakPolarHBondContact O-CA 3.17Å; T115-S122 WeakPolarHBondContact O-CB 3.22Å; T115-D123 PolarHBondContact N-O 3.23Å; T115-D123 WeakPolarHBondContact OG1-CB 3.33Å; T115-D123 PolarHBondContact OG1-N 3.4Å; T115-D123 VanDerWaalsContact OG1-N 3.1Å
116	I	95.2	Very high	94.6	Very high	27 Å²	27	51.1 Å²	51.1	14%	0.138	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	123.2	173.4	-62.9	77.1	0	0	0	108.3	P50 V51 F52 E54 K114	P50-I116 WeakPolarHBondContact CB-O 3.06Å; V51-I116 PolarHBondContact N-O 3.49Å; F52-I116 HydrophobicContact CD1-CB 4.29Å; F52-I116 HydrophobicContact CD2-CB 4.28Å; F52-I116 HydrophobicContact CD2-CD1 3.69Å; F52-I116 HydrophobicContact CD2-CG1 4.26Å; F52-I116 HydrophobicContact CE1-CB 3.85Å; F52-I116 HydrophobicContact CE1-CG1 4.33Å; F52-I116 HydrophobicContact CE1-CG2 3.81Å; F52-I116 HydrophobicContact CE2-CB 3.86Å; F52-I116 HydrophobicContact CE2-CD1 3.22Å; F52-I116 HydrophobicContact CE2-CG1 3.54Å; F52-I116 HydrophobicContact CG-CB 4.48Å; F52-I116 HydrophobicContact CZ-CB 3.61Å; F52-I116 HydrophobicContact CZ-CD1 3.84Å; F52-I116 HydrophobicContact CZ-CG1 3.57Å; F52-I116 HydrophobicContact CZ-CG2 3.77Å; F52-I116 PolarHBondContact O-N 2.79Å; E54-I116 HydrophobicContact CG-CD1 4.16Å; K114-I116 HydrophobicContact CD-CD1 4.35Å; K114-I116 HydrophobicContact CG-CD1 4.12Å
117	H	93	Very high	94.8	Very high	13 Å²	13	45.8 Å²	45.8	6%	0.06	25%	0.248	C	C	.	.			trans	-100.7	170.3	-179.6	-64.2	-90.3	0	0	0	111.5	T48 T115 D119 S120 E121	T48-H117 PolarHBondContact O-CE1 2.85Å; T48-H117 VanDerWaalsContact O-CE1 3.27Å; T115-H117 PolarHBondContact OG1-NE2 3.07Å; H117-D119 VanDerWaalsContact C-N 3.28Å; H117-D119 WeakPolarHBondContact CB-OD1 3.42Å; H117-D119 PolarHBondContact O-N 2.78Å; H117-S120 PolarHBondContact O-N 3.16Å; H117-E121 PolarHBondContact CD2-O 3.12Å; H117-E121 PolarHBondContact N-O 3Å
118	H	91.2	Very high	94.8	Very high	144 Å²	144	48.6 Å²	48.6	67%	0.667	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-30.7	-176.4	-83.2	-81.9	0	0	0	113.7	V51 Q68 S120	V51-H118 HydrophobicContact CG2-CB 4.46Å; Q68-H118 PolarHBondContact NE2-CE1 3.39Å; Q68-H118 PolarHBondContact NE2-NE2 2.01Å; H118-S120 PolarHBondContact O-N 3.49Å
119	D	90	Very high	94.8	Very high	102 Å²	102	47.4 Å²	47.4	55%	0.545	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	4.8	173.8	52.6	11.3	0	0	0	113	H117 E121	H117-D119 VanDerWaalsContact C-N 3.28Å; H117-D119 WeakPolarHBondContact CB-OD1 3.42Å; H117-D119 PolarHBondContact O-N 2.78Å; D119-E121 PolarHBondContact O-N 2.93Å; D119-E121 WeakPolarHBondContact OD1-CB 3.24Å; D119-E121 PolarHBondContact OD1-N 2.76Å
120	S	83.7	Confident	94.8	Very high	101 Å²	101	47.4 Å²	47.4	71%	0.706	25%	0.251	S	S	*	.	S	Bend	trans	67.1	10.4	-174.2	-47	0	0	0	0	114.8	H117 H118	H117-S120 PolarHBondContact O-N 3.16Å; H118-S120 PolarHBondContact O-N 3.49Å
121	E	88	Confident	94.8	Very high	132 Å²	132	44.4 Å²	44.4	62%	0.617	24%	0.237	S	C	*	.			trans	-66.6	146.4	167.7	-66.4	-169.6	172.7	0	0	110.1	H117 D119	H117-E121 PolarHBondContact CD2-O 3.12Å; H117-E121 PolarHBondContact N-O 3Å; D119-E121 PolarHBondContact O-N 2.93Å; D119-E121 WeakPolarHBondContact OD1-CB 3.24Å; D119-E121 PolarHBondContact OD1-N 2.76Å
122	S	91.2	Very high	94.6	Very high	60 Å²	60	44.9 Å²	44.9	42%	0.42	24%	0.24	S	C	.	.			trans	-139	129	178.7	69.7	0	0	0	0	111.4	T115	T115-S122 WeakPolarHBondContact O-CA 3.17Å; T115-S122 WeakPolarHBondContact O-CB 3.22Å
123	D	92.6	Very high	94.3	Very high	54 Å²	54	46.5 Å²	46.5	29%	0.289	25%	0.245	S	C	.	.			trans	-101	153.5	169.7	-67.4	-51.3	0	0	0	109.9	N24 F25 K114 T115	N24-D123 WeakPolarHBondContact CB-OD2 3.47Å; N24-D123 PolarHBondContact ND2-OD2 2.85Å; F25-D123 HydrophobicContact CE2-CB 3.62Å; F25-D123 HydrophobicContact CZ-CB 3.71Å; K114-D123 CarbonylContact C-O 3.58Å; K114-D123 WeakPolarHBondContact CA-O 3.49Å; T115-D123 PolarHBondContact N-O 3.23Å; T115-D123 WeakPolarHBondContact OG1-CB 3.33Å; T115-D123 PolarHBondContact OG1-N 3.4Å; T115-D123 VanDerWaalsContact OG1-N 3.1Å
124	T	96.1	Very high	94	Very high	73 Å²	73	49.5 Å²	49.5	45%	0.448	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	136.1	174.9	-60.3	0	0	0	0	111	K112 C113	K112-T124 HydrophobicContact CB-CG2 4.38Å; K112-T124 HydrophobicContact CD-CG2 4.37Å; C113-T124 WeakPolarHBondContact O-CA 3.23Å
125	A	97.5	Very high	93.9	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.008	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	137.5	169.9	0	0	0	0	0	110.4	F25 R28 K112 C113	F25-A125 HydrophobicContact CD1-CB 4.17Å; F25-A125 HydrophobicContact CD2-CB 3.95Å; F25-A125 HydrophobicContact CE1-CB 3.91Å; F25-A125 HydrophobicContact CE2-CB 3.66Å; F25-A125 HydrophobicContact CG-CB 4.2Å; F25-A125 HydrophobicContact CZ-CB 3.65Å; R28-A125 HydrophobicContact CB-CB 3.85Å; K112-A125 WeakPolarHBondContact CA-O 3.37Å; C113-A125 PolarHBondContact N-O 3.05Å; C113-A125 PolarHBondContact O-N 2.93Å
126	S	97.7	Very high	93.8	Very high	42 Å²	42	53.5 Å²	53.5	29%	0.294	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	153.2	-176.7	-49.9	0	0	0	0	112.2	E110 Y111 K112	E110-S126 WeakPolarHBondContact OE1-CB 3.12Å; E110-S126 PolarHBondContact OE1-OG 3.2Å; Y111-S126 CarbonylContact O-C 3.57Å; Y111-S126 VanDerWaalsContact O-CA 3.3Å; Y111-S126 WeakPolarHBondContact O-CA 3.36Å; K112-S126 WeakPolarHBondContact CG-OG 3.43Å
127	A	97.8	Very high	93.8	Very high	2 Å²	2	57.2 Å²	57.2	2%	0.017	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	149.1	160.8	0	0	0	0	0	110.4	P29 T30 N31 E110 Y111 I129	P29-A127 HydrophobicContact CB-CB 3.73Å; P29-A127 HydrophobicContact CG-CB 4.29Å; T30-A127 VanDerWaalsContact O-CB 3.3Å; T30-A127 WeakPolarHBondContact O-CB 3.44Å; N31-A127 WeakPolarHBondContact OD1-CA 3.41Å; E110-A127 CarbonylContact C-O 3.45Å; E110-A127 WeakPolarHBondContact CA-O 3.37Å; Y111-A127 PolarHBondContact N-O 3.27Å; Y111-A127 PolarHBondContact O-N 2.92Å; A127-I129 HydrophobicContact CB-CD1 4.42Å
128	Y	97.3	Very high	94	Very high	65 Å²	65	58 Å²	58	26%	0.255	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.5	171.9	-163.8	-97.7	0	0	0	109.3	N31 Q32 T108 G109 E110 Q219 A220 Y221	N31-Y128 PolarHBondContact OD1-N 3.46Å; Q32-Y128 PolarHBondContact N-O 3Å; T108-Y128 HydrophobicContact CG2-CE1 4.23Å; G109-Y128 CarbonylContact O-C 3.55Å; G109-Y128 WeakPolarHBondContact O-CA 3.45Å; E110-Y128 HydrophobicContact CB-CD2 4.36Å; Y128-Q219 PolarHBondContact OH-OE1 3.03Å; Y128-A220 HydrophobicContact CD1-CB 4.03Å; Y128-A220 HydrophobicContact CE1-CB 4.14Å; Y128-A220 HydrophobicContact CG-CB 4.46Å; Y128-Y221 HydrophobicContact CD1-CD2 4.24Å; Y128-Y221 AromaticContact CD1-CE2 3.72Å; Y128-Y221 HydrophobicContact CD1-CE2 3.72Å; Y128-Y221 HydrophobicContact CE1-CE2 4.45Å; Y128-Y221 PolarHBondContact O-OH 3.36Å
129	I	97.5	Very high	94.4	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	124.8	176.4	-49.7	-59.9	0	0	0	108.5	Q32 T34 I40 H42 I103 T108 G109 Y111 A127	Q32-I129 HydrophobicContact CB-CD1 3.73Å; Q32-I129 WeakPolarHBondContact O-CA 3.39Å; T34-I129 HydrophobicContact CG2-CG2 4.24Å; I40-I129 HydrophobicContact CD1-CG1 4.26Å; I40-I129 HydrophobicContact CD1-CG2 4.13Å; H42-I129 VanDerWaalsContact CE1-CD1 3.44Å; H42-I129 WeakPolarHBondContact CE1-CD1 3.35Å; H42-I129 WeakPolarHBondContact NE2-CD1 3.17Å; I103-I129 HydrophobicContact CD1-CG2 4.35Å; T108-I129 WeakPolarHBondContact CA-O 3.17Å; T108-I129 WeakPolarHBondContact CG2-O 3.27Å; G109-I129 PolarHBondContact N-O 3.48Å; G109-I129 PolarHBondContact O-N 3.26Å; Y111-I129 HydrophobicContact CD2-CB 3.84Å; Y111-I129 HydrophobicContact CD2-CG1 3.34Å; Y111-I129 HydrophobicContact CE2-CB 3.77Å; Y111-I129 HydrophobicContact CE2-CG1 3.7Å; Y111-I129 HydrophobicContact CG-CG1 4.11Å; A127-I129 HydrophobicContact CB-CD1 4.42Å
130	L	96.2	Very high	94.8	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	113.1	177.4	176.8	64.2	0	0	0	109.6	Q32 I33 T34 T108 S132 P165 M218 Y221	Q32-L130 PolarHBondContact O-N 2.85Å; I33-L130 CarbonylContact C-O 3.52Å; I33-L130 WeakPolarHBondContact CA-O 3.24Å; I33-L130 HydrophobicContact CG1-CB 4.39Å; I33-L130 HydrophobicContact CG1-CD2 4.43Å; I33-L130 HydrophobicContact CG2-CD2 4.42Å; T34-L130 PolarHBondContact N-O 3.16Å; T108-L130 HydrophobicContact CG2-CD1 3.91Å; L130-S132 PolarHBondContact O-N 3.08Å; L130-P165 HydrophobicContact CD1-CG 4.01Å; L130-M218 HydrophobicContact CD2-CB 3.74Å; L130-M218 HydrophobicContact CD2-SD 4.45Å; L130-Y221 HydrophobicContact CB-CD2 3.53Å; L130-Y221 HydrophobicContact CB-CE2 3.39Å; L130-Y221 HydrophobicContact CD2-CD2 3.63Å; L130-Y221 HydrophobicContact CD2-CE2 4.37Å; L130-Y221 HydrophobicContact CD2-CG 4.22Å; L130-Y221 HydrophobicContact CG-CD2 4.19Å; L130-Y221 HydrophobicContact CG-CE2 4.5Å
131	V	96.9	Very high	95.5	Very high	1 Å²	1	51 Å²	51	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	113	166.6	-172.5	0	0	0	0	107.4	T34 A36 I103 D104 F105 T108	T34-V131 HydrophobicContact CG2-CB 4.43Å; T34-V131 HydrophobicContact CG2-CG2 3.87Å; A36-V131 HydrophobicContact CB-CG1 4.33Å; I103-V131 HydrophobicContact CD1-CG2 3.62Å; I103-V131 HydrophobicContact CG1-CG2 3.73Å; I103-V131 HydrophobicContact CG2-CG2 4.18Å; D104-V131 WeakPolarHBondContact O-CG2 3.32Å; F105-V131 HydrophobicContact CD1-CG1 4.26Å; F105-V131 WeakPolarHBondContact CD1-O 3.25Å; F105-V131 HydrophobicContact CE1-CG1 4.49Å; T108-V131 WeakPolarHBondContact OG1-CB 3.46Å; T108-V131 PolarHBondContact OG1-N 2.83Å
132	S	94.4	Very high	95.9	Very high	9 Å²	9	44.8 Å²	44.8	6%	0.063	22%	0.224	C	C	.	.			trans	-124.5	153.6	-172.4	68.9	0	0	0	0	113.3	I33 T34 L130 K164	I33-S132 WeakPolarHBondContact CG2-OG 3.46Å; T34-S132 PolarHBondContact O-N 2.55Å; T34-S132 PolarHBondContact O-OG 2.81Å; L130-S132 PolarHBondContact O-N 3.08Å; S132-K164 CarbonylContact C-O 3.4Å; S132-K164 WeakPolarHBondContact CA-O 3.45Å; S132-K164 VanDerWaalsContact CB-O 3.24Å; S132-K164 WeakPolarHBondContact CB-O 3.32Å
133	Y	92.9	Very high	96.2	Very high	79 Å²	79	44.8 Å²	44.8	31%	0.31	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	129.7	158.3	-170.6	-98	0	0	0	108	R136 A162 G163 K164	Y133-R136 HydrophobicContact CE1-CG 4.2Å; Y133-R136 VanDerWaalsContact OH-CZ 3.23Å; Y133-R136 PolarHBondContact OH-NE 3.35Å; Y133-R136 PolarHBondContact OH-NH2 2.9Å; Y133-A162 HydrophobicContact CD1-CB 4.2Å; Y133-A162 HydrophobicContact CE1-CB 4.01Å; Y133-G163 VanDerWaalsContact O-CA 3.27Å; Y133-G163 WeakPolarHBondContact O-CA 3.3Å; Y133-K164 PolarHBondContact N-O 2.98Å; Y133-K164 PolarHBondContact O-N 2.96Å; Y133-K164 VanDerWaalsContact O-N 3.1Å
134	P	92.2	Very high	96.4	Very high	64 Å²	64	47.3 Å²	47.3	42%	0.416	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	159.2	-174.1	27.8	-35.4	0	0	0	113	R136 G163	P134-R136 PolarHBondContact O-N 3.43Å; P134-G163 PolarHBondContact O-N 2.84Å
135	I	94.4	Very high	96.3	Very high	23 Å²	23	47 Å²	47	12%	0.118	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	124	168.3	-56.8	-61.1	0	0	0	108.6	K137 L138 A160 A162 P167 V216 M218 N225	I135-K137 VanDerWaalsContact CG2-O 3.3Å; I135-K137 WeakPolarHBondContact CG2-O 3.38Å; I135-L138 HydrophobicContact CG2-CB 4.35Å; I135-A160 HydrophobicContact CD1-CB 4.49Å; I135-A160 HydrophobicContact CG2-CB 4.41Å; I135-A162 WeakPolarHBondContact CD1-O 3.23Å; I135-P167 HydrophobicContact CD1-CB 3.79Å; I135-P167 HydrophobicContact CD1-CG 3.77Å; I135-V216 HydrophobicContact CD1-CG1 4Å; I135-V216 HydrophobicContact CG1-CG1 4.05Å; I135-M218 HydrophobicContact CD1-CE 3.45Å; I135-M218 VanDerWaalsContact CD1-CE 3.45Å; I135-M218 HydrophobicContact CG1-CE 3.77Å; I135-N225 HydrophobicContact CG1-CB 4.43Å
136	R	94.2	Very high	96.2	Very high	131 Å²	131	53.8 Å²	53.8	49%	0.494	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-31.6	179.4	-72.9	-175.6	177.7	-179.5	1.2	112.4	Y133 P134 R161 A162 E190	Y133-R136 HydrophobicContact CE1-CG 4.2Å; Y133-R136 VanDerWaalsContact OH-CZ 3.23Å; Y133-R136 PolarHBondContact OH-NE 3.35Å; Y133-R136 PolarHBondContact OH-NH2 2.9Å; P134-R136 PolarHBondContact O-N 3.43Å; R136-R161 PolarHBondContact N-O 2.84Å; R136-A162 HydrophobicContact CB-CB 4.09Å; R136-A162 HydrophobicContact CG-CB 3.85Å; R136-E190 IonicContact NH1-OE2 3.86Å; R136-E190 PolarHBondContact NH1-OE2 3.25Å
137	K	95.4	Very high	96	Very high	104 Å²	104	53.9 Å²	53.9	45%	0.452	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	131.7	-176.1	-155.8	-172.9	-164.7	-151.2	0	110	I135 E139 A160 R161	I135-K137 VanDerWaalsContact CG2-O 3.3Å; I135-K137 WeakPolarHBondContact CG2-O 3.38Å; K137-E139 HydrophobicContact CD-CG 4.36Å; K137-E139 WeakPolarHBondContact CE-OE1 3.11Å; K137-E139 VanDerWaalsContact CE-OE2 3.31Å; K137-E139 WeakPolarHBondContact CE-OE2 3.39Å; K137-E139 HydrophobicContact CG-CG 4.22Å; K137-E139 IonicContact NZ-OE1 3.15Å; K137-E139 PolarHBondContact NZ-OE1 3.15Å; K137-E139 IonicContact NZ-OE2 2.71Å; K137-E139 PolarHBondContact NZ-OE2 2.95Å; K137-A160 WeakPolarHBondContact O-CA 3.39Å; K137-R161 HydrophobicContact CB-CB 4.12Å; K137-R161 PolarHBondContact O-N 2.89Å
138	L	97.8	Very high	96	Very high	29 Å²	29	53.8 Å²	53.8	15%	0.152	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	115.4	173.1	179.5	59.8	0	0	0	108.5	I135 C158 Q159 A160 V216 N225 Q226 T227	I135-L138 HydrophobicContact CG2-CB 4.35Å; L138-C158 VanDerWaalsContact CD1-SG 3.6Å; L138-Q159 WeakPolarHBondContact CA-O 3.2Å; L138-A160 HydrophobicContact CD1-CB 3.97Å; L138-V216 HydrophobicContact CD1-CG2 3.61Å; L138-V216 HydrophobicContact CD2-CG2 3.92Å; L138-V216 HydrophobicContact CG-CG2 4.4Å; L138-N225 HydrophobicContact CD2-CB 4.1Å; L138-Q226 VanDerWaalsContact CD2-C 3.47Å; L138-T227 HydrophobicContact CD1-CG2 4.41Å; L138-T227 HydrophobicContact CD2-CG2 3.99Å; L138-T227 HydrophobicContact CG-CG2 3.79Å
139	E	97.9	Very high	96	Very high	91 Å²	91	51.4 Å²	51.4	43%	0.425	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	137.8	-178.4	-71.5	179.9	147.7	0	0	110.2	K137 C158 Q159	K137-E139 HydrophobicContact CD-CG 4.36Å; K137-E139 WeakPolarHBondContact CE-OE1 3.11Å; K137-E139 VanDerWaalsContact CE-OE2 3.31Å; K137-E139 WeakPolarHBondContact CE-OE2 3.39Å; K137-E139 HydrophobicContact CG-CG 4.22Å; K137-E139 IonicContact NZ-OE1 3.15Å; K137-E139 PolarHBondContact NZ-OE1 3.15Å; K137-E139 IonicContact NZ-OE2 2.71Å; K137-E139 PolarHBondContact NZ-OE2 2.95Å; E139-C158 CarbonylContact O-C 3.52Å; E139-C158 WeakPolarHBondContact O-CA 3.4Å; E139-C158 PolarHBondContact O-SG 2.79Å; E139-C158 VanDerWaalsContact O-SG 3.39Å; E139-Q159 PolarHBondContact N-O 2.83Å; E139-Q159 PolarHBondContact O-N 2.77Å
140	L	98.6	Very high	95.9	Very high	15 Å²	15	53.6 Å²	53.6	8%	0.079	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.9	172.6	174.5	65.5	0	0	0	107.6	I156 E157 C158 L171 L212 C214 T227 K229	L140-I156 HydrophobicContact CD1-CG2 3.91Å; L140-E157 CarbonylContact C-O 3.52Å; L140-E157 WeakPolarHBondContact CA-O 3.39Å; L140-C158 HydrophobicContact CD1-CB 3.96Å; L140-L171 HydrophobicContact CD1-CD2 4.1Å; L140-L212 HydrophobicContact CD1-CD2 4.05Å; L140-L212 HydrophobicContact CD1-CG 4.44Å; L140-L212 HydrophobicContact CD2-CD2 4.14Å; L140-L212 HydrophobicContact CD2-CG 4.13Å; L140-L212 HydrophobicContact CG-CD2 4.39Å; L140-C214 HydrophobicContact CD1-CB 4.32Å; L140-T227 HydrophobicContact CB-CG2 3.6Å; L140-T227 HydrophobicContact CD2-CG2 4.45Å; L140-K229 HydrophobicContact CD2-CB 4.11Å; L140-K229 HydrophobicContact CD2-CD 4.27Å; L140-K229 HydrophobicContact CD2-CG 4.09Å; L140-K229 HydrophobicContact CG-CD 4.14Å; L140-K229 HydrophobicContact CG-CG 4.47Å; L140-K229 WeakPolarHBondContact O-CE 3.38Å
141	H	98.3	Very high	95.9	Very high	96 Å²	96	55.4 Å²	55.4	44%	0.444	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	142.9	179.2	-174	66.7	0	0	0	110.3	D143 I156 E157	H141-D143 IonicContact CD2-OD1 2.68Å; H141-D143 PolarHBondContact CD2-OD1 2.75Å; H141-D143 IonicContact NE2-OD1 2.7Å; H141-D143 PolarHBondContact NE2-OD1 2.92Å; H141-I156 WeakPolarHBondContact O-CA 3.3Å; H141-E157 PolarHBondContact N-O 2.91Å; H141-E157 PolarHBondContact O-N 3.08Å
142	I	98	Very high	95.8	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	123	172.8	-51.9	175.1	0	0	0	106.7	N144 E145 L148 T154 I156 L212 K229 I231	I142-N144 PolarHBondContact O-N 2.74Å; I142-E145 HydrophobicContact CB-CB 4.13Å; I142-E145 HydrophobicContact CB-CG 4.33Å; I142-E145 HydrophobicContact CD1-CG 4.41Å; I142-E145 PolarHBondContact O-N 2.94Å; I142-L148 HydrophobicContact CG2-CD1 4.22Å; I142-L148 HydrophobicContact CG2-CD2 4.08Å; I142-T154 HydrophobicContact CG2-CG2 4.34Å; I142-T154 WeakPolarHBondContact CG2-OG1 3.14Å; I142-I156 HydrophobicContact CG1-CG1 4.41Å; I142-I156 HydrophobicContact CG2-CG1 4.38Å; I142-L212 HydrophobicContact CD1-CD2 3.58Å; I142-L212 HydrophobicContact CG1-CD2 3.66Å; I142-K229 HydrophobicContact CD1-CB 3.79Å; I142-K229 HydrophobicContact CD1-CD 3.75Å; I142-K229 HydrophobicContact CD1-CG 4.41Å; I142-K229 HydrophobicContact CG1-CD 3.84Å; I142-I231 HydrophobicContact CD1-CD1 3.78Å
143	D	97.2	Very high	95.9	Very high	60 Å²	60	65 Å²	65	32%	0.321	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	131.4	175.9	-83.1	18.2	0	0	0	110.2	H141 E145 T154 Y155	H141-D143 IonicContact CD2-OD1 2.68Å; H141-D143 PolarHBondContact CD2-OD1 2.75Å; H141-D143 IonicContact NE2-OD1 2.7Å; H141-D143 PolarHBondContact NE2-OD1 2.92Å; D143-E145 PolarHBondContact O-N 3Å; D143-T154 PolarHBondContact O-OG1 2.78Å; D143-Y155 PolarHBondContact N-O 2.87Å; D143-Y155 WeakPolarHBondContact OD2-CB 3.39Å
144	N	95.3	Very high	96.1	Very high	106 Å²	106	61.3 Å²	61.3	57%	0.567	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	33.2	179.5	-59.4	-45.5	0	0	0	113.8	I142 T146 S147 L148	I142-N144 PolarHBondContact O-N 2.74Å; N144-T146 PolarHBondContact O-N 3.46Å; N144-S147 PolarHBondContact O-N 2.93Å; N144-S147 PolarHBondContact O-OG 3.29Å; N144-S147 VanDerWaalsContact O-OG 3.12Å; N144-L148 PolarHBondContact O-N 2.83Å
145	E	95.4	Very high	96.3	Very high	68 Å²	68	61.4 Å²	61.4	32%	0.318	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-44.6	-37.8	-175.6	-174.2	175.5	-175.3	0	0	115.2	I142 D143 S147 L148 K229	I142-E145 HydrophobicContact CB-CB 4.13Å; I142-E145 HydrophobicContact CB-CG 4.33Å; I142-E145 HydrophobicContact CD1-CG 4.41Å; I142-E145 PolarHBondContact O-N 2.94Å; D143-E145 PolarHBondContact O-N 3Å; E145-S147 VanDerWaalsContact C-N 3.28Å; E145-S147 PolarHBondContact O-N 2.98Å; E145-L148 WeakPolarHBondContact O-CG 3.47Å; E145-K229 VanDerWaalsContact OE1-CD 3.29Å; E145-K229 WeakPolarHBondContact OE1-CD 3.28Å; E145-K229 IonicContact OE1-NZ 2.78Å; E145-K229 PolarHBondContact OE1-NZ 3.32Å; E145-K229 IonicContact OE2-NZ 2.69Å; E145-K229 PolarHBondContact OE2-NZ 3.34Å
146	T	94	Very high	96.5	Very high	142 Å²	142	60.3 Å²	60.3	87%	0.871	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-80.8	-5.2	-177.3	56	0	0	0	0	114.2	N144	N144-T146 PolarHBondContact O-N 3.46Å
147	S	95.4	Very high	96.7	Very high	44 Å²	44	56.2 Å²	56.2	31%	0.308	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-134.8	18.2	-170.9	65.6	0	0	0	0	114	N144 E145 S149 K234	N144-S147 PolarHBondContact O-N 2.93Å; N144-S147 PolarHBondContact O-OG 3.29Å; N144-S147 VanDerWaalsContact O-OG 3.12Å; E145-S147 VanDerWaalsContact C-N 3.28Å; E145-S147 PolarHBondContact O-N 2.98Å; S147-S149 PolarHBondContact O-OG 3.13Å; S147-S149 VanDerWaalsContact O-OG 3.09Å; S147-K234 PolarHBondContact O-NZ 3.42Å
148	L	97.4	Very high	96.9	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	27%	0.266	C	S	.	.			trans	-57.1	138.1	-179.9	-56.7	177	0	0	0	111.3	I142 N144 E145 T154 L203 I231 H232 L233 K234	I142-L148 HydrophobicContact CG2-CD1 4.22Å; I142-L148 HydrophobicContact CG2-CD2 4.08Å; N144-L148 PolarHBondContact O-N 2.83Å; E145-L148 WeakPolarHBondContact O-CG 3.47Å; L148-T154 HydrophobicContact CD2-CG2 4.42Å; L148-L203 HydrophobicContact CB-CD1 3.81Å; L148-L203 HydrophobicContact CD1-CD1 4.35Å; L148-L203 HydrophobicContact CD2-CD1 4.02Å; L148-L203 HydrophobicContact CG-CD1 4.26Å; L148-I231 HydrophobicContact CD1-CD1 4.14Å; L148-I231 HydrophobicContact CD1-CG2 4.32Å; L148-H232 WeakPolarHBondContact CB-O 3.31Å; L148-L233 HydrophobicContact CB-CD2 3.88Å; L148-L233 WeakPolarHBondContact O-CA 3.31Å; L148-K234 PolarHBondContact O-N 2.83Å
149	S	96.9	Very high	96.8	Very high	15 Å²	15	53.3 Å²	53.3	11%	0.105	28%	0.275	C	S	.	.			trans	-134.6	156.2	-176.7	-43.3	0	0	0	0	111.4	S147 Q152 K234 D235	S147-S149 PolarHBondContact O-OG 3.13Å; S147-S149 VanDerWaalsContact O-OG 3.09Å; S149-Q152 WeakPolarHBondContact O-CB 3.44Å; S149-Q152 PolarHBondContact O-N 2.95Å; S149-K234 WeakPolarHBondContact OG-CD 3.43Å; S149-K234 WeakPolarHBondContact OG-CE 3.5Å; S149-K234 PolarHBondContact OG-NZ 3.38Å; S149-D235 WeakPolarHBondContact CA-OD1 3.26Å
150	V	96.2	Very high	96.8	Very high	46 Å²	46	49 Å²	49	28%	0.279	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	136.1	176.1	179.1	0	0	0	0	109.6	Q152 N205 L233 D235	V150-Q152 PolarHBondContact O-N 3.3Å; V150-N205 WeakPolarHBondContact CG2-OD1 3.39Å; V150-L233 HydrophobicContact CG2-CB 4.43Å; V150-L233 HydrophobicContact CG2-CD1 3.75Å; V150-D235 WeakPolarHBondContact CG2-OD1 3.47Å; V150-D235 VanDerWaalsContact N-CG 3.32Å; V150-D235 PolarHBondContact N-OD1 3.37Å; V150-D235 PolarHBondContact N-OD2 3.25Å
151	G	95.3	Very high	96.6	Very high	38 Å²	38	51.2 Å²	51.2	39%	0.392	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.4	-13.6	-178	0	0	0	0	0	115.1	L203	G151-L203 VanDerWaalsContact CA-O 3.31Å; G151-L203 WeakPolarHBondContact CA-O 3.43Å; G151-L203 PolarHBondContact N-O 2.96Å
152	Q	94.9	Very high	96.4	Very high	49 Å²	49	46.7 Å²	46.7	23%	0.229	24%	0.241	C	C	.	.			trans	-64.3	140.1	175.5	-177.1	-178	-20.5	0	0	110.9	S149 V150 L203	S149-Q152 WeakPolarHBondContact O-CB 3.44Å; S149-Q152 PolarHBondContact O-N 2.95Å; V150-Q152 PolarHBondContact O-N 3.3Å; Q152-L203 PolarHBondContact O-N 2.78Å
153	R	96.4	Very high	96	Very high	164 Å²	164	47 Å²	47	62%	0.619	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	124.4	163.6	-71.3	-175.1	175.9	-82.4	3.3	109.4	N200 I201 K202	R153-N200 PolarHBondContact NH1-O 2.74Å; R153-I201 CarbonylContact C-O 3.53Å; R153-I201 VanDerWaalsContact CA-O 3.26Å; R153-I201 WeakPolarHBondContact CA-O 3.45Å; R153-K202 HydrophobicContact CG-CB 4.19Å; R153-K202 HydrophobicContact CG-CG 4.44Å
154	T	96.2	Very high	95.6	Very high	1 Å²	1	49 Å²	49	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	138.8	177.4	-177.6	0	0	0	0	110.3	I142 D143 L148 N200 I201 L203	I142-T154 HydrophobicContact CG2-CG2 4.34Å; I142-T154 WeakPolarHBondContact CG2-OG1 3.14Å; D143-T154 PolarHBondContact O-OG1 2.78Å; L148-T154 HydrophobicContact CD2-CG2 4.42Å; T154-N200 CarbonylContact O-C 3.58Å; T154-N200 WeakPolarHBondContact O-CA 3.33Å; T154-I201 HydrophobicContact CG2-CD1 4.04Å; T154-I201 HydrophobicContact CG2-CG1 3.52Å; T154-I201 PolarHBondContact N-O 3.25Å; T154-I201 PolarHBondContact O-N 3.35Å; T154-L203 HydrophobicContact CG2-CD1 3.9Å; T154-L203 HydrophobicContact CG2-CD2 4.06Å; T154-L203 HydrophobicContact CG2-CG 3.98Å
155	Y	97.8	Very high	95.4	Very high	65 Å²	65	45.2 Å²	45.2	26%	0.255	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	132	172.9	176.9	-101.4	0	0	0	109.1	D143 E157 T198 A199	D143-Y155 PolarHBondContact N-O 2.87Å; D143-Y155 WeakPolarHBondContact OD2-CB 3.39Å; Y155-E157 HydrophobicContact CD1-CB 4.49Å; Y155-E157 HydrophobicContact CE1-CB 3.7Å; Y155-E157 HydrophobicContact CE1-CG 4.49Å; Y155-E157 PolarHBondContact OH-OE2 3.27Å; Y155-T198 HydrophobicContact CE2-CG2 4.2Å; Y155-T198 WeakPolarHBondContact OH-CG2 3.26Å; Y155-A199 WeakPolarHBondContact CA-O 3.49Å
156	I	98.3	Very high	95.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.5	177.7	-69.1	164.3	0	0	0	107.4	L140 H141 I142 L171 T198 A199 I201 L212	L140-I156 HydrophobicContact CD1-CG2 3.91Å; H141-I156 WeakPolarHBondContact O-CA 3.3Å; I142-I156 HydrophobicContact CG1-CG1 4.41Å; I142-I156 HydrophobicContact CG2-CG1 4.38Å; I156-L171 HydrophobicContact CG2-CD1 4Å; I156-L171 HydrophobicContact CG2-CD2 4.24Å; I156-T198 CarbonylContact O-C 3.56Å; I156-T198 WeakPolarHBondContact O-CA 3.09Å; I156-A199 HydrophobicContact CB-CB 4.49Å; I156-A199 PolarHBondContact N-O 3.45Å; I156-A199 PolarHBondContact O-N 2.78Å; I156-I201 HydrophobicContact CD1-CD1 3.36Å; I156-I201 HydrophobicContact CD1-CG1 3.66Å; I156-I201 HydrophobicContact CD1-CG2 4.23Å; I156-L212 HydrophobicContact CB-CD2 4.46Å; I156-L212 HydrophobicContact CD1-CD1 3.82Å; I156-L212 HydrophobicContact CD1-CD2 3.59Å; I156-L212 HydrophobicContact CD1-CG 4.36Å; I156-L212 HydrophobicContact CG1-CD2 3.86Å; I156-L212 HydrophobicContact CG2-CD1 4.4Å; I156-L212 HydrophobicContact CG2-CD2 3.76Å
157	E	98.2	Very high	95.1	Very high	45 Å²	45	36.4 Å²	36.4	21%	0.21	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	128.9	175.4	-177	171.8	103.4	0	0	110.4	L140 H141 Y155 Q159 T196 A197 T198	L140-E157 CarbonylContact C-O 3.52Å; L140-E157 WeakPolarHBondContact CA-O 3.39Å; H141-E157 PolarHBondContact N-O 2.91Å; H141-E157 PolarHBondContact O-N 3.08Å; Y155-E157 HydrophobicContact CD1-CB 4.49Å; Y155-E157 HydrophobicContact CE1-CB 3.7Å; Y155-E157 HydrophobicContact CE1-CG 4.49Å; Y155-E157 PolarHBondContact OH-OE2 3.27Å; E157-Q159 HydrophobicContact CG-CG 4.07Å; E157-Q159 PolarHBondContact OE1-NE2 2.85Å; E157-T196 HydrophobicContact CG-CG2 3.81Å; E157-A197 CarbonylContact C-O 3.56Å; E157-A197 WeakPolarHBondContact CA-O 3.43Å; E157-T198 HydrophobicContact CB-CG2 4.45Å; E157-T198 HydrophobicContact CG-CG2 4.11Å
158	C	98.5	Very high	95.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128.9	167.3	-175.7	0	0	0	0	110.2	L138 E139 L140 I169 L171 T196 A197 C214	L138-C158 VanDerWaalsContact CD1-SG 3.6Å; E139-C158 CarbonylContact O-C 3.52Å; E139-C158 WeakPolarHBondContact O-CA 3.4Å; E139-C158 PolarHBondContact O-SG 2.79Å; E139-C158 VanDerWaalsContact O-SG 3.39Å; L140-C158 HydrophobicContact CD1-CB 3.96Å; C158-I169 HydrophobicContact CB-CG2 4.31Å; C158-L171 HydrophobicContact CB-CD2 3.78Å; C158-T196 CarbonylContact O-C 3.55Å; C158-T196 VanDerWaalsContact O-CA 3.29Å; C158-T196 WeakPolarHBondContact O-CA 3.37Å; C158-A197 PolarHBondContact N-O 2.73Å; C158-A197 PolarHBondContact O-N 2.86Å; C158-C214 HydrophobicContact CB-CB 3.71Å; C158-C214 WeakPolarHBondContact CB-SG 2.97Å; C158-C214 WeakPolarHBondContact SG-CB 3.06Å; C158-C214 CovalentContact SG-SG 2.01Å; C158-C214 PolarHBondContact SG-SG 3.49Å
159	Q	97.1	Very high	95	Very high	72 Å²	72	39.3 Å²	39.3	34%	0.336	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.6	177.7	-59.9	-167.4	22.4	0	0	110.6	L138 E139 E157 S195 T196	L138-Q159 WeakPolarHBondContact CA-O 3.2Å; E139-Q159 PolarHBondContact N-O 2.83Å; E139-Q159 PolarHBondContact O-N 2.77Å; E157-Q159 HydrophobicContact CG-CG 4.07Å; E157-Q159 PolarHBondContact OE1-NE2 2.85Å; Q159-S195 WeakPolarHBondContact CA-O 3.45Å; Q159-T196 HydrophobicContact CG-CG2 3.93Å
160	A	97.1	Very high	95	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	110	169.1	0	0	0	0	0	108.6	I135 K137 L138 P167 I169 T194 S195 V216	I135-A160 HydrophobicContact CD1-CB 4.49Å; I135-A160 HydrophobicContact CG2-CB 4.41Å; K137-A160 WeakPolarHBondContact O-CA 3.39Å; L138-A160 HydrophobicContact CD1-CB 3.97Å; A160-P167 HydrophobicContact CB-CB 4.42Å; A160-P167 HydrophobicContact CB-CG 4.27Å; A160-I169 HydrophobicContact CB-CD1 3.75Å; A160-I169 HydrophobicContact CB-CG1 4.19Å; A160-T194 WeakPolarHBondContact O-CA 3.49Å; A160-S195 PolarHBondContact N-O 3.08Å; A160-S195 PolarHBondContact O-N 3Å; A160-V216 HydrophobicContact CB-CG2 3.86Å
161	R	95	Very high	95.1	Very high	62 Å²	62	40.1 Å²	40.1	23%	0.234	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	140.3	178.6	-178.6	171.9	-176.1	-99	-5.4	111.3	R136 K137 D188 E190 T194	R136-R161 PolarHBondContact N-O 2.84Å; K137-R161 HydrophobicContact CB-CB 4.12Å; K137-R161 PolarHBondContact O-N 2.89Å; R161-D188 IonicContact CZ-OD2 2.71Å; R161-D188 IonicContact NE-OD2 3.37Å; R161-D188 PolarHBondContact NE-OD2 2.98Å; R161-D188 IonicContact NH2-OD1 2.65Å; R161-D188 IonicContact NH2-OD2 3.2Å; R161-D188 PolarHBondContact NH2-OD2 3.21Å; R161-E190 IonicContact CZ-OE2 3.24Å; R161-E190 IonicContact NH1-OE2 3.13Å; R161-E190 IonicContact NH2-OE1 3.85Å; R161-E190 IonicContact NH2-OE2 3.34Å; R161-E190 PolarHBondContact NH2-OE2 2.85Å; R161-T194 HydrophobicContact CB-CG2 4.38Å
162	A	93.4	Very high	95.3	Very high	1 Å²	1	39 Å²	39	1%	0.008	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	65.7	-162.1	-171.4	0	0	0	0	0	111.4	Y133 I135 R136 P167 L192 I193	Y133-A162 HydrophobicContact CD1-CB 4.2Å; Y133-A162 HydrophobicContact CE1-CB 4.01Å; I135-A162 WeakPolarHBondContact CD1-O 3.23Å; R136-A162 HydrophobicContact CB-CB 4.09Å; R136-A162 HydrophobicContact CG-CB 3.85Å; A162-P167 VanDerWaalsContact O-CG 3.32Å; A162-P167 WeakPolarHBondContact O-CG 3.3Å; A162-L192 HydrophobicContact CB-CB 4.46Å; A162-L192 HydrophobicContact CB-CD1 4.08Å; A162-L192 HydrophobicContact CB-CD2 4.43Å; A162-I193 CarbonylContact C-O 3.52Å; A162-I193 VanDerWaalsContact CA-O 3.24Å; A162-I193 WeakPolarHBondContact CA-O 3.44Å; A162-I193 PolarHBondContact N-O 2.76Å
163	G	90.4	Very high	95.4	Very high	7 Å²	7	37.3 Å²	37.3	7%	0.072	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	99.7	122	-168.6	0	0	0	0	0	111.5	Y133 P134 P165	Y133-G163 VanDerWaalsContact O-CA 3.27Å; Y133-G163 WeakPolarHBondContact O-CA 3.3Å; P134-G163 PolarHBondContact O-N 2.84Å; G163-P165 CarbonylContact C-O 3.58Å; G163-P165 VanDerWaalsContact C-O 3.31Å
164	K	89.4	Confident	95.4	Very high	103 Å²	103	31.4 Å²	31.4	45%	0.448	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	126.8	164.5	-175.4	171.6	171.9	-169.6	0	106.7	F105 S132 Y133	F105-K164 HydrophobicContact CD1-CD 3.76Å; F105-K164 HydrophobicContact CD1-CG 4.01Å; F105-K164 HydrophobicContact CD2-CD 4.31Å; F105-K164 HydrophobicContact CE1-CB 4.04Å; F105-K164 HydrophobicContact CE1-CD 3.53Å; F105-K164 HydrophobicContact CE1-CG 3.77Å; F105-K164 HydrophobicContact CE2-CD 4.09Å; F105-K164 HydrophobicContact CG-CD 4.16Å; F105-K164 HydrophobicContact CZ-CD 3.7Å; F105-K164 HydrophobicContact CZ-CG 4.38Å; S132-K164 CarbonylContact C-O 3.4Å; S132-K164 WeakPolarHBondContact CA-O 3.45Å; S132-K164 VanDerWaalsContact CB-O 3.24Å; S132-K164 WeakPolarHBondContact CB-O 3.32Å; Y133-K164 PolarHBondContact N-O 2.98Å; Y133-K164 PolarHBondContact O-N 2.96Å; Y133-K164 VanDerWaalsContact O-N 3.1Å
165	P	90.1	Very high	95.4	Very high	27 Å²	27	34 Å²	34	18%	0.175	19%	0.185	C	C	.	.	S	Bend	cis	-60.6	167.3	-4.6	31.4	-38.7	0	0	0	112.4	L130 G163 M218 Q219	L130-P165 HydrophobicContact CD1-CG 4.01Å; G163-P165 CarbonylContact C-O 3.58Å; G163-P165 VanDerWaalsContact C-O 3.31Å; P165-M218 HydrophobicContact CG-CB 3.96Å; P165-M218 HydrophobicContact CG-CG 4.33Å; P165-Q219 HydrophobicContact CB-CG 4.04Å; P165-Q219 HydrophobicContact CG-CB 4.41Å; P165-Q219 HydrophobicContact CG-CG 3.64Å
166	A	90.4	Very high	95.3	Very high	25 Å²	25	37.1 Å²	37.1	21%	0.207	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-54.1	124.7	-178.1	0	0	0	0	0	110.9	I193	A166-I193 HydrophobicContact CB-CD1 3.74Å; A166-I193 HydrophobicContact CB-CG2 4.15Å
167	P	93.3	Very high	95.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-66	138.6	-177.3	19.9	-26.8	0	0	0	112.1	I135 A160 A162 Q185 S195 V216 D217	I135-P167 HydrophobicContact CD1-CB 3.79Å; I135-P167 HydrophobicContact CD1-CG 3.77Å; A160-P167 HydrophobicContact CB-CB 4.42Å; A160-P167 HydrophobicContact CB-CG 4.27Å; A162-P167 VanDerWaalsContact O-CG 3.32Å; A162-P167 WeakPolarHBondContact O-CG 3.3Å; P167-Q185 PolarHBondContact O-NE2 2.84Å; P167-Q185 VanDerWaalsContact O-NE2 3.15Å; P167-S195 WeakPolarHBondContact O-CB 3.1Å; P167-S195 PolarHBondContact O-OG 2.79Å; P167-V216 HydrophobicContact CB-CG1 3.44Å; P167-V216 VanDerWaalsContact CB-CG1 3.44Å; P167-D217 WeakPolarHBondContact CA-O 3.45Å
168	Q	94.2	Very high	95.2	Very high	96 Å²	96	40.7 Å²	40.7	45%	0.449	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	131.6	168.7	-59.4	-56.3	-51.1	0	0	108.7	Q185 V216 D217	Q168-Q185 VanDerWaalsContact NE2-NE2 3.11Å; Q168-V216 WeakPolarHBondContact O-CA 3.22Å; Q168-D217 HydrophobicContact CB-CB 4.4Å; Q168-D217 PolarHBondContact N-O 3.15Å; Q168-D217 PolarHBondContact O-N 3.42Å
169	I	96.7	Very high	94.8	Very high	10 Å²	10	46.7 Å²	46.7	5%	0.051	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.8	-176.9	-60.1	179.4	0	0	0	109.9	C158 A160 S195 A197 C214 H215	C158-I169 HydrophobicContact CB-CG2 4.31Å; A160-I169 HydrophobicContact CB-CD1 3.75Å; A160-I169 HydrophobicContact CB-CG1 4.19Å; I169-S195 VanDerWaalsContact CD1-C 3.45Å; I169-S195 WeakPolarHBondContact CD1-O 3.12Å; I169-A197 HydrophobicContact CB-CB 3.85Å; I169-A197 HydrophobicContact CG2-CB 3.37Å; I169-C214 WeakPolarHBondContact CG2-SG 3.29Å; I169-H215 WeakPolarHBondContact CA-O 3.33Å
170	R	96.4	Very high	94.5	Very high	72 Å²	72	47.6 Å²	47.6	27%	0.272	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	126	170.2	-65.7	-177.6	-69.9	96.3	4.1	110.1	C214 H215 D217 N223	R170-C214 WeakPolarHBondContact O-CA 3.34Å; R170-H215 HydrophobicContact CB-CB 4.39Å; R170-H215 PolarHBondContact N-O 2.65Å; R170-H215 VanDerWaalsContact NH2-CB 3.35Å; R170-H215 PolarHBondContact O-N 2.96Å; R170-D217 IonicContact CZ-OD1 3.66Å; R170-D217 IonicContact CZ-OD2 3.91Å; R170-D217 IonicContact NE-OD1 2.76Å; R170-D217 IonicContact NE-OD2 2.93Å; R170-D217 PolarHBondContact NE-OD2 3.47Å; R170-D217 IonicContact NH2-OD1 3Å; R170-D217 PolarHBondContact NH2-OD1 3.47Å; R170-D217 IonicContact NH2-OD2 4Å; R170-D217 PolarHBondContact NH2-OD2 3.47Å; R170-D217 VanDerWaalsContact NH2-OD2 3.15Å; R170-N223 PolarHBondContact NH2-OD1 2.86Å
171	L	98.4	Very high	94.5	Very high	5 Å²	5	49 Å²	49	3%	0.026	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	127.6	169.2	-68.2	173.4	0	0	0	109.3	L140 I156 C158 I178 A181 A197 A199 T213 C214	L140-L171 HydrophobicContact CD1-CD2 4.1Å; I156-L171 HydrophobicContact CG2-CD1 4Å; I156-L171 HydrophobicContact CG2-CD2 4.24Å; C158-L171 HydrophobicContact CB-CD2 3.78Å; L171-I178 HydrophobicContact CB-CB 4.37Å; L171-I178 HydrophobicContact CB-CD1 3.96Å; L171-I178 HydrophobicContact CB-CG1 4.35Å; L171-I178 PolarHBondContact O-N 2.01Å; L171-A181 HydrophobicContact CB-CB 4.45Å; L171-A181 HydrophobicContact CD1-CB 4.23Å; L171-A197 HydrophobicContact CD1-CB 3.94Å; L171-A197 HydrophobicContact CG-CB 3.99Å; L171-A199 HydrophobicContact CD1-CB 4.1Å; L171-T213 WeakPolarHBondContact CA-O 3.31Å; L171-C214 HydrophobicContact CD2-CB 3.96Å
172	N	98.1	Very high	94.6	Very high	16 Å²	16	55.1 Å²	55.1	9%	0.086	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	147	172.3	-58.6	-9.6	0	0	0	110.2	L176 P177 L212 T213	N172-L176 CarbonylContact C-O 3.57Å; N172-L176 WeakPolarHBondContact CA-O 3.22Å; N172-L176 WeakPolarHBondContact CB-O 3.09Å; N172-P177 WeakPolarHBondContact OD1-CA 3.43Å; N172-L212 CarbonylContact O-C 3.53Å; N172-L212 WeakPolarHBondContact O-CA 3.34Å; N172-T213 WeakPolarHBondContact CB-OG1 3.3Å; N172-T213 PolarHBondContact N-O 2.95Å; N172-T213 PolarHBondContact O-N 2.75Å
173	L	97.7	Very high	94.8	Very high	13 Å²	13	58.1 Å²	58.1	7%	0.068	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	122.6	172.6	178.8	58.8	0	0	0	108.9	G175 L176 I178 I201 H207 Q210 L211 L212 I231	L173-G175 PolarHBondContact O-N 2.91Å; L173-L176 PolarHBondContact N-O 3.04Å; L173-L176 PolarHBondContact O-N 2.84Å; L173-I178 HydrophobicContact CB-CD1 4.12Å; L173-I178 HydrophobicContact CB-CG1 4.11Å; L173-I201 HydrophobicContact CD2-CD1 3.76Å; L173-H207 HydrophobicContact CD2-CB 4.38Å; L173-H207 VanDerWaalsContact CD2-CD2 3.44Å; L173-H207 WeakPolarHBondContact CD2-CD2 3.48Å; L173-Q210 HydrophobicContact CD1-CB 3.99Å; L173-L211 WeakPolarHBondContact CA-O 3.37Å; L173-L212 HydrophobicContact CD1-CB 4.31Å; L173-I231 HydrophobicContact CD1-CG1 3.79Å
174	G	96.5	Very high	95.1	Very high	40 Å²	40	61.4 Å²	61.4	41%	0.412	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	26.6	-175.6	0	0	0	0	0	113.1	L176 L211	G174-L176 VanDerWaalsContact C-N 3.29Å; G174-L176 PolarHBondContact O-N 2.84Å; G174-L211 PolarHBondContact N-O 3.18Å
175	G	95.6	Very high	95.3	Very high	56 Å²	56	60.4 Å²	60.4	58%	0.577	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	-5.7	-175.3	0	0	0	0	0	115.1	L173	L173-G175 PolarHBondContact O-N 2.91Å
176	L	96.8	Very high	95.5	Very high	129 Å²	129	66.2 Å²	66.2	68%	0.675	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	137.2	178.4	-63.4	176.3	0	0	0	111.4	N172 L173 G174	N172-L176 CarbonylContact C-O 3.57Å; N172-L176 WeakPolarHBondContact CA-O 3.22Å; N172-L176 WeakPolarHBondContact CB-O 3.09Å; L173-L176 PolarHBondContact N-O 3.04Å; L173-L176 PolarHBondContact O-N 2.84Å; G174-L176 VanDerWaalsContact C-N 3.29Å; G174-L176 PolarHBondContact O-N 2.84Å
177	P	96.9	Very high	95.7	Very high	100 Å²	100	69.9 Å²	69.9	65%	0.649	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.2	136.3	175.6	-22.3	33	0	0	0	112.7	N172 S179	N172-P177 WeakPolarHBondContact OD1-CA 3.43Å; P177-S179 PolarHBondContact O-N 2.87Å
178	I	97.2	Very high	95.3	Very high	21 Å²	21	71.8 Å²	71.8	11%	0.108	40%	0.398	C	S	.	.			trans	-80.7	101.9	171.8	-56.8	179.9	0	0	0	108.3	L171 L173 E180 A181 A199 I201 L212	L171-I178 HydrophobicContact CB-CB 4.37Å; L171-I178 HydrophobicContact CB-CD1 3.96Å; L171-I178 HydrophobicContact CB-CG1 4.35Å; L171-I178 PolarHBondContact O-N 2.01Å; L173-I178 HydrophobicContact CB-CD1 4.12Å; L173-I178 HydrophobicContact CB-CG1 4.11Å; I178-E180 VanDerWaalsContact C-N 3.27Å; I178-E180 HydrophobicContact CG2-CG 3.81Å; I178-E180 PolarHBondContact O-N 2.04Å; I178-A181 HydrophobicContact CB-CB 4.41Å; I178-A181 HydrophobicContact CG2-CB 4.43Å; I178-A181 VanDerWaalsContact O-CB 3.26Å; I178-A181 WeakPolarHBondContact O-CB 3.29Å; I178-A181 PolarHBondContact O-N 2.89Å; I178-A181 VanDerWaalsContact O-N 3.15Å; I178-A199 HydrophobicContact CG2-CB 3.83Å; I178-I201 HydrophobicContact CD1-CG2 4.1Å; I178-I201 HydrophobicContact CG2-CG2 3.93Å; I178-L212 HydrophobicContact CD1-CD1 3.72Å
179	S	90.9	Very high	95	Very high	125 Å²	125	75.8 Å²	75.8	87%	0.874	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-28.5	-172.7	54	0	0	0	0	114.6	P177 A181	P177-S179 PolarHBondContact O-N 2.87Å; S179-A181 VanDerWaalsContact C-N 3.3Å
180	E	90.5	Very high	94.6	Very high	91 Å²	91	80.8 Å²	80.8	43%	0.425	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	1.6	179.4	61.9	-177.6	-163.6	0	0	114	I178 R182 I201	I178-E180 VanDerWaalsContact C-N 3.27Å; I178-E180 HydrophobicContact CG2-CG 3.81Å; I178-E180 PolarHBondContact O-N 2.04Å; E180-R182 PolarHBondContact O-N 3.35Å; E180-I201 WeakPolarHBondContact OE1-CA 3.38Å; E180-I201 PolarHBondContact OE1-N 2.99Å
181	A	96.8	Very high	94.2	Very high	31 Å²	31	79.8 Å²	79.8	26%	0.256	46%	0.456	S	S	.	.			trans	-63.5	131.4	-179.8	0	0	0	0	0	111.2	L171 I178 S179 T198 A199	L171-A181 HydrophobicContact CB-CB 4.45Å; L171-A181 HydrophobicContact CD1-CB 4.23Å; I178-A181 HydrophobicContact CB-CB 4.41Å; I178-A181 HydrophobicContact CG2-CB 4.43Å; I178-A181 VanDerWaalsContact O-CB 3.26Å; I178-A181 WeakPolarHBondContact O-CB 3.29Å; I178-A181 PolarHBondContact O-N 2.89Å; I178-A181 VanDerWaalsContact O-N 3.15Å; S179-A181 VanDerWaalsContact C-N 3.3Å; A181-T198 CarbonylContact C-O 3.52Å; A181-T198 VanDerWaalsContact CA-O 3.26Å; A181-T198 WeakPolarHBondContact CA-O 3.43Å; A181-A199 HydrophobicContact CB-CB 4.41Å
182	R	97.7	Very high	93.7	Very high	189 Å²	189	81 Å²	81	71%	0.713	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.1	176.9	-63.6	-177.5	-178.4	-177.6	-0.1	109.5	E180 A197 T198	E180-R182 PolarHBondContact O-N 3.35Å; R182-A197 CarbonylContact O-C 3.57Å; R182-A197 VanDerWaalsContact O-CA 3.27Å; R182-A197 WeakPolarHBondContact O-CA 2.95Å; R182-T198 PolarHBondContact N-O 2.99Å; R182-T198 PolarHBondContact O-N 3.48Å
183	V	96.5	Very high	93.5	Very high	65 Å²	65	82.7 Å²	82.7	39%	0.394	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.6	177.9	-175.6	0	0	0	0	109.6	T196 A197	V183-T196 CarbonylContact C-O 3.58Å; V183-T196 WeakPolarHBondContact CA-O 3.04Å; V183-A197 HydrophobicContact CG2-CB 4.09Å
184	V	96.4	Very high	93.3	Very high	75 Å²	75	83 Å²	83	46%	0.455	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	141.1	176	-179.5	0	0	0	0	108.6	K186 S195 T196	V184-K186 HydrophobicContact CG1-CG 4.26Å; V184-S195 CarbonylContact O-C 3.56Å; V184-S195 WeakPolarHBondContact O-CA 3.02Å; V184-T196 PolarHBondContact N-O 3.02Å; V184-T196 PolarHBondContact O-N 3.44Å
185	Q	95.4	Very high	93.3	Very high	83 Å²	83	81.1 Å²	81.1	39%	0.388	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	135.8	174.1	-61.7	-173	-19.9	0	0	109.6	P167 Q168 I193 T194 S195	P167-Q185 PolarHBondContact O-NE2 2.84Å; P167-Q185 VanDerWaalsContact O-NE2 3.15Å; Q168-Q185 VanDerWaalsContact NE2-NE2 3.11Å; Q185-I193 HydrophobicContact CB-CG2 4.25Å; Q185-T194 WeakPolarHBondContact CA-O 3.44Å; Q185-S195 WeakPolarHBondContact CG-OG 3.33Å; Q185-S195 PolarHBondContact NE2-OG 2.86Å
186	K	94.2	Very high	93.4	Very high	149 Å²	149	79.7 Å²	79.7	65%	0.648	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134	145.1	176.2	-64.8	-177.8	-177.8	175.8	0	109.7	V184 I193 T194	V184-K186 HydrophobicContact CG1-CG 4.26Å; K186-I193 CarbonylContact O-C 3.59Å; K186-I193 WeakPolarHBondContact O-CA 3.18Å; K186-T194 PolarHBondContact N-O 2.81Å; K186-T194 PolarHBondContact O-N 2.89Å
187	V	92.7	Very high	93.4	Very high	102 Å²	102	73.6 Å²	73.6	62%	0.618	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	129.9	170.5	-176.2	0	0	0	0	107.7	L192 I193	V187-L192 CarbonylContact C-O 3.6Å; V187-L192 WeakPolarHBondContact CA-O 3.01Å; V187-I193 HydrophobicContact CG2-CG1 4.33Å
188	D	86.1	Confident	93.5	Very high	40 Å²	40	70.1 Å²	70.1	21%	0.214	38%	0.379	C	S	.	.			trans	-87.5	-179.9	176.8	70	22.9	0	0	0	112.6	R161 E190 G191 L192	R161-D188 IonicContact CZ-OD2 2.71Å; R161-D188 IonicContact NE-OD2 3.37Å; R161-D188 PolarHBondContact NE-OD2 2.98Å; R161-D188 IonicContact NH2-OD1 2.65Å; R161-D188 IonicContact NH2-OD2 3.2Å; R161-D188 PolarHBondContact NH2-OD2 3.21Å; D188-E190 PolarHBondContact O-N 2.91Å; D188-E190 WeakPolarHBondContact OD1-CA 3Å; D188-E190 WeakPolarHBondContact OD1-CB 3.37Å; D188-E190 PolarHBondContact OD1-N 3.44Å; D188-G191 PolarHBondContact O-N 3.05Å; D188-G191 PolarHBondContact OD1-N 2.86Å; D188-L192 PolarHBondContact N-O 3.1Å; D188-L192 PolarHBondContact OD1-N 3.41Å
189	I	87.8	Confident	93.6	Very high	180 Å²	180	69.2 Å²	69.2	92%	0.923	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-21.3	-179.1	61.2	170.9	0	0	0	113.8	G191	I189-G191 VanDerWaalsContact C-N 3.28Å
190	E	88	Confident	93.9	Very high	115 Å²	115	67.3 Å²	67.3	54%	0.537	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	1.4	176.1	-65.2	177.2	-170.5	0	0	111.7	R136 R161 D188 L192	R136-E190 IonicContact NH1-OE2 3.86Å; R136-E190 PolarHBondContact NH1-OE2 3.25Å; R161-E190 IonicContact CZ-OE2 3.24Å; R161-E190 IonicContact NH1-OE2 3.13Å; R161-E190 IonicContact NH2-OE1 3.85Å; R161-E190 IonicContact NH2-OE2 3.34Å; R161-E190 PolarHBondContact NH2-OE2 2.85Å; D188-E190 PolarHBondContact O-N 2.91Å; D188-E190 WeakPolarHBondContact OD1-CA 3Å; D188-E190 WeakPolarHBondContact OD1-CB 3.37Å; D188-E190 PolarHBondContact OD1-N 3.44Å; E190-L192 VanDerWaalsContact C-N 3.25Å; E190-L192 HydrophobicContact CB-CD1 4.28Å; E190-L192 HydrophobicContact CB-CG 4.14Å; E190-L192 PolarHBondContact O-N 3.16Å; E190-L192 WeakPolarHBondContact OE2-CD1 3.47Å
191	G	87.3	Confident	94.1	Very high	51 Å²	51	63.4 Å²	63.4	53%	0.526	34%	0.336	S	S	.	.	S	Bend	trans	76.8	10.7	-174.1	0	0	0	0	0	113.5	D188 I189	D188-G191 PolarHBondContact O-N 3.05Å; D188-G191 PolarHBondContact OD1-N 2.86Å; I189-G191 VanDerWaalsContact C-N 3.28Å
192	L	89.4	Confident	94.1	Very high	31 Å²	31	67.4 Å²	67.4	16%	0.162	35%	0.348	C	S	.	.			trans	-88.2	140.6	-179.8	-61	177	0	0	0	110.7	A162 V187 D188 E190	A162-L192 HydrophobicContact CB-CB 4.46Å; A162-L192 HydrophobicContact CB-CD1 4.08Å; A162-L192 HydrophobicContact CB-CD2 4.43Å; V187-L192 CarbonylContact C-O 3.6Å; V187-L192 WeakPolarHBondContact CA-O 3.01Å; D188-L192 PolarHBondContact N-O 3.1Å; D188-L192 PolarHBondContact OD1-N 3.41Å; E190-L192 VanDerWaalsContact C-N 3.25Å; E190-L192 HydrophobicContact CB-CD1 4.28Å; E190-L192 HydrophobicContact CB-CG 4.14Å; E190-L192 PolarHBondContact O-N 3.16Å; E190-L192 WeakPolarHBondContact OE2-CD1 3.47Å
193	I	92.7	Very high	94	Very high	51 Å²	51	58.5 Å²	58.5	26%	0.262	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	129.9	175.2	-59.7	173.8	0	0	0	108.7	A162 A166 Q185 K186 V187	A162-I193 CarbonylContact C-O 3.52Å; A162-I193 VanDerWaalsContact CA-O 3.24Å; A162-I193 WeakPolarHBondContact CA-O 3.44Å; A162-I193 PolarHBondContact N-O 2.76Å; A166-I193 HydrophobicContact CB-CD1 3.74Å; A166-I193 HydrophobicContact CB-CG2 4.15Å; Q185-I193 HydrophobicContact CB-CG2 4.25Å; K186-I193 CarbonylContact O-C 3.59Å; K186-I193 WeakPolarHBondContact O-CA 3.18Å; V187-I193 HydrophobicContact CG2-CG1 4.33Å
194	T	94.5	Very high	93.9	Very high	19 Å²	19	57.9 Å²	57.9	12%	0.117	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	119.8	166.3	-59	0	0	0	0	108.2	A160 R161 Q185 K186	A160-T194 WeakPolarHBondContact O-CA 3.49Å; R161-T194 HydrophobicContact CB-CG2 4.38Å; Q185-T194 WeakPolarHBondContact CA-O 3.44Å; K186-T194 PolarHBondContact N-O 2.81Å; K186-T194 PolarHBondContact O-N 2.89Å
195	S	96.4	Very high	93.8	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	136	170.5	-64.7	0	0	0	0	108.9	Q159 A160 P167 I169 V184 Q185	Q159-S195 WeakPolarHBondContact CA-O 3.45Å; A160-S195 PolarHBondContact N-O 3.08Å; A160-S195 PolarHBondContact O-N 3Å; P167-S195 WeakPolarHBondContact O-CB 3.1Å; P167-S195 PolarHBondContact O-OG 2.79Å; I169-S195 VanDerWaalsContact CD1-C 3.45Å; I169-S195 WeakPolarHBondContact CD1-O 3.12Å; V184-S195 CarbonylContact O-C 3.56Å; V184-S195 WeakPolarHBondContact O-CA 3.02Å; Q185-S195 WeakPolarHBondContact CG-OG 3.33Å; Q185-S195 PolarHBondContact NE2-OG 2.86Å
196	T	97.2	Very high	93.8	Very high	27 Å²	27	58.5 Å²	58.5	17%	0.166	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	122.6	178.9	-55.4	0	0	0	0	108.9	E157 C158 Q159 V183 V184 T198	E157-T196 HydrophobicContact CG-CG2 3.81Å; C158-T196 CarbonylContact O-C 3.55Å; C158-T196 VanDerWaalsContact O-CA 3.29Å; C158-T196 WeakPolarHBondContact O-CA 3.37Å; Q159-T196 HydrophobicContact CG-CG2 3.93Å; V183-T196 CarbonylContact C-O 3.58Å; V183-T196 WeakPolarHBondContact CA-O 3.04Å; V184-T196 PolarHBondContact N-O 3.02Å; V184-T196 PolarHBondContact O-N 3.44Å; T196-T198 HydrophobicContact CG2-CG2 3.87Å
197	A	98.1	Very high	93.8	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.008	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	131.4	170.7	0	0	0	0	0	110.1	E157 C158 I169 L171 R182 V183	E157-A197 CarbonylContact C-O 3.56Å; E157-A197 WeakPolarHBondContact CA-O 3.43Å; C158-A197 PolarHBondContact N-O 2.73Å; C158-A197 PolarHBondContact O-N 2.86Å; I169-A197 HydrophobicContact CB-CB 3.85Å; I169-A197 HydrophobicContact CG2-CB 3.37Å; L171-A197 HydrophobicContact CD1-CB 3.94Å; L171-A197 HydrophobicContact CG-CB 3.99Å; R182-A197 CarbonylContact O-C 3.57Å; R182-A197 VanDerWaalsContact O-CA 3.27Å; R182-A197 WeakPolarHBondContact O-CA 2.95Å; V183-A197 HydrophobicContact CG2-CB 4.09Å
198	T	98.4	Very high	94	Very high	27 Å²	27	49.4 Å²	49.4	17%	0.166	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	145.4	-179.7	66.4	0	0	0	0	111.4	Y155 I156 E157 A181 R182 T196	Y155-T198 HydrophobicContact CE2-CG2 4.2Å; Y155-T198 WeakPolarHBondContact OH-CG2 3.26Å; I156-T198 CarbonylContact O-C 3.56Å; I156-T198 WeakPolarHBondContact O-CA 3.09Å; E157-T198 HydrophobicContact CB-CG2 4.45Å; E157-T198 HydrophobicContact CG-CG2 4.11Å; A181-T198 CarbonylContact C-O 3.52Å; A181-T198 VanDerWaalsContact CA-O 3.26Å; A181-T198 WeakPolarHBondContact CA-O 3.43Å; R182-T198 PolarHBondContact N-O 2.99Å; R182-T198 PolarHBondContact O-N 3.48Å; T196-T198 HydrophobicContact CG2-CG2 3.87Å
199	A	98.1	Very high	94.4	Very high	2 Å²	2	55.3 Å²	55.3	2%	0.017	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	155.9	177.5	0	0	0	0	0	111.3	Y155 I156 L171 I178 A181 I201	Y155-A199 WeakPolarHBondContact CA-O 3.49Å; I156-A199 HydrophobicContact CB-CB 4.49Å; I156-A199 PolarHBondContact N-O 3.45Å; I156-A199 PolarHBondContact O-N 2.78Å; L171-A199 HydrophobicContact CD1-CB 4.1Å; I178-A199 HydrophobicContact CG2-CB 3.83Å; A181-A199 HydrophobicContact CB-CB 4.41Å; A199-I201 HydrophobicContact CB-CG2 4.29Å
200	N	97.2	Very high	94.9	Very high	84 Å²	84	49.4 Å²	49.4	45%	0.449	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	73	-179.8	-79	-78.2	0	0	0	110.9	R153 T154	R153-N200 PolarHBondContact NH1-O 2.74Å; T154-N200 CarbonylContact O-C 3.58Å; T154-N200 WeakPolarHBondContact O-CA 3.33Å
201	I	95.9	Very high	95.3	Very high	9 Å²	9	47.7 Å²	47.7	5%	0.046	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	139.9	-169.9	66.1	170.5	0	0	0	111.7	R153 T154 I156 L173 I178 E180 A199 L203	R153-I201 CarbonylContact C-O 3.53Å; R153-I201 VanDerWaalsContact CA-O 3.26Å; R153-I201 WeakPolarHBondContact CA-O 3.45Å; T154-I201 HydrophobicContact CG2-CD1 4.04Å; T154-I201 HydrophobicContact CG2-CG1 3.52Å; T154-I201 PolarHBondContact N-O 3.25Å; T154-I201 PolarHBondContact O-N 3.35Å; I156-I201 HydrophobicContact CD1-CD1 3.36Å; I156-I201 HydrophobicContact CD1-CG1 3.66Å; I156-I201 HydrophobicContact CD1-CG2 4.23Å; L173-I201 HydrophobicContact CD2-CD1 3.76Å; I178-I201 HydrophobicContact CD1-CG2 4.1Å; I178-I201 HydrophobicContact CG2-CG2 3.93Å; E180-I201 WeakPolarHBondContact OE1-CA 3.38Å; E180-I201 PolarHBondContact OE1-N 2.99Å; A199-I201 HydrophobicContact CB-CG2 4.29Å; I201-L203 HydrophobicContact CD1-CD2 3.59Å; I201-L203 HydrophobicContact CG1-CD2 4.05Å
202	K	96	Very high	95.9	Very high	116 Å²	116	45.3 Å²	45.3	50%	0.504	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	119.6	165.3	-172.8	-179.9	179.3	-177.5	0	109.1	R153	R153-K202 HydrophobicContact CG-CB 4.19Å; R153-K202 HydrophobicContact CG-CG 4.44Å
203	L	95.8	Very high	96.3	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-75.1	143.7	-179.5	-61.5	173.8	0	0	0	111.2	L148 G151 Q152 T154 I201 H207 I231 L233	L148-L203 HydrophobicContact CB-CD1 3.81Å; L148-L203 HydrophobicContact CD1-CD1 4.35Å; L148-L203 HydrophobicContact CD2-CD1 4.02Å; L148-L203 HydrophobicContact CG-CD1 4.26Å; G151-L203 VanDerWaalsContact CA-O 3.31Å; G151-L203 WeakPolarHBondContact CA-O 3.43Å; G151-L203 PolarHBondContact N-O 2.96Å; Q152-L203 PolarHBondContact O-N 2.78Å; T154-L203 HydrophobicContact CG2-CD1 3.9Å; T154-L203 HydrophobicContact CG2-CD2 4.06Å; T154-L203 HydrophobicContact CG2-CG 3.98Å; I201-L203 HydrophobicContact CD1-CD2 3.59Å; I201-L203 HydrophobicContact CG1-CD2 4.05Å; L203-H207 HydrophobicContact CD2-CB 4.5Å; L203-I231 HydrophobicContact CD2-CG2 4.22Å; L203-L233 HydrophobicContact CB-CD2 4.14Å; L203-L233 HydrophobicContact CD1-CD2 3.71Å; L203-L233 HydrophobicContact CG-CD2 4.34Å
204	T	95	Very high	96.6	Very high	53 Å²	53	42.4 Å²	42.4	33%	0.325	21%	0.214	S	C	.	.			trans	-135.4	163.1	179.2	59.2	0	0	0	0	108	T206 H207 L233	T204-T206 PolarHBondContact O-N 2.86Å; T204-T206 VanDerWaalsContact O-N 3.09Å; T204-T206 PolarHBondContact OG1-OG1 2.76Å; T204-H207 PolarHBondContact N-ND1 2.94Å; T204-H207 WeakPolarHBondContact O-CB 3.1Å; T204-H207 PolarHBondContact O-N 3.26Å; T204-H207 PolarHBondContact OG1-CE1 3Å; T204-H207 VanDerWaalsContact OG1-CE1 3.26Å; T204-H207 PolarHBondContact OG1-ND1 3.45Å; T204-L233 VanDerWaalsContact O-CD1 3.26Å; T204-L233 WeakPolarHBondContact O-CD1 3.37Å
205	N	94.4	Very high	96.7	Very high	72 Å²	72	42.6 Å²	42.6	39%	0.385	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-53.2	-33.2	177.5	-77	-45.9	0	0	0	113.1	V150 H207 H208	V150-N205 WeakPolarHBondContact CG2-OD1 3.39Å; N205-H207 PolarHBondContact O-N 2.66Å; N205-H208 WeakPolarHBondContact O-CB 3.35Å; N205-H208 PolarHBondContact O-N 3.06Å
206	T	93.9	Very high	96.7	Very high	99 Å²	99	42.6 Å²	42.6	61%	0.607	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-65.4	-23	179.4	56.1	0	0	0	0	113.4	T204 H208 Q210	T204-T206 PolarHBondContact O-N 2.86Å; T204-T206 VanDerWaalsContact O-N 3.09Å; T204-T206 PolarHBondContact OG1-OG1 2.76Å; T206-H208 VanDerWaalsContact C-N 3.34Å; T206-Q210 WeakPolarHBondContact O-CG 3.49Å; T206-Q210 PolarHBondContact O-NE2 3.32Å
207	H	95.6	Very high	96.7	Very high	37 Å²	37	42 Å²	42	17%	0.171	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-80.8	-12.1	179.5	-59.4	144.7	0	0	0	113.5	L173 L203 T204 N205 W209 Q210 I231	L173-H207 HydrophobicContact CD2-CB 4.38Å; L173-H207 VanDerWaalsContact CD2-CD2 3.44Å; L173-H207 WeakPolarHBondContact CD2-CD2 3.48Å; L203-H207 HydrophobicContact CD2-CB 4.5Å; T204-H207 PolarHBondContact N-ND1 2.94Å; T204-H207 WeakPolarHBondContact O-CB 3.1Å; T204-H207 PolarHBondContact O-N 3.26Å; T204-H207 PolarHBondContact OG1-CE1 3Å; T204-H207 VanDerWaalsContact OG1-CE1 3.26Å; T204-H207 PolarHBondContact OG1-ND1 3.45Å; N205-H207 PolarHBondContact O-N 2.66Å; H207-W209 PolarHBondContact O-N 2.77Å; H207-Q210 WeakPolarHBondContact O-CB 3.26Å; H207-Q210 PolarHBondContact O-N 3.27Å; H207-I231 HydrophobicContact CB-CG2 4.31Å; H207-I231 WeakPolarHBondContact O-CB 3.45Å; H207-I231 WeakPolarHBondContact O-CG2 3.47Å
208	H	96	Very high	96.4	Very high	22 Å²	22	42.2 Å²	42.2	10%	0.102	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	133.7	176.8	-168.2	69.2	0	0	0	110.7	N205 T206 Q210 H232 L233 Y236	N205-H208 WeakPolarHBondContact O-CB 3.35Å; N205-H208 PolarHBondContact O-N 3.06Å; T206-H208 VanDerWaalsContact C-N 3.34Å; H208-Q210 PolarHBondContact O-N 2.71Å; H208-Q210 VanDerWaalsContact O-N 3.16Å; H208-H232 AromaticContact CE1-CD2 3.53Å; H208-H232 AromaticContact CE1-NE2 3.9Å; H208-L233 HydrophobicContact CB-CD1 4.1Å; H208-L233 HydrophobicContact CB-CG 4.24Å; H208-L233 PolarHBondContact CE1-N 3.04Å; H208-L233 PolarHBondContact CE1-O 2.88Å; H208-L233 VanDerWaalsContact CE1-O 3.29Å; H208-L233 PolarHBondContact ND1-N 3.43Å; H208-Y236 HydrophobicContact CB-CD2 3.46Å; H208-Y236 VanDerWaalsContact CB-CD2 3.46Å; H208-Y236 HydrophobicContact CB-CE2 3.86Å; H208-Y236 HydrophobicContact CB-CG 3.97Å; H208-Y236 AromaticContact CD2-CD1 3.32Å; H208-Y236 WeakPolarHBondContact CD2-CD1 3.5Å; H208-Y236 AromaticContact CD2-CD2 3.56Å; H208-Y236 AromaticContact CD2-CE1 3.67Å; H208-Y236 AromaticContact CD2-CE2 3.89Å; H208-Y236 AromaticContact CD2-CG 3.25Å; H208-Y236 AromaticContact CD2-CZ 3.94Å; H208-Y236 AromaticContact CE1-CG 3.96Å; H208-Y236 AromaticContact CG-CD2 3.54Å; H208-Y236 AromaticContact CG-CG 3.49Å; H208-Y236 VanDerWaalsContact CG-CG 3.49Å; H208-Y236 AromaticContact ND1-CG 3.91Å; H208-Y236 AromaticContact NE2-CD1 3.47Å; H208-Y236 WeakPolarHBondContact NE2-CD1 3.34Å; H208-Y236 AromaticContact NE2-CG 3.6Å
209	W	95.5	Very high	96	Very high	164 Å²	164	46 Å²	46	62%	0.621	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.5	8.5	-173.2	-63.3	116	0	0	0	116.4	H207 V230 I231 H232	H207-W209 PolarHBondContact O-N 2.77Å; W209-V230 HydrophobicContact CE3-CG1 3.67Å; W209-V230 HydrophobicContact CZ3-CG1 4.1Å; W209-I231 WeakPolarHBondContact CA-O 3.4Å; W209-I231 PolarHBondContact N-O 3.4Å; W209-H232 AromaticContact CH2-CD2 3.83Å; W209-H232 AromaticContact CZ2-CD2 3.68Å
210	Q	96.8	Very high	95.5	Very high	56 Å²	56	49.2 Å²	49.2	26%	0.262	25%	0.253	S	S	.	.			trans	-78	149.2	174.4	-65.9	-165.5	-4.3	0	0	111.8	L173 T206 H207 H208 I231	L173-Q210 HydrophobicContact CD1-CB 3.99Å; T206-Q210 WeakPolarHBondContact O-CG 3.49Å; T206-Q210 PolarHBondContact O-NE2 3.32Å; H207-Q210 WeakPolarHBondContact O-CB 3.26Å; H207-Q210 PolarHBondContact O-N 3.27Å; H208-Q210 PolarHBondContact O-N 2.71Å; H208-Q210 VanDerWaalsContact O-N 3.16Å; Q210-I231 PolarHBondContact O-N 3.05Å
211	L	98	Very high	95.3	Very high	80 Å²	80	46.9 Å²	46.9	42%	0.419	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	124.1	170.9	-81.6	75	0	0	0	109.7	L173 G174 T213 F228	L173-L211 WeakPolarHBondContact CA-O 3.37Å; G174-L211 PolarHBondContact N-O 3.18Å; L211-T213 HydrophobicContact CB-CG2 3.94Å; L211-T213 HydrophobicContact CD2-CG2 4.36Å; L211-F228 HydrophobicContact CD2-CB 4.48Å; L211-F228 HydrophobicContact CD2-CD2 4.03Å; L211-F228 HydrophobicContact CD2-CG 4.26Å; L211-F228 HydrophobicContact CG-CD2 4.35Å
212	L	98.3	Very high	95.2	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	114.4	158.1	177.2	68.5	0	0	0	107.6	L140 I142 I156 N172 L173 I178 F228 K229 I231	L140-L212 HydrophobicContact CD1-CD2 4.05Å; L140-L212 HydrophobicContact CD1-CG 4.44Å; L140-L212 HydrophobicContact CD2-CD2 4.14Å; L140-L212 HydrophobicContact CD2-CG 4.13Å; L140-L212 HydrophobicContact CG-CD2 4.39Å; I142-L212 HydrophobicContact CD1-CD2 3.58Å; I142-L212 HydrophobicContact CG1-CD2 3.66Å; I156-L212 HydrophobicContact CB-CD2 4.46Å; I156-L212 HydrophobicContact CD1-CD1 3.82Å; I156-L212 HydrophobicContact CD1-CD2 3.59Å; I156-L212 HydrophobicContact CD1-CG 4.36Å; I156-L212 HydrophobicContact CG1-CD2 3.86Å; I156-L212 HydrophobicContact CG2-CD1 4.4Å; I156-L212 HydrophobicContact CG2-CD2 3.76Å; N172-L212 CarbonylContact O-C 3.53Å; N172-L212 WeakPolarHBondContact O-CA 3.34Å; L173-L212 HydrophobicContact CD1-CB 4.31Å; I178-L212 HydrophobicContact CD1-CD1 3.72Å; L212-F228 CarbonylContact O-C 3.57Å; L212-F228 WeakPolarHBondContact O-CA 3.37Å; L212-F228 WeakPolarHBondContact O-CB 3.36Å; L212-K229 PolarHBondContact N-O 2.81Å; L212-K229 PolarHBondContact O-N 3.27Å; L212-I231 HydrophobicContact CB-CD1 4.22Å; L212-I231 HydrophobicContact CB-CG1 4.35Å
213	T	98.4	Very high	95.1	Very high	21 Å²	21	53.6 Å²	53.6	13%	0.129	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	142.5	-178.7	65.4	0	0	0	0	111	L171 N172 L211 H215 F228	L171-T213 WeakPolarHBondContact CA-O 3.31Å; N172-T213 WeakPolarHBondContact CB-OG1 3.3Å; N172-T213 PolarHBondContact N-O 2.95Å; N172-T213 PolarHBondContact O-N 2.75Å; L211-T213 HydrophobicContact CB-CG2 3.94Å; L211-T213 HydrophobicContact CD2-CG2 4.36Å; T213-H215 WeakPolarHBondContact CB-NE2 3.21Å; T213-H215 PolarHBondContact OG1-CD2 3.39Å; T213-H215 VanDerWaalsContact OG1-CD2 3.29Å; T213-H215 PolarHBondContact OG1-NE2 3.09Å; T213-F228 HydrophobicContact CG2-CB 3.91Å
214	C	98.5	Very high	95	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	115.8	168.9	178.4	0	0	0	0	108.6	L140 C158 I169 R170 L171 Q226 T227	L140-C214 HydrophobicContact CD1-CB 4.32Å; C158-C214 HydrophobicContact CB-CB 3.71Å; C158-C214 WeakPolarHBondContact CB-SG 2.97Å; C158-C214 WeakPolarHBondContact SG-CB 3.06Å; C158-C214 CovalentContact SG-SG 2.01Å; C158-C214 PolarHBondContact SG-SG 3.49Å; I169-C214 WeakPolarHBondContact CG2-SG 3.29Å; R170-C214 WeakPolarHBondContact O-CA 3.34Å; L171-C214 HydrophobicContact CD2-CB 3.96Å; C214-Q226 VanDerWaalsContact O-CA 3.25Å; C214-Q226 WeakPolarHBondContact O-CA 3.14Å; C214-T227 HydrophobicContact CB-CG2 3.92Å; C214-T227 PolarHBondContact N-O 3.31Å; C214-T227 PolarHBondContact O-N 3.13Å
215	H	97.7	Very high	95	Very high	23 Å²	23	56.2 Å²	56.2	11%	0.106	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	133.3	178.8	-60	-86.8	0	0	0	109.9	I169 R170 T213 N223 Q226	I169-H215 WeakPolarHBondContact CA-O 3.33Å; R170-H215 HydrophobicContact CB-CB 4.39Å; R170-H215 PolarHBondContact N-O 2.65Å; R170-H215 VanDerWaalsContact NH2-CB 3.35Å; R170-H215 PolarHBondContact O-N 2.96Å; T213-H215 WeakPolarHBondContact CB-NE2 3.21Å; T213-H215 PolarHBondContact OG1-CD2 3.39Å; T213-H215 VanDerWaalsContact OG1-CD2 3.29Å; T213-H215 PolarHBondContact OG1-NE2 3.09Å; H215-N223 PolarHBondContact ND1-OD1 3.11Å; H215-Q226 PolarHBondContact ND1-OE1 3.42Å
216	V	97.1	Very high	95.2	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	125.3	173	-177	0	0	0	0	108.8	I135 L138 A160 P167 Q168 N223 V224 N225	I135-V216 HydrophobicContact CD1-CG1 4Å; I135-V216 HydrophobicContact CG1-CG1 4.05Å; L138-V216 HydrophobicContact CD1-CG2 3.61Å; L138-V216 HydrophobicContact CD2-CG2 3.92Å; L138-V216 HydrophobicContact CG-CG2 4.4Å; A160-V216 HydrophobicContact CB-CG2 3.86Å; P167-V216 HydrophobicContact CB-CG1 3.44Å; P167-V216 VanDerWaalsContact CB-CG1 3.44Å; Q168-V216 WeakPolarHBondContact O-CA 3.22Å; V216-N223 CarbonylContact O-C 3.56Å; V216-N223 VanDerWaalsContact O-CA 3.31Å; V216-N223 WeakPolarHBondContact O-CA 3.44Å; V216-N223 PolarHBondContact O-N 3.22Å; V216-V224 HydrophobicContact CB-CG2 4.38Å; V216-V224 HydrophobicContact CG1-CG2 4.01Å; V216-V224 WeakPolarHBondContact O-CG2 3.2Å; V216-V224 PolarHBondContact O-N 3.33Å; V216-N225 HydrophobicContact CB-CB 4.24Å; V216-N225 WeakPolarHBondContact CB-O 3.41Å; V216-N225 PolarHBondContact N-O 3.46Å
217	D	95.3	Very high	95.4	Very high	16 Å²	16	55.6 Å²	55.6	9%	0.086	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	152.8	175.2	-56.7	-28.2	0	0	0	109.8	P167 Q168 R170 Y221 R222 N223	P167-D217 WeakPolarHBondContact CA-O 3.45Å; Q168-D217 HydrophobicContact CB-CB 4.4Å; Q168-D217 PolarHBondContact N-O 3.15Å; Q168-D217 PolarHBondContact O-N 3.42Å; R170-D217 IonicContact CZ-OD1 3.66Å; R170-D217 IonicContact CZ-OD2 3.91Å; R170-D217 IonicContact NE-OD1 2.76Å; R170-D217 IonicContact NE-OD2 2.93Å; R170-D217 PolarHBondContact NE-OD2 3.47Å; R170-D217 IonicContact NH2-OD1 3Å; R170-D217 PolarHBondContact NH2-OD1 3.47Å; R170-D217 IonicContact NH2-OD2 4Å; R170-D217 PolarHBondContact NH2-OD2 3.47Å; R170-D217 VanDerWaalsContact NH2-OD2 3.15Å; D217-Y221 CarbonylContact C-O 3.55Å; D217-Y221 WeakPolarHBondContact CA-O 3.4Å; D217-R222 VanDerWaalsContact OD1-CA 3.23Å; D217-R222 WeakPolarHBondContact OD1-CA 3.44Å; D217-N223 PolarHBondContact OD1-N 3.06Å
218	M	93.2	Very high	95.5	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.02	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	109.5	173.3	-76.9	-177.7	-175.2	0	0	109.6	L130 I135 P165 A220 Y221 V224	L130-M218 HydrophobicContact CD2-CB 3.74Å; L130-M218 HydrophobicContact CD2-SD 4.45Å; I135-M218 HydrophobicContact CD1-CE 3.45Å; I135-M218 VanDerWaalsContact CD1-CE 3.45Å; I135-M218 HydrophobicContact CG1-CE 3.77Å; P165-M218 HydrophobicContact CG-CB 3.96Å; P165-M218 HydrophobicContact CG-CG 4.33Å; M218-A220 PolarHBondContact O-N 3.37Å; M218-A220 VanDerWaalsContact O-N 3.13Å; M218-Y221 PolarHBondContact N-O 2.89Å; M218-Y221 PolarHBondContact O-N 3.15Å; M218-V224 HydrophobicContact CB-CG1 4.25Å; M218-V224 HydrophobicContact CB-CG2 4.35Å; M218-V224 HydrophobicContact CE-CG2 4.28Å; M218-V224 HydrophobicContact CG-CG2 3.85Å; M218-V224 HydrophobicContact SD-CG2 4.14Å
219	Q	89.8	Confident	95.6	Very high	108 Å²	108	61.3 Å²	61.3	51%	0.505	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	-118	-175.9	-70.7	171	-14.2	0	0	111.4	Y128 P165 Y221	Y128-Q219 PolarHBondContact OH-OE1 3.03Å; P165-Q219 HydrophobicContact CB-CG 4.04Å; P165-Q219 HydrophobicContact CG-CB 4.41Å; P165-Q219 HydrophobicContact CG-CG 3.64Å; Q219-Y221 VanDerWaalsContact C-N 3.32Å
220	A	87.5	Confident	95.7	Very high	69 Å²	69	56.2 Å²	56.2	57%	0.57	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-14.9	-179	0	0	0	0	0	113.6	Y128 M218	Y128-A220 HydrophobicContact CD1-CB 4.03Å; Y128-A220 HydrophobicContact CE1-CB 4.14Å; Y128-A220 HydrophobicContact CG-CB 4.46Å; M218-A220 PolarHBondContact O-N 3.37Å; M218-A220 VanDerWaalsContact O-N 3.13Å
221	Y	93.3	Very high	95.7	Very high	35 Å²	35	53.5 Å²	53.5	14%	0.137	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	119.4	-178.1	-77	-85.8	0	0	0	111.6	N31 Q32 I33 Y128 L130 D217 M218 Q219	N31-Y221 VanDerWaalsContact C-OH 3.27Å; N31-Y221 WeakPolarHBondContact CA-OH 3.3Å; N31-Y221 HydrophobicContact CB-CE1 4.23Å; N31-Y221 VanDerWaalsContact CB-OH 3.28Å; N31-Y221 WeakPolarHBondContact CB-OH 3.4Å; Q32-Y221 VanDerWaalsContact C-OH 3.29Å; Q32-Y221 PolarHBondContact N-OH 3.37Å; Q32-Y221 PolarHBondContact O-OH 2.94Å; Q32-Y221 VanDerWaalsContact O-OH 3.08Å; I33-Y221 HydrophobicContact CD1-CD1 3.6Å; I33-Y221 HydrophobicContact CD1-CD2 4.4Å; I33-Y221 HydrophobicContact CD1-CE1 4.12Å; I33-Y221 HydrophobicContact CD1-CG 3.76Å; I33-Y221 HydrophobicContact CG1-CD1 3.63Å; I33-Y221 HydrophobicContact CG1-CD2 4.05Å; I33-Y221 HydrophobicContact CG1-CE1 3.64Å; I33-Y221 HydrophobicContact CG1-CE2 4.03Å; I33-Y221 HydrophobicContact CG1-CG 3.83Å; Y128-Y221 HydrophobicContact CD1-CD2 4.24Å; Y128-Y221 AromaticContact CD1-CE2 3.72Å; Y128-Y221 HydrophobicContact CD1-CE2 3.72Å; Y128-Y221 HydrophobicContact CE1-CE2 4.45Å; Y128-Y221 PolarHBondContact O-OH 3.36Å; L130-Y221 HydrophobicContact CB-CD2 3.53Å; L130-Y221 HydrophobicContact CB-CE2 3.39Å; L130-Y221 HydrophobicContact CD2-CD2 3.63Å; L130-Y221 HydrophobicContact CD2-CE2 4.37Å; L130-Y221 HydrophobicContact CD2-CG 4.22Å; L130-Y221 HydrophobicContact CG-CD2 4.19Å; L130-Y221 HydrophobicContact CG-CE2 4.5Å; D217-Y221 CarbonylContact C-O 3.55Å; D217-Y221 WeakPolarHBondContact CA-O 3.4Å; M218-Y221 PolarHBondContact N-O 2.89Å; M218-Y221 PolarHBondContact O-N 3.15Å; Q219-Y221 VanDerWaalsContact C-N 3.32Å
222	R	93.7	Very high	95.7	Very high	192 Å²	192	54.2 Å²	54.2	73%	0.725	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	148.6	176	-65.6	-171.3	177.3	-161.2	-1.3	111.8	D217 V224	D217-R222 VanDerWaalsContact OD1-CA 3.23Å; D217-R222 WeakPolarHBondContact OD1-CA 3.44Å; R222-V224 VanDerWaalsContact C-N 3.28Å; R222-V224 PolarHBondContact O-N 3.41Å
223	N	93.7	Very high	95.6	Very high	73 Å²	73	54.3 Å²	54.3	39%	0.39	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.7	42	173.1	-46.2	-52.5	0	0	0	112.6	R170 H215 V216 D217 N225	R170-N223 PolarHBondContact NH2-OD1 2.86Å; H215-N223 PolarHBondContact ND1-OD1 3.11Å; V216-N223 CarbonylContact O-C 3.56Å; V216-N223 VanDerWaalsContact O-CA 3.31Å; V216-N223 WeakPolarHBondContact O-CA 3.44Å; V216-N223 PolarHBondContact O-N 3.22Å; D217-N223 PolarHBondContact OD1-N 3.06Å; N223-N225 PolarHBondContact O-N 3.23Å
224	V	93.8	Very high	95.4	Very high	48 Å²	48	60 Å²	60	29%	0.291	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	-24.9	175.3	-59.6	0	0	0	0	111.7	I33 V216 M218 R222	I33-V224 HydrophobicContact CD1-CG1 3.77Å; V216-V224 HydrophobicContact CB-CG2 4.38Å; V216-V224 HydrophobicContact CG1-CG2 4.01Å; V216-V224 WeakPolarHBondContact O-CG2 3.2Å; V216-V224 PolarHBondContact O-N 3.33Å; M218-V224 HydrophobicContact CB-CG1 4.25Å; M218-V224 HydrophobicContact CB-CG2 4.35Å; M218-V224 HydrophobicContact CE-CG2 4.28Å; M218-V224 HydrophobicContact CG-CG2 3.85Å; M218-V224 HydrophobicContact SD-CG2 4.14Å; R222-V224 VanDerWaalsContact C-N 3.28Å; R222-V224 PolarHBondContact O-N 3.41Å
225	N	95.6	Very high	95.1	Very high	62 Å²	62	63.5 Å²	63.5	33%	0.332	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	156.5	166.4	-159.3	-18.7	0	0	0	108.7	I135 L138 V216 N223	I135-N225 HydrophobicContact CG1-CB 4.43Å; L138-N225 HydrophobicContact CD2-CB 4.1Å; V216-N225 HydrophobicContact CB-CB 4.24Å; V216-N225 WeakPolarHBondContact CB-O 3.41Å; V216-N225 PolarHBondContact N-O 3.46Å; N223-N225 PolarHBondContact O-N 3.23Å
226	Q	97.3	Very high	94.8	Very high	116 Å²	116	67 Å²	67	54%	0.542	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	153.2	178.5	60.9	-174.7	-8.1	0	0	111.6	L138 C214 H215	L138-Q226 VanDerWaalsContact CD2-C 3.47Å; C214-Q226 VanDerWaalsContact O-CA 3.25Å; C214-Q226 WeakPolarHBondContact O-CA 3.14Å; H215-Q226 PolarHBondContact ND1-OE1 3.42Å
227	T	98.2	Very high	94.2	Very high	42 Å²	42	70 Å²	70	26%	0.258	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	163.3	170.7	-171	0	0	0	0	109.5	L138 L140 C214	L138-T227 HydrophobicContact CD1-CG2 4.41Å; L138-T227 HydrophobicContact CD2-CG2 3.99Å; L138-T227 HydrophobicContact CG-CG2 3.79Å; L140-T227 HydrophobicContact CB-CG2 3.6Å; L140-T227 HydrophobicContact CD2-CG2 4.45Å; C214-T227 HydrophobicContact CB-CG2 3.92Å; C214-T227 PolarHBondContact N-O 3.31Å; C214-T227 PolarHBondContact O-N 3.13Å
228	F	98.3	Very high	93.4	Very high	126 Å²	126	73.3 Å²	73.3	55%	0.553	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.8	160.8	-179.4	68.7	-88.4	0	0	0	112.4	L211 L212 T213	L211-F228 HydrophobicContact CD2-CB 4.48Å; L211-F228 HydrophobicContact CD2-CD2 4.03Å; L211-F228 HydrophobicContact CD2-CG 4.26Å; L211-F228 HydrophobicContact CG-CD2 4.35Å; L212-F228 CarbonylContact O-C 3.57Å; L212-F228 WeakPolarHBondContact O-CA 3.37Å; L212-F228 WeakPolarHBondContact O-CB 3.36Å; T213-F228 HydrophobicContact CG2-CB 3.91Å
229	K	98.3	Very high	92.6	Very high	52 Å²	52	77.6 Å²	77.6	23%	0.226	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	154.7	168.5	-78.2	175.6	172	-82.8	0	109.1	L140 I142 E145 L212	L140-K229 HydrophobicContact CD2-CB 4.11Å; L140-K229 HydrophobicContact CD2-CD 4.27Å; L140-K229 HydrophobicContact CD2-CG 4.09Å; L140-K229 HydrophobicContact CG-CD 4.14Å; L140-K229 HydrophobicContact CG-CG 4.47Å; L140-K229 WeakPolarHBondContact O-CE 3.38Å; I142-K229 HydrophobicContact CD1-CB 3.79Å; I142-K229 HydrophobicContact CD1-CD 3.75Å; I142-K229 HydrophobicContact CD1-CG 4.41Å; I142-K229 HydrophobicContact CG1-CD 3.84Å; E145-K229 VanDerWaalsContact OE1-CD 3.29Å; E145-K229 WeakPolarHBondContact OE1-CD 3.28Å; E145-K229 IonicContact OE1-NZ 2.78Å; E145-K229 PolarHBondContact OE1-NZ 3.32Å; E145-K229 IonicContact OE2-NZ 2.69Å; E145-K229 PolarHBondContact OE2-NZ 3.34Å; L212-K229 PolarHBondContact N-O 2.81Å; L212-K229 PolarHBondContact O-N 3.27Å
230	V	97.6	Very high	91.8	Very high	57 Å²	57	81.7 Å²	81.7	35%	0.345	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	129.2	176.9	-179.9	0	0	0	0	108.5	W209 H232	W209-V230 HydrophobicContact CE3-CG1 3.67Å; W209-V230 HydrophobicContact CZ3-CG1 4.1Å; V230-H232 PolarHBondContact O-N 3.39Å
231	I	97.2	Very high	90.4	Very high	0 Å²	0	90.1 Å²	90.1	0%	0	46%	0.461	C	S	.	.			trans	-78.7	115.1	174.8	-59.9	-59.5	0	0	0	109	I142 L148 L173 L203 H207 W209 Q210 L212 L233	I142-I231 HydrophobicContact CD1-CD1 3.78Å; L148-I231 HydrophobicContact CD1-CD1 4.14Å; L148-I231 HydrophobicContact CD1-CG2 4.32Å; L173-I231 HydrophobicContact CD1-CG1 3.79Å; L203-I231 HydrophobicContact CD2-CG2 4.22Å; H207-I231 HydrophobicContact CB-CG2 4.31Å; H207-I231 WeakPolarHBondContact O-CB 3.45Å; H207-I231 WeakPolarHBondContact O-CG2 3.47Å; W209-I231 WeakPolarHBondContact CA-O 3.4Å; W209-I231 PolarHBondContact N-O 3.4Å; Q210-I231 PolarHBondContact O-N 3.05Å; L212-I231 HydrophobicContact CB-CD1 4.22Å; L212-I231 HydrophobicContact CB-CG1 4.35Å; I231-L233 HydrophobicContact CG2-CD2 3.74Å; I231-L233 HydrophobicContact CG2-CG 4.19Å
232	H	96.4	Very high	90.2	Very high	94 Å²	94	92.9 Å²	92.9	44%	0.435	48%	0.477	S	S	.	.			trans	-114.6	121.6	172.9	-179.5	-104	0	0	0	109.4	L148 H208 W209 V230	L148-H232 WeakPolarHBondContact CB-O 3.31Å; H208-H232 AromaticContact CE1-CD2 3.53Å; H208-H232 AromaticContact CE1-NE2 3.9Å; W209-H232 AromaticContact CH2-CD2 3.83Å; W209-H232 AromaticContact CZ2-CD2 3.68Å; V230-H232 PolarHBondContact O-N 3.39Å
233	L	96.9	Very high	90	Very high	2 Å²	2	87.7 Å²	87.7	1%	0.01	46%	0.464	C	S	.	.			trans	-105.4	125.1	-177.7	-53.6	-178.9	0	0	0	108.7	L148 V150 L203 T204 H208 I231 D235 Y236	L148-L233 HydrophobicContact CB-CD2 3.88Å; L148-L233 WeakPolarHBondContact O-CA 3.31Å; V150-L233 HydrophobicContact CG2-CB 4.43Å; V150-L233 HydrophobicContact CG2-CD1 3.75Å; L203-L233 HydrophobicContact CB-CD2 4.14Å; L203-L233 HydrophobicContact CD1-CD2 3.71Å; L203-L233 HydrophobicContact CG-CD2 4.34Å; T204-L233 VanDerWaalsContact O-CD1 3.26Å; T204-L233 WeakPolarHBondContact O-CD1 3.37Å; H208-L233 HydrophobicContact CB-CD1 4.1Å; H208-L233 HydrophobicContact CB-CG 4.24Å; H208-L233 PolarHBondContact CE1-N 3.04Å; H208-L233 PolarHBondContact CE1-O 2.88Å; H208-L233 VanDerWaalsContact CE1-O 3.29Å; H208-L233 PolarHBondContact ND1-N 3.43Å; I231-L233 HydrophobicContact CG2-CD2 3.74Å; I231-L233 HydrophobicContact CG2-CG 4.19Å; L233-D235 VanDerWaalsContact C-N 3.3Å; L233-D235 PolarHBondContact O-N 2.95Å; L233-Y236 PolarHBondContact O-N 3.11Å
234	K	94.8	Very high	89.8	Confident	142 Å²	142	88.5 Å²	88.5	62%	0.617	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-24.4	-173.1	75	-170.1	-169.6	-149.7	0	114.3	S147 L148 S149	S147-K234 PolarHBondContact O-NZ 3.42Å; L148-K234 PolarHBondContact O-N 2.83Å; S149-K234 WeakPolarHBondContact OG-CD 3.43Å; S149-K234 WeakPolarHBondContact OG-CE 3.5Å; S149-K234 PolarHBondContact OG-NZ 3.38Å
235	D	92.3	Very high	89.6	Confident	73 Å²	73	90.9 Å²	90.9	39%	0.39	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	20.7	-175.9	61.1	-21.5	0	0	0	111.6	S149 V150 L233 A237	S149-D235 WeakPolarHBondContact CA-OD1 3.26Å; V150-D235 WeakPolarHBondContact CG2-OD1 3.47Å; V150-D235 VanDerWaalsContact N-CG 3.32Å; V150-D235 PolarHBondContact N-OD1 3.37Å; V150-D235 PolarHBondContact N-OD2 3.25Å; L233-D235 VanDerWaalsContact C-N 3.3Å; L233-D235 PolarHBondContact O-N 2.95Å; D235-A237 PolarHBondContact O-N 3.15Å
236	Y	90.5	Very high	89.2	Confident	97 Å²	97	92.7 Å²	92.7	38%	0.38	49%	0.487	S	S	.	.			trans	-59	120.7	174.2	172.5	-105.1	0	0	0	110.5	H208 L233 P238	H208-Y236 HydrophobicContact CB-CD2 3.46Å; H208-Y236 VanDerWaalsContact CB-CD2 3.46Å; H208-Y236 HydrophobicContact CB-CE2 3.86Å; H208-Y236 HydrophobicContact CB-CG 3.97Å; H208-Y236 AromaticContact CD2-CD1 3.32Å; H208-Y236 WeakPolarHBondContact CD2-CD1 3.5Å; H208-Y236 AromaticContact CD2-CD2 3.56Å; H208-Y236 AromaticContact CD2-CE1 3.67Å; H208-Y236 AromaticContact CD2-CE2 3.89Å; H208-Y236 AromaticContact CD2-CG 3.25Å; H208-Y236 AromaticContact CD2-CZ 3.94Å; H208-Y236 AromaticContact CE1-CG 3.96Å; H208-Y236 AromaticContact CG-CD2 3.54Å; H208-Y236 AromaticContact CG-CG 3.49Å; H208-Y236 VanDerWaalsContact CG-CG 3.49Å; H208-Y236 AromaticContact ND1-CG 3.91Å; H208-Y236 AromaticContact NE2-CD1 3.47Å; H208-Y236 WeakPolarHBondContact NE2-CD1 3.34Å; H208-Y236 AromaticContact NE2-CG 3.6Å; L233-Y236 PolarHBondContact O-N 3.11Å; Y236-P238 HydrophobicContact CD1-CG 4.49Å; Y236-P238 HydrophobicContact CE1-CB 4.35Å; Y236-P238 HydrophobicContact CE1-CG 3.82Å
237	A	84.3	Confident	88.7	Confident	61 Å²	61	91.1 Å²	91.1	50%	0.504	48%	0.484	S	S	.	.			trans	-110.6	119.5	169	0	0	0	0	0	108.1	D235 A239	D235-A237 PolarHBondContact O-N 3.15Å; A237-A239 PolarHBondContact O-N 3.22Å
238	P	78.7	Confident	88	Confident	86 Å²	86	94.6 Å²	94.6	56%	0.558	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-55.7	141	168.8	-15.7	26.8	0	0	0	109.2	Y236 E240	Y236-P238 HydrophobicContact CD1-CG 4.49Å; Y236-P238 HydrophobicContact CE1-CB 4.35Å; Y236-P238 HydrophobicContact CE1-CG 3.82Å; P238-E240 PolarHBondContact O-N 3.08Å
239	A	76.4	Confident	87.2	Confident	94 Å²	94	92.2 Å²	92.2	78%	0.777	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-60.3	122.2	164.5	0	0	0	0	0	107.6	A237 L241	A237-A239 PolarHBondContact O-N 3.22Å; A239-L241 PolarHBondContact O-N 3.31Å
240	E	73.8	Confident	86.3	Confident	194 Å²	194	95.6 Å²	95.6	91%	0.907	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-57.5	127.4	169.2	-71.3	179.4	164.5	0	0	107.9	P238	P238-E240 PolarHBondContact O-N 3.08Å
241	L	56.7	Low	85.3	Confident	247 Å²	247	99.1 Å²	99.1	100%	1.293	53%	0.534	S	S	*	.			trans	-65.7	0	179.5	-82.4	161.3	0	0	0	112	A239	A239-L241 PolarHBondContact O-N 3.31Å

Retrieved 241 of 241 residues in 179.8 ms (Link to these results)

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