A0A093GYV9_STRCA Loading...

Oligodendrocyte-myelin glycoprotein

Cell adhesion molecule contributing to the interactive process required for myelination in the central nervous system.

AlphaFold DB , UniProt , Accession A0A093GYV9, Species STRCA (Struthio camelus australis), Gene n/a, Length 440 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	47.1	Very low	49.3	Very low	223 Å²	223	131.2 Å²	131.2	100%	1.099	67%	0.674	S	S	*	*				0	5.5	0	-103.9	-179.6	-81.3	0	0	113.7
2	E	44.9	Very low	49.7	Very low	171 Å²	171	130.3 Å²	130.3	80%	0.799	67%	0.671	S	S	*	*			trans	-95.6	-17.7	-177	-65.6	-172.3	146.5	0	0	114.7
3	H	43.9	Very low	50.2	Low	169 Å²	169	127.7 Å²	127.7	78%	0.782	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-11.3	-174.8	-116.7	30.9	0	0	0	115.3
4	Q	45.4	Very low	50.6	Low	162 Å²	162	121.4 Å²	121.4	76%	0.757	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-25.1	175.2	-80.7	-138.4	-10.7	0	0	113.5	T8	Q4-T8 PolarHBondContact O-N 3.22Å; Q4-T8 PolarHBondContact O-OG1 3.26Å
5	I	50	Low	50.8	Low	122 Å²	122	120.5 Å²	120.5	63%	0.626	63%	0.63	S	S	*	*	H	α-helix	trans	-73.1	-31.4	-179.5	-58.9	173.2	0	0	0	111	T8 S9	I5-T8 PolarHBondContact O-OG1 2.94Å; I5-T8 VanDerWaalsContact O-OG1 3.08Å; I5-S9 PolarHBondContact O-N 3.16Å
6	L	46.4	Very low	51	Low	123 Å²	123	120.1 Å²	120.1	64%	0.644	63%	0.628	S	S	*	*	H	α-helix	trans	-74.3	-27.5	179.7	-156.9	69.8	0	0	0	113.2	T10	L6-T10 PolarHBondContact O-N 3.31Å; L6-T10 PolarHBondContact O-OG1 3.21Å
7	K	48.3	Very low	51.1	Low	163 Å²	163	123.2 Å²	123.2	71%	0.709	64%	0.636	S	S	*	*	H	α-helix	trans	-81.7	-31.6	178.7	-90.6	-177.2	175.3	179.3	0	113.6	S9 T10 C11	K7-S9 VanDerWaalsContact C-N 3.33Å; K7-T10 PolarHBondContact O-OG1 3.14Å; K7-T10 VanDerWaalsContact O-OG1 3.09Å; K7-C11 PolarHBondContact O-N 3.14Å
8	T	50.3	Low	51	Low	84 Å²	84	125.7 Å²	125.7	52%	0.515	64%	0.641	S	S	.	*	H	α-helix	trans	-71.5	-33	173.7	52	0	0	0	0	111	Q4 I5 L12	Q4-T8 PolarHBondContact O-N 3.22Å; Q4-T8 PolarHBondContact O-OG1 3.26Å; I5-T8 PolarHBondContact O-OG1 2.94Å; I5-T8 VanDerWaalsContact O-OG1 3.08Å; T8-L12 WeakPolarHBondContact O-CB 3.36Å; T8-L12 PolarHBondContact O-N 2.76Å
9	S	54.8	Low	51	Low	60 Å²	60	123.9 Å²	123.9	42%	0.42	63%	0.632	S	S	.	*	H	α-helix	trans	-66.6	-36.9	175	-170.1	0	0	0	0	113.7	I5 K7 L13	I5-S9 PolarHBondContact O-N 3.16Å; K7-S9 VanDerWaalsContact C-N 3.33Å; S9-L13 WeakPolarHBondContact O-CB 3.39Å; S9-L13 WeakPolarHBondContact O-CD1 3.46Å; S9-L13 PolarHBondContact O-N 3.14Å
10	T	57.3	Low	50.9	Low	86 Å²	86	123.1 Å²	123.1	53%	0.528	64%	0.636	S	S	.	*	H	α-helix	trans	-76.6	-30.4	178.4	50.1	0	0	0	0	112.7	L6 K7 A14	L6-T10 PolarHBondContact O-N 3.31Å; L6-T10 PolarHBondContact O-OG1 3.21Å; K7-T10 PolarHBondContact O-OG1 3.14Å; K7-T10 VanDerWaalsContact O-OG1 3.09Å; T10-A14 VanDerWaalsContact O-CB 3.25Å; T10-A14 WeakPolarHBondContact O-CB 3.46Å; T10-A14 PolarHBondContact O-N 3Å
11	C	53.6	Low	50.8	Low	80 Å²	80	121.2 Å²	121.2	54%	0.541	63%	0.63	S	S	.	*	H	α-helix	trans	-72.5	-37.3	173.6	-147.5	0	0	0	0	111.8	K7 A14 L15	K7-C11 PolarHBondContact O-N 3.14Å; C11-A14 PolarHBondContact O-N 2.77Å; C11-L15 WeakPolarHBondContact O-CB 3.47Å; C11-L15 PolarHBondContact O-N 3.02Å
12	L	54.3	Low	50.9	Low	120 Å²	120	117.8 Å²	117.8	63%	0.628	62%	0.621	S	S	*	*	H	α-helix	trans	-68.2	-39	172.9	-145.3	90.8	0	0	0	111.9	T8 L15 L16	T8-L12 WeakPolarHBondContact O-CB 3.36Å; T8-L12 PolarHBondContact O-N 2.76Å; L12-L15 PolarHBondContact O-N 3.15Å; L12-L16 WeakPolarHBondContact O-CG 3.48Å; L12-L16 PolarHBondContact O-N 3.33Å
13	L	55.9	Low	51.2	Low	97 Å²	97	115.4 Å²	115.4	51%	0.508	61%	0.613	S	S	.	*	H	α-helix	trans	-65.5	-41.2	171.5	-110	89.9	0	0	0	111.8	S9 L16 F17	S9-L13 WeakPolarHBondContact O-CB 3.39Å; S9-L13 WeakPolarHBondContact O-CD1 3.46Å; S9-L13 PolarHBondContact O-N 3.14Å; L13-L16 WeakPolarHBondContact O-CB 3.27Å; L13-L16 PolarHBondContact O-N 3.41Å; L13-L16 VanDerWaalsContact O-N 3.17Å; L13-F17 WeakPolarHBondContact O-CD2 3.48Å; L13-F17 PolarHBondContact O-N 2.81Å
14	A	55.7	Low	51.9	Low	40 Å²	40	108.2 Å²	108.2	33%	0.331	59%	0.585	S	S	.	*	H	α-helix	trans	-66.2	-38.4	176.2	0	0	0	0	0	111.6	T10 C11 L16 F17 F18	T10-A14 VanDerWaalsContact O-CB 3.25Å; T10-A14 WeakPolarHBondContact O-CB 3.46Å; T10-A14 PolarHBondContact O-N 3Å; C11-A14 PolarHBondContact O-N 2.77Å; A14-L16 VanDerWaalsContact C-N 3.29Å; A14-L16 PolarHBondContact O-N 3.17Å; A14-F17 CarbonylContact O-C 3.53Å; A14-F17 WeakPolarHBondContact O-CA 3.45Å; A14-F17 WeakPolarHBondContact O-CB 3.32Å; A14-F17 PolarHBondContact O-N 2.89Å; A14-F18 WeakPolarHBondContact O-CD2 3.43Å; A14-F18 PolarHBondContact O-N 3.29Å
15	L	53.6	Low	53.3	Low	107 Å²	107	106.3 Å²	106.3	56%	0.56	58%	0.579	S	S	*	*	H	α-helix	trans	-62.4	-34.2	170.7	-91.2	153.2	0	0	0	112	C11 L12 F17 F18 I19	C11-L15 WeakPolarHBondContact O-CB 3.47Å; C11-L15 PolarHBondContact O-N 3.02Å; L12-L15 PolarHBondContact O-N 3.15Å; L15-F17 VanDerWaalsContact C-N 3.32Å; L15-F17 PolarHBondContact O-N 3.46Å; L15-F18 CarbonylContact O-C 3.44Å; L15-F18 PolarHBondContact O-N 3.49Å; L15-I19 VanDerWaalsContact O-CG1 3.29Å; L15-I19 WeakPolarHBondContact O-CG1 3.49Å; L15-I19 PolarHBondContact O-N 3.29Å
16	L	54.4	Low	55	Low	115 Å²	115	102.3 Å²	102.3	60%	0.602	56%	0.561	S	S	*	*	H	α-helix	trans	-70	-24.4	171.3	-76.9	161.7	0	0	0	113.6	L12 L13 A14 I19	L12-L16 WeakPolarHBondContact O-CG 3.48Å; L12-L16 PolarHBondContact O-N 3.33Å; L13-L16 WeakPolarHBondContact O-CB 3.27Å; L13-L16 PolarHBondContact O-N 3.41Å; L13-L16 VanDerWaalsContact O-N 3.17Å; A14-L16 VanDerWaalsContact C-N 3.29Å; A14-L16 PolarHBondContact O-N 3.17Å; L16-I19 HydrophobicContact CD2-CD1 4.27Å
17	F	52.8	Low	57	Low	173 Å²	173	97 Å²	97	76%	0.759	53%	0.534	S	S	*	.	H	α-helix	trans	-83	-21.9	170.6	-89	-84	0	0	0	113.4	L13 A14 L15	L13-F17 WeakPolarHBondContact O-CD2 3.48Å; L13-F17 PolarHBondContact O-N 2.81Å; A14-F17 CarbonylContact O-C 3.53Å; A14-F17 WeakPolarHBondContact O-CA 3.45Å; A14-F17 WeakPolarHBondContact O-CB 3.32Å; A14-F17 PolarHBondContact O-N 2.89Å; L15-F17 VanDerWaalsContact C-N 3.32Å; L15-F17 PolarHBondContact O-N 3.46Å
18	F	49.5	Very low	58.8	Low	167 Å²	167	94.6 Å²	94.6	73%	0.732	54%	0.538	S	S	*	.	H	α-helix	trans	-108.1	6.7	178.7	-73.9	-68.6	0	0	0	114.5	A14 L15 P20	A14-F18 WeakPolarHBondContact O-CD2 3.43Å; A14-F18 PolarHBondContact O-N 3.29Å; L15-F18 CarbonylContact O-C 3.44Å; L15-F18 PolarHBondContact O-N 3.49Å; F18-P20 VanDerWaalsContact C-CD 3.46Å; F18-P20 WeakPolarHBondContact O-CD 3.43Å
19	I	51	Low	60.7	Low	93 Å²	93	94.3 Å²	94.3	48%	0.477	53%	0.533	S	S	.	.	S	Bend	trans	-75.2	99.7	149	-63.7	159.3	0	0	0	102.6	L15 L16 T21	L15-I19 VanDerWaalsContact O-CG1 3.29Å; L15-I19 WeakPolarHBondContact O-CG1 3.49Å; L15-I19 PolarHBondContact O-N 3.29Å; L16-I19 HydrophobicContact CD2-CD1 4.27Å; I19-T21 PolarHBondContact O-N 3.23Å
20	P	48.1	Very low	62.5	Low	107 Å²	107	92 Å²	92	70%	0.695	52%	0.516	S	S	*	.			trans	-57.3	106.1	155	27.6	-30.2	0	0	0	102.1	F18 V22	F18-P20 VanDerWaalsContact C-CD 3.46Å; F18-P20 WeakPolarHBondContact O-CD 3.43Å; P20-V22 PolarHBondContact O-N 2.77Å
21	T	49.3	Very low	64.3	Low	84 Å²	84	92 Å²	92	52%	0.515	52%	0.516	S	S	.	.			trans	-42.4	120.2	172	42.5	0	0	0	0	105.7	I19 L23	I19-T21 PolarHBondContact O-N 3.23Å; T21-L23 HydrophobicContact CG2-CD1 4.03Å; T21-L23 PolarHBondContact O-N 2.86Å
22	V	49.6	Very low	66.1	Low	151 Å²	151	89.5 Å²	89.5	92%	0.915	50%	0.5	S	S	*	.	S	Bend	trans	-67.5	45.6	166	-173	0	0	0	0	107.8	P20	P20-V22 PolarHBondContact O-N 2.77Å
23	L	51.7	Low	67.9	Low	121 Å²	121	87.1 Å²	87.1	63%	0.634	49%	0.493	S	S	*	.			trans	-96.3	101.1	167	-89.4	159.1	0	0	0	102.1	T21 I25	T21-L23 HydrophobicContact CG2-CD1 4.03Å; T21-L23 PolarHBondContact O-N 2.86Å; L23-I25 WeakPolarHBondContact O-CG1 3.32Å; L23-I25 PolarHBondContact O-N 3.36Å
24	G	58.4	Low	69.2	Low	18 Å²	18	84.8 Å²	84.8	19%	0.186	49%	0.493	C	S	.	.			trans	-50.6	112.8	170.9	0	0	0	0	0	108.1	C26 N36	G24-C26 PolarHBondContact O-N 3.02Å; G24-C26 VanDerWaalsContact O-N 3.16Å; G24-N36 PolarHBondContact O-ND2 3.19Å
25	I	74.6	Confident	70.5	Confident	122 Å²	122	89.9 Å²	89.9	63%	0.626	51%	0.514	S	S	*	.			trans	-78	108.9	-179.9	-63.7	172.6	0	0	0	105.3	L23	L23-I25 WeakPolarHBondContact O-CG1 3.32Å; L23-I25 PolarHBondContact O-N 3.36Å
26	C	85.6	Confident	71.7	Confident	38 Å²	38	86.5 Å²	86.5	26%	0.257	50%	0.496	S	S	.	.			trans	-61.7	130.9	169.5	-172.5	0	0	0	0	108.4	G24 S28 C32	G24-C26 PolarHBondContact O-N 3.02Å; G24-C26 VanDerWaalsContact O-N 3.16Å; C26-S28 PolarHBondContact O-N 3.16Å; C26-C32 VanDerWaalsContact CA-SG 3.51Å; C26-C32 HydrophobicContact CB-CB 3.57Å; C26-C32 WeakPolarHBondContact CB-SG 3.3Å; C26-C32 WeakPolarHBondContact SG-CB 3.3Å; C26-C32 PolarHBondContact SG-N 3.28Å; C26-C32 CovalentContact SG-SG 2.03Å; C26-C32 PolarHBondContact SG-SG 3.14Å
27	P	88.8	Confident	73.4	Confident	12 Å²	12	87 Å²	87	8%	0.078	49%	0.49	C	S	.	.			trans	-58	140.6	174.9	-19.8	29.5	0	0	0	110.8	N29 C30 P50 H51 L53	P27-N29 PolarHBondContact O-N 3.39Å; P27-N29 VanDerWaalsContact O-N 3.08Å; P27-C30 HydrophobicContact CB-CB 4.3Å; P27-C30 HydrophobicContact CG-CB 4.47Å; P27-C30 PolarHBondContact O-N 3.27Å; P27-C30 VanDerWaalsContact O-O 3.12Å; P27-P50 HydrophobicContact CB-CB 3.74Å; P27-P50 HydrophobicContact CB-CG 4.31Å; P27-P50 HydrophobicContact CG-CB 4.02Å; P27-P50 HydrophobicContact CG-CG 4.21Å; P27-H51 WeakPolarHBondContact CG-O 3.19Å; P27-L53 HydrophobicContact CG-CD2 3.88Å; P27-L53 HydrophobicContact CG-CG 4.2Å
28	S	86.2	Confident	75.4	Confident	112 Å²	112	81.7 Å²	81.7	78%	0.783	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-28.9	-179.3	57.6	0	0	0	0	113.5	C26 C30	C26-S28 PolarHBondContact O-N 3.16Å; S28-C30 VanDerWaalsContact C-N 3.26Å; S28-C30 PolarHBondContact O-N 3.16Å
29	N	89.3	Confident	77.6	Confident	77 Å²	77	73.9 Å²	73.9	41%	0.412	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-1.5	-179.4	-63.6	-0.6	0	0	0	112.5	P27 R44 L46	P27-N29 PolarHBondContact O-N 3.39Å; P27-N29 VanDerWaalsContact O-N 3.08Å; N29-R44 WeakPolarHBondContact O-CD 3.46Å; N29-R44 WeakPolarHBondContact O-CG 3.31Å; N29-R44 PolarHBondContact O-NE 3.26Å; N29-R44 PolarHBondContact O-NH1 2.71Å; N29-L46 HydrophobicContact CB-CD2 4.29Å
30	C	93.3	Very high	79.8	Confident	11 Å²	11	72.2 Å²	72.2	7%	0.074	43%	0.428	C	S	.	.	S	Bend	trans	-125.6	164.4	-176.9	-53.7	0	0	0	0	111.2	P27 S28 V39 D40 C41 P50	P27-C30 HydrophobicContact CB-CB 4.3Å; P27-C30 HydrophobicContact CG-CB 4.47Å; P27-C30 PolarHBondContact O-N 3.27Å; P27-C30 VanDerWaalsContact O-O 3.12Å; S28-C30 VanDerWaalsContact C-N 3.26Å; S28-C30 PolarHBondContact O-N 3.16Å; C30-V39 HydrophobicContact CB-CG1 3.98Å; C30-D40 CarbonylContact C-O 3.45Å; C30-D40 VanDerWaalsContact CA-O 3.28Å; C30-D40 WeakPolarHBondContact CA-O 3.19Å; C30-D40 WeakPolarHBondContact CB-O 3.28Å; C30-C41 HydrophobicContact CB-CB 4.06Å; C30-C41 WeakPolarHBondContact CB-SG 3.32Å; C30-C41 WeakPolarHBondContact SG-CB 3.18Å; C30-C41 CovalentContact SG-SG 2.03Å; C30-C41 PolarHBondContact SG-SG 3.4Å; C30-P50 VanDerWaalsContact SG-CG 3.55Å
31	T	93.8	Very high	82.1	Confident	86 Å²	86	67.1 Å²	67.1	53%	0.528	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	125.3	172.4	-59.6	0	0	0	0	107.9	D40 R44	T31-D40 PolarHBondContact N-O 3.04Å; T31-D40 PolarHBondContact O-N 3.46Å; T31-R44 PolarHBondContact OG1-NH2 3.36Å
32	C	93.1	Very high	84.4	Confident	29 Å²	29	64.7 Å²	64.7	20%	0.196	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	141.5	-178.2	-52.8	0	0	0	0	110.6	C26 N36 N38	C26-C32 VanDerWaalsContact CA-SG 3.51Å; C26-C32 HydrophobicContact CB-CB 3.57Å; C26-C32 WeakPolarHBondContact CB-SG 3.3Å; C26-C32 WeakPolarHBondContact SG-CB 3.3Å; C26-C32 PolarHBondContact SG-N 3.28Å; C26-C32 CovalentContact SG-SG 2.03Å; C26-C32 PolarHBondContact SG-SG 3.14Å; C32-N36 HydrophobicContact CB-CB 4.27Å; C32-N36 WeakPolarHBondContact CB-OD1 2.98Å; C32-N38 CarbonylContact C-O 3.24Å; C32-N38 WeakPolarHBondContact CA-O 3.16Å
33	S	91.8	Very high	86.6	Confident	70 Å²	70	59.8 Å²	59.8	49%	0.49	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	170.1	177.8	62.9	0	0	0	0	110.8	N36 R37 N38	S33-N36 PolarHBondContact O-N 3.46Å; S33-R37 PolarHBondContact O-N 2.02Å; S33-N38 PolarHBondContact N-O 2.83Å; S33-N38 PolarHBondContact O-N 3.39Å; S33-N38 WeakPolarHBondContact OG-CB 3.44Å
34	G	82.8	Confident	88.7	Confident	48 Å²	48	58.9 Å²	58.9	50%	0.495	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	52.2	177.1	0	0	0	0	0	112.9	N36 R37	G34-N36 VanDerWaalsContact C-N 3.28Å; G34-N36 PolarHBondContact O-N 3.4Å; G34-R37 WeakPolarHBondContact O-CB 3.47Å; G34-R37 WeakPolarHBondContact O-CG 2.88Å; G34-R37 PolarHBondContact O-N 3.13Å
35	N	82.1	Confident	90.5	Very high	146 Å²	146	63.6 Å²	63.6	78%	0.781	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	40.8	-174	-59.3	-19.9	0	0	0	113	R37	N35-R37 PolarHBondContact O-N 2.94Å
36	N	80.6	Confident	91.5	Very high	36 Å²	36	58.4 Å²	58.4	19%	0.193	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.4	20.1	-178.2	-53.2	-52.6	0	0	0	115.7	G24 C32 S33 G34 Q54 I57	G24-N36 PolarHBondContact O-ND2 3.19Å; C32-N36 HydrophobicContact CB-CB 4.27Å; C32-N36 WeakPolarHBondContact CB-OD1 2.98Å; S33-N36 PolarHBondContact O-N 3.46Å; G34-N36 VanDerWaalsContact C-N 3.28Å; G34-N36 PolarHBondContact O-N 3.4Å; N36-Q54 HydrophobicContact CB-CG 4.48Å; N36-I57 WeakPolarHBondContact O-CG2 3.39Å
37	R	89.1	Confident	91.9	Very high	125 Å²	125	60.6 Å²	60.6	47%	0.472	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-25.3	175.2	-64.2	-177.1	178.3	-159.2	-0.3	113	S33 G34 N35 I57 T58 Y59	S33-R37 PolarHBondContact O-N 2.02Å; G34-R37 WeakPolarHBondContact O-CB 3.47Å; G34-R37 WeakPolarHBondContact O-CG 2.88Å; G34-R37 PolarHBondContact O-N 3.13Å; N35-R37 PolarHBondContact O-N 2.94Å; R37-I57 CarbonylContact O-C 3.09Å; R37-I57 WeakPolarHBondContact O-CA 3.49Å; R37-T58 PolarHBondContact O-N 3.18Å; R37-T58 PolarHBondContact O-OG1 2.93Å; R37-Y59 PolarHBondContact O-N 3.24Å; R37-Y59 VanDerWaalsContact O-N 3.15Å
38	N	95.2	Very high	92.2	Very high	63 Å²	63	64.9 Å²	64.9	34%	0.337	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	110.1	178.2	-67.5	57	0	0	0	107.9	C32 S33 Y59	C32-N38 CarbonylContact C-O 3.24Å; C32-N38 WeakPolarHBondContact CA-O 3.16Å; S33-N38 PolarHBondContact N-O 2.83Å; S33-N38 PolarHBondContact O-N 3.39Å; S33-N38 WeakPolarHBondContact OG-CB 3.44Å; N38-Y59 HydrophobicContact CB-CD1 4.36Å
39	V	95.8	Very high	92.5	Very high	3 Å²	3	60.5 Å²	60.5	2%	0.018	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	123.8	-175.6	-175.2	0	0	0	0	110	C30 L53 I57 Y59 L60 N61	C30-V39 HydrophobicContact CB-CG1 3.98Å; V39-L53 HydrophobicContact CB-CD2 4.36Å; V39-L53 HydrophobicContact CG1-CD2 3.62Å; V39-L53 HydrophobicContact CG2-CD2 4.38Å; V39-I57 HydrophobicContact CG2-CG2 3.63Å; V39-Y59 PolarHBondContact N-O 3.29Å; V39-L60 HydrophobicContact CB-CD1 4.04Å; V39-L60 HydrophobicContact CG1-CD1 4.15Å; V39-L60 WeakPolarHBondContact O-CA 3.37Å; V39-N61 PolarHBondContact O-N 3.23Å
40	D	96.9	Very high	92.6	Very high	58 Å²	58	57.5 Å²	57.5	31%	0.31	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	112.3	175.4	-170.3	-8.9	0	0	0	110.6	C30 T31 S42 N61	C30-D40 CarbonylContact C-O 3.45Å; C30-D40 VanDerWaalsContact CA-O 3.28Å; C30-D40 WeakPolarHBondContact CA-O 3.19Å; C30-D40 WeakPolarHBondContact CB-O 3.28Å; T31-D40 PolarHBondContact N-O 3.04Å; T31-D40 PolarHBondContact O-N 3.46Å; D40-S42 VanDerWaalsContact OD1-CB 3.24Å; D40-S42 WeakPolarHBondContact OD1-CB 3.44Å; D40-S42 PolarHBondContact OD1-N 3.34Å; D40-S42 PolarHBondContact OD1-OG 3.23Å; D40-N61 HydrophobicContact CB-CB 4.44Å; D40-N61 PolarHBondContact OD1-ND2 3.2Å
41	C	96.2	Very high	92.3	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	36%	0.362	C	S	.	.			trans	-116.1	22.3	176.8	-56	0	0	0	0	111.3	C30 R44 L46 N61 L62 N65	C30-C41 HydrophobicContact CB-CB 4.06Å; C30-C41 WeakPolarHBondContact CB-SG 3.32Å; C30-C41 WeakPolarHBondContact SG-CB 3.18Å; C30-C41 CovalentContact SG-SG 2.03Å; C30-C41 PolarHBondContact SG-SG 3.4Å; C41-R44 WeakPolarHBondContact O-CG 3.21Å; C41-L46 HydrophobicContact CB-CD1 3.78Å; C41-N61 CarbonylContact C-O 3.36Å; C41-N61 WeakPolarHBondContact CA-O 3.49Å; C41-N61 PolarHBondContact N-O 3.38Å; C41-L62 HydrophobicContact CB-CD2 4.04Å; C41-N65 PolarHBondContact O-ND2 3.09Å
42	S	97.4	Very high	91.9	Very high	32 Å²	32	62.4 Å²	62.4	22%	0.224	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	144.7	-174.8	61.6	0	0	0	0	113.5	D40 R44 N61 S63	D40-S42 VanDerWaalsContact OD1-CB 3.24Å; D40-S42 WeakPolarHBondContact OD1-CB 3.44Å; D40-S42 PolarHBondContact OD1-N 3.34Å; D40-S42 PolarHBondContact OD1-OG 3.23Å; S42-R44 WeakPolarHBondContact O-CG 3.26Å; S42-N61 PolarHBondContact OG-ND2 3.04Å; S42-S63 CarbonylContact C-O 3.03Å; S42-S63 WeakPolarHBondContact CA-O 3.45Å; S42-S63 VanDerWaalsContact CB-O 3.26Å; S42-S63 WeakPolarHBondContact CB-O 3.48Å; S42-S63 WeakPolarHBondContact CB-OG 3.22Å
43	G	96.6	Very high	91.8	Very high	48 Å²	48	61.3 Å²	61.3	50%	0.495	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	30.3	173.8	0	0	0	0	0	114.5	S63 F64	G43-S63 PolarHBondContact N-O 3.09Å; G43-F64 WeakPolarHBondContact CA-O 3.31Å; G43-F64 PolarHBondContact N-O 3.2Å
44	R	95.3	Very high	91.6	Very high	102 Å²	102	61.3 Å²	61.3	39%	0.385	34%	0.339	S	S	.	.	S	Bend	trans	-114.2	11.3	-169.9	-58.5	-63.7	-176.5	116.5	6.5	113.7	N29 T31 C41 S42 L46 N65	N29-R44 WeakPolarHBondContact O-CD 3.46Å; N29-R44 WeakPolarHBondContact O-CG 3.31Å; N29-R44 PolarHBondContact O-NE 3.26Å; N29-R44 PolarHBondContact O-NH1 2.71Å; T31-R44 PolarHBondContact OG1-NH2 3.36Å; C41-R44 WeakPolarHBondContact O-CG 3.21Å; S42-R44 WeakPolarHBondContact O-CG 3.26Å; R44-L46 HydrophobicContact CB-CD1 3.97Å; R44-L46 HydrophobicContact CB-CD2 4.27Å; R44-L46 HydrophobicContact CB-CG 3.74Å; R44-L46 PolarHBondContact O-N 2.77Å; R44-N65 PolarHBondContact N-OD1 2.8Å
45	N	95.4	Very high	92	Very high	117 Å²	117	63 Å²	63	63%	0.626	34%	0.337	S	S	*	.			trans	51.7	34.8	-176.7	-61.2	-35.3	0	0	0	112.9	N65	N45-N65 PolarHBondContact N-OD1 3.06Å; N45-N65 VanDerWaalsContact N-OD1 3.12Å
46	L	95.4	Very high	92.4	Very high	14 Å²	14	59.1 Å²	59.1	7%	0.073	32%	0.317	C	S	.	.			trans	-75.6	135.2	-178.5	-60.4	169.8	0	0	0	110.4	N29 C41 R44 N65 Q66 F67	N29-L46 HydrophobicContact CB-CD2 4.29Å; C41-L46 HydrophobicContact CB-CD1 3.78Å; R44-L46 HydrophobicContact CB-CD1 3.97Å; R44-L46 HydrophobicContact CB-CD2 4.27Å; R44-L46 HydrophobicContact CB-CG 3.74Å; R44-L46 PolarHBondContact O-N 2.77Å; L46-N65 HydrophobicContact CB-CB 4.23Å; L46-N65 WeakPolarHBondContact CB-OD1 3.42Å; L46-N65 PolarHBondContact N-OD1 3.25Å; L46-Q66 CarbonylContact O-C 3.57Å; L46-Q66 WeakPolarHBondContact O-CA 3.4Å; L46-Q66 PolarHBondContact O-N 3.31Å; L46-F67 HydrophobicContact CB-CE2 3.99Å; L46-F67 HydrophobicContact CB-CZ 3.73Å
47	T	95.3	Very high	93.1	Very high	83 Å²	83	57.4 Å²	57.4	51%	0.509	31%	0.307	S	S	.	.	S	Bend	trans	-107	-20.1	170.6	54.8	0	0	0	0	112.1	Q66 F67	T47-Q66 HydrophobicContact CG2-CB 3.95Å; T47-F67 WeakPolarHBondContact O-CD1 3.42Å
48	I	93.9	Very high	93.4	Very high	103 Å²	103	53.4 Å²	53.4	53%	0.528	30%	0.297	S	S	.	.	S	Bend	trans	-131.6	151.9	-179.9	61.8	169.2	0	0	0	110.2
49	L	93.4	Very high	93.6	Very high	20 Å²	20	53.8 Å²	53.8	11%	0.105	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-63.1	133	176.4	-77.2	177	0	0	0	109.9	L53 L62 F67 L70 Q73 L74 F77	L49-L53 HydrophobicContact CD2-CD1 4.31Å; L49-L62 HydrophobicContact CD2-CD1 3.51Å; L49-L62 HydrophobicContact CD2-CD2 3.81Å; L49-L62 HydrophobicContact CD2-CG 4.33Å; L49-F67 HydrophobicContact CD2-CE1 4.47Å; L49-F67 HydrophobicContact CD2-CZ 4.31Å; L49-L70 HydrophobicContact CD1-CD2 4.35Å; L49-L70 HydrophobicContact CD2-CD2 4.2Å; L49-L70 HydrophobicContact CG-CD2 3.96Å; L49-Q73 HydrophobicContact CD1-CB 3.54Å; L49-L74 HydrophobicContact CD1-CD2 4.22Å; L49-F77 HydrophobicContact CD1-CE2 4.48Å
50	P	90.6	Very high	93.6	Very high	14 Å²	14	53.6 Å²	53.6	9%	0.091	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-66	139	-178.9	23.7	-29.7	0	0	0	111.4	P27 C30 L53	P27-P50 HydrophobicContact CB-CB 3.74Å; P27-P50 HydrophobicContact CB-CG 4.31Å; P27-P50 HydrophobicContact CG-CB 4.02Å; P27-P50 HydrophobicContact CG-CG 4.21Å; C30-P50 VanDerWaalsContact SG-CG 3.55Å; P50-L53 HydrophobicContact CG-CD1 4.05Å; P50-L53 HydrophobicContact CG-CD2 4.35Å; P50-L53 HydrophobicContact CG-CG 4.14Å; P50-L53 WeakPolarHBondContact O-CG 3.16Å
51	H	87.1	Confident	93.7	Very high	163 Å²	163	51.5 Å²	51.5	76%	0.755	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	146.1	173.5	-58.3	-70.5	0	0	0	110.6	P27	P27-H51 WeakPolarHBondContact CG-O 3.19Å
52	G	85.5	Confident	93.8	Very high	36 Å²	36	51.5 Å²	51.5	37%	0.371	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.4	-5.4	177.7	0	0	0	0	0	116	Q54	G52-Q54 PolarHBondContact O-N 3.32Å; G52-Q54 PolarHBondContact O-NE2 3.16Å; G52-Q54 VanDerWaalsContact O-NE2 3.17Å
53	L	90.5	Very high	93.8	Very high	7 Å²	7	50.2 Å²	50.2	4%	0.037	27%	0.272	C	S	.	.			trans	-54.4	132.6	171.4	-68.8	175.6	0	0	0	111.1	P27 V39 L49 P50 L60 R76 F77	P27-L53 HydrophobicContact CG-CD2 3.88Å; P27-L53 HydrophobicContact CG-CG 4.2Å; V39-L53 HydrophobicContact CB-CD2 4.36Å; V39-L53 HydrophobicContact CG1-CD2 3.62Å; V39-L53 HydrophobicContact CG2-CD2 4.38Å; L49-L53 HydrophobicContact CD2-CD1 4.31Å; P50-L53 HydrophobicContact CG-CD1 4.05Å; P50-L53 HydrophobicContact CG-CD2 4.35Å; P50-L53 HydrophobicContact CG-CG 4.14Å; P50-L53 WeakPolarHBondContact O-CG 3.16Å; L53-L60 HydrophobicContact CD2-CD1 4.46Å; L53-R76 PolarHBondContact O-NH2 2.88Å; L53-F77 HydrophobicContact CB-CE1 4.03Å; L53-F77 HydrophobicContact CB-CZ 4.05Å; L53-F77 HydrophobicContact CD1-CZ 3.98Å
54	Q	89.1	Confident	93.9	Very high	69 Å²	69	53.8 Å²	53.8	32%	0.322	28%	0.275	S	S	.	.			trans	-81.2	150.5	179.6	-58.8	-63.5	-53	0	0	110.9	N36 G52 N56 I57 F77	N36-Q54 HydrophobicContact CB-CG 4.48Å; G52-Q54 PolarHBondContact O-N 3.32Å; G52-Q54 PolarHBondContact O-NE2 3.16Å; G52-Q54 VanDerWaalsContact O-NE2 3.17Å; Q54-N56 VanDerWaalsContact C-N 3.29Å; Q54-N56 VanDerWaalsContact CB-OD1 3.31Å; Q54-N56 WeakPolarHBondContact CB-OD1 3.43Å; Q54-N56 PolarHBondContact O-N 2.97Å; Q54-I57 HydrophobicContact CB-CG2 4.31Å; Q54-I57 WeakPolarHBondContact O-CG1 3.4Å; Q54-I57 VanDerWaalsContact O-CG2 3.28Å; Q54-I57 WeakPolarHBondContact O-CG2 3.34Å; Q54-F77 WeakPolarHBondContact O-CD1 3.19Å; Q54-F77 WeakPolarHBondContact O-CE1 3.34Å
55	D	90.5	Very high	94	Very high	83 Å²	83	49.3 Å²	49.3	44%	0.444	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-15.5	-178.7	-66.4	-14.5	0	0	0	113.2	I57 R76	D55-I57 VanDerWaalsContact C-N 3.32Å; D55-R76 IonicContact OD1-CZ 2.71Å; D55-R76 IonicContact OD1-NE 3.78Å; D55-R76 PolarHBondContact OD1-NE 2.76Å; D55-R76 IonicContact OD1-NH2 3.69Å
56	N	91	Very high	94.1	Very high	66 Å²	66	46.7 Å²	46.7	35%	0.353	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	11.9	-179.9	71.2	-10.3	0	0	0	113.8	Q54	Q54-N56 VanDerWaalsContact C-N 3.29Å; Q54-N56 VanDerWaalsContact CB-OD1 3.31Å; Q54-N56 WeakPolarHBondContact CB-OD1 3.43Å; Q54-N56 PolarHBondContact O-N 2.97Å
57	I	94.5	Very high	94.2	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.239	C	C	.	.			trans	-61.4	141.7	176.7	60.3	175.7	0	0	0	111	N36 R37 V39 Q54 D55 L60 F77 N79 L80	N36-I57 WeakPolarHBondContact O-CG2 3.39Å; R37-I57 CarbonylContact O-C 3.09Å; R37-I57 WeakPolarHBondContact O-CA 3.49Å; V39-I57 HydrophobicContact CG2-CG2 3.63Å; Q54-I57 HydrophobicContact CB-CG2 4.31Å; Q54-I57 WeakPolarHBondContact O-CG1 3.4Å; Q54-I57 VanDerWaalsContact O-CG2 3.28Å; Q54-I57 WeakPolarHBondContact O-CG2 3.34Å; D55-I57 VanDerWaalsContact C-N 3.32Å; I57-L60 HydrophobicContact CD1-CB 4.06Å; I57-L60 HydrophobicContact CD1-CD1 4.34Å; I57-L60 HydrophobicContact CD1-CD2 3.96Å; I57-L60 HydrophobicContact CD1-CG 4.34Å; I57-F77 HydrophobicContact CD1-CB 4.26Å; I57-F77 HydrophobicContact CD1-CD1 3.36Å; I57-F77 HydrophobicContact CD1-CD2 4.14Å; I57-F77 HydrophobicContact CD1-CE1 3.59Å; I57-F77 HydrophobicContact CD1-CE2 4.35Å; I57-F77 HydrophobicContact CD1-CG 3.67Å; I57-F77 HydrophobicContact CD1-CZ 4.09Å; I57-F77 HydrophobicContact CG1-CB 4.06Å; I57-F77 HydrophobicContact CG1-CD1 3.53Å; I57-F77 HydrophobicContact CG1-CE1 4.16Å; I57-F77 HydrophobicContact CG1-CG 3.92Å; I57-N79 CarbonylContact O-C 3.1Å; I57-N79 VanDerWaalsContact O-C 3.24Å; I57-L80 HydrophobicContact CD1-CD1 4.17Å; I57-L80 HydrophobicContact CG1-CD1 4.07Å; I57-L80 WeakPolarHBondContact O-CA 3.47Å; I57-L80 PolarHBondContact O-N 3.13Å
58	T	96.6	Very high	94.2	Very high	40 Å²	40	46.5 Å²	46.5	25%	0.245	24%	0.237	C	C	.	.	S	Bend	trans	-111	-25.3	178.5	54	0	0	0	0	112	R37 R81 T82	R37-T58 PolarHBondContact O-N 3.18Å; R37-T58 PolarHBondContact O-OG1 2.93Å; T58-R81 WeakPolarHBondContact O-CB 3.16Å; T58-R81 PolarHBondContact O-N 2.97Å; T58-T82 PolarHBondContact O-N 2.69Å; T58-T82 VanDerWaalsContact O-N 3.12Å
59	Y	97.5	Very high	94.2	Very high	71 Å²	71	45.7 Å²	45.7	28%	0.278	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	128.4	177.7	173.5	-87	0	0	0	109.4	R37 N38 V39 N61 T82	R37-Y59 PolarHBondContact O-N 3.24Å; R37-Y59 VanDerWaalsContact O-N 3.15Å; N38-Y59 HydrophobicContact CB-CD1 4.36Å; V39-Y59 PolarHBondContact N-O 3.29Å; Y59-N61 HydrophobicContact CE1-CB 3.73Å; Y59-T82 WeakPolarHBondContact CA-O 3.4Å; Y59-T82 HydrophobicContact CD2-CG2 3.73Å; Y59-T82 HydrophobicContact CE2-CG2 3.82Å
60	L	97.5	Very high	94.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	116.8	177.3	-178.4	58.8	0	0	0	110.2	V39 L53 I57 L62 L74 F77 L80 T82 L83 D84	V39-L60 HydrophobicContact CB-CD1 4.04Å; V39-L60 HydrophobicContact CG1-CD1 4.15Å; V39-L60 WeakPolarHBondContact O-CA 3.37Å; L53-L60 HydrophobicContact CD2-CD1 4.46Å; I57-L60 HydrophobicContact CD1-CB 4.06Å; I57-L60 HydrophobicContact CD1-CD1 4.34Å; I57-L60 HydrophobicContact CD1-CD2 3.96Å; I57-L60 HydrophobicContact CD1-CG 4.34Å; L60-L62 HydrophobicContact CD1-CD2 4.02Å; L60-L62 HydrophobicContact CD1-CG 4.25Å; L60-L62 HydrophobicContact CD2-CD1 3.96Å; L60-L62 HydrophobicContact CD2-CD2 4.45Å; L60-L62 HydrophobicContact CD2-CG 4.17Å; L60-L62 HydrophobicContact CG-CD1 4.25Å; L60-L62 HydrophobicContact CG-CD2 4.23Å; L60-L62 HydrophobicContact CG-CG 3.92Å; L60-L74 HydrophobicContact CD2-CD2 4.18Å; L60-F77 HydrophobicContact CD2-CE2 4.3Å; L60-L80 HydrophobicContact CB-CD1 3.66Å; L60-L80 HydrophobicContact CB-CD2 4.49Å; L60-T82 PolarHBondContact N-O 3.33Å; L60-L83 HydrophobicContact CB-CD1 4.15Å; L60-L83 HydrophobicContact CD2-CD1 4.07Å; L60-L83 HydrophobicContact CG-CD1 4.16Å; L60-L83 WeakPolarHBondContact O-CA 3.37Å; L60-D84 PolarHBondContact O-N 3.48Å
61	N	98.1	Very high	94.3	Very high	13 Å²	13	46.4 Å²	46.4	7%	0.07	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	113.8	173.3	-174.7	3	0	0	0	110.3	V39 D40 C41 S42 Y59 S63	V39-N61 PolarHBondContact O-N 3.23Å; D40-N61 HydrophobicContact CB-CB 4.44Å; D40-N61 PolarHBondContact OD1-ND2 3.2Å; C41-N61 CarbonylContact C-O 3.36Å; C41-N61 WeakPolarHBondContact CA-O 3.49Å; C41-N61 PolarHBondContact N-O 3.38Å; S42-N61 PolarHBondContact OG-ND2 3.04Å; Y59-N61 HydrophobicContact CE1-CB 3.73Å; N61-S63 VanDerWaalsContact OD1-CB 3.25Å; N61-S63 WeakPolarHBondContact OD1-CB 2.96Å; N61-S63 PolarHBondContact OD1-N 3.18Å; N61-S63 PolarHBondContact OD1-OG 3.32Å
62	L	97.6	Very high	94.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.227	C	C	.	.			trans	-114.5	14.9	175.7	-60.9	173.4	0	0	0	111.3	C41 L49 L60 N65 F67 L70 L74 L83 D84 I85 N88	C41-L62 HydrophobicContact CB-CD2 4.04Å; L49-L62 HydrophobicContact CD2-CD1 3.51Å; L49-L62 HydrophobicContact CD2-CD2 3.81Å; L49-L62 HydrophobicContact CD2-CG 4.33Å; L60-L62 HydrophobicContact CD1-CD2 4.02Å; L60-L62 HydrophobicContact CD1-CG 4.25Å; L60-L62 HydrophobicContact CD2-CD1 3.96Å; L60-L62 HydrophobicContact CD2-CD2 4.45Å; L60-L62 HydrophobicContact CD2-CG 4.17Å; L60-L62 HydrophobicContact CG-CD1 4.25Å; L60-L62 HydrophobicContact CG-CD2 4.23Å; L60-L62 HydrophobicContact CG-CG 3.92Å; L62-N65 PolarHBondContact O-ND2 3.21Å; L62-F67 HydrophobicContact CB-CD2 4.32Å; L62-F67 HydrophobicContact CB-CE2 3.91Å; L62-F67 HydrophobicContact CD1-CE2 4.47Å; L62-F67 HydrophobicContact CD2-CE2 4.13Å; L62-F67 HydrophobicContact CD2-CZ 4.25Å; L62-F67 HydrophobicContact CG-CE2 4.38Å; L62-L70 HydrophobicContact CD1-CD1 4.15Å; L62-L74 HydrophobicContact CD1-CD2 4.47Å; L62-L83 HydrophobicContact CD1-CD1 4.3Å; L62-D84 CarbonylContact C-O 3.45Å; L62-D84 WeakPolarHBondContact CA-O 3.27Å; L62-D84 WeakPolarHBondContact CB-O 3.29Å; L62-D84 PolarHBondContact N-O 2.98Å; L62-I85 HydrophobicContact CB-CG2 4.26Å; L62-I85 HydrophobicContact CD1-CG2 4.09Å; L62-N88 PolarHBondContact O-ND2 3.3Å
63	S	98.3	Very high	94.6	Very high	5 Å²	5	46.3 Å²	46.3	4%	0.035	23%	0.227	C	C	.	.			trans	-66.8	159	-174.7	63.8	0	0	0	0	113	S42 G43 N61 N65 D84 S86	S42-S63 CarbonylContact C-O 3.03Å; S42-S63 WeakPolarHBondContact CA-O 3.45Å; S42-S63 VanDerWaalsContact CB-O 3.26Å; S42-S63 WeakPolarHBondContact CB-O 3.48Å; S42-S63 WeakPolarHBondContact CB-OG 3.22Å; G43-S63 PolarHBondContact N-O 3.09Å; N61-S63 VanDerWaalsContact OD1-CB 3.25Å; N61-S63 WeakPolarHBondContact OD1-CB 2.96Å; N61-S63 PolarHBondContact OD1-N 3.18Å; N61-S63 PolarHBondContact OD1-OG 3.32Å; S63-N65 PolarHBondContact O-N 3.35Å; S63-N65 PolarHBondContact O-ND2 3.06Å; S63-D84 PolarHBondContact N-O 3.17Å; S63-S86 CarbonylContact C-O 3.59Å; S63-S86 WeakPolarHBondContact CA-O 3.42Å; S63-S86 VanDerWaalsContact CB-O 3.29Å; S63-S86 WeakPolarHBondContact CB-O 3.4Å
64	F	98.2	Very high	94.7	Very high	124 Å²	124	46.1 Å²	46.1	54%	0.544	23%	0.226	S	C	.	.	S	Bend	trans	56.1	48	178.7	-59.7	-85.9	0	0	0	112.8	G43 S86 N87	G43-F64 WeakPolarHBondContact CA-O 3.31Å; G43-F64 PolarHBondContact N-O 3.2Å; F64-S86 PolarHBondContact N-O 3.43Å; F64-N87 VanDerWaalsContact CA-O 3.27Å; F64-N87 WeakPolarHBondContact CA-O 3.25Å; F64-N87 HydrophobicContact CB-CB 4.48Å; F64-N87 HydrophobicContact CD1-CB 3.61Å; F64-N87 HydrophobicContact CD2-CB 4.42Å; F64-N87 HydrophobicContact CE1-CB 3.86Å; F64-N87 VanDerWaalsContact CE1-CG 3.46Å; F64-N87 WeakPolarHBondContact CE1-ND2 3.45Å; F64-N87 HydrophobicContact CG-CB 3.92Å; F64-N87 HydrophobicContact CZ-CB 4.37Å; F64-N87 WeakPolarHBondContact CZ-ND2 3.34Å; F64-N87 PolarHBondContact N-O 2.78Å
65	N	98.1	Very high	94.8	Very high	7 Å²	7	46.1 Å²	46.1	4%	0.037	23%	0.231	C	C	.	.	S	Bend	trans	-125.1	-163.8	176	-78.9	-60.3	0	0	0	109.4	C41 R44 N45 L46 L62 S63 F67 N87 N88	C41-N65 PolarHBondContact O-ND2 3.09Å; R44-N65 PolarHBondContact N-OD1 2.8Å; N45-N65 PolarHBondContact N-OD1 3.06Å; N45-N65 VanDerWaalsContact N-OD1 3.12Å; L46-N65 HydrophobicContact CB-CB 4.23Å; L46-N65 WeakPolarHBondContact CB-OD1 3.42Å; L46-N65 PolarHBondContact N-OD1 3.25Å; L62-N65 PolarHBondContact O-ND2 3.21Å; S63-N65 PolarHBondContact O-N 3.35Å; S63-N65 PolarHBondContact O-ND2 3.06Å; N65-F67 HydrophobicContact CB-CD2 3.63Å; N65-F67 HydrophobicContact CB-CE2 3.64Å; N65-N87 PolarHBondContact N-O 3.42Å; N65-N88 VanDerWaalsContact CA-OD1 3.28Å; N65-N88 WeakPolarHBondContact CA-OD1 3.22Å; N65-N88 WeakPolarHBondContact CB-OD1 3.47Å; N65-N88 PolarHBondContact N-OD1 2.9Å; N65-N88 PolarHBondContact O-OD1 3.4Å
66	Q	97.6	Very high	94.9	Very high	62 Å²	62	47.4 Å²	47.4	29%	0.29	23%	0.23	S	C	.	.			trans	-122.6	32.5	-175.1	-62.9	179.8	4.4	0	0	111.1	L46 T47 I68 N88 W89	L46-Q66 CarbonylContact O-C 3.57Å; L46-Q66 WeakPolarHBondContact O-CA 3.4Å; L46-Q66 PolarHBondContact O-N 3.31Å; T47-Q66 HydrophobicContact CG2-CB 3.95Å; Q66-I68 PolarHBondContact O-N 3.01Å; Q66-N88 PolarHBondContact N-OD1 3.27Å; Q66-W89 HydrophobicContact CB-CE3 3.96Å; Q66-W89 HydrophobicContact CB-CH2 3.97Å; Q66-W89 HydrophobicContact CB-CZ3 3.62Å; Q66-W89 HydrophobicContact CG-CE3 4.43Å; Q66-W89 HydrophobicContact CG-CH2 3.59Å; Q66-W89 HydrophobicContact CG-CZ2 4.03Å; Q66-W89 HydrophobicContact CG-CZ3 3.82Å
67	F	97.3	Very high	95	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.213	C	C	.	.			trans	-68.4	125.5	178.6	-69	-72.3	0	0	0	110.7	L46 T47 L49 L62 N65 L70 N88 W89 L90	L46-F67 HydrophobicContact CB-CE2 3.99Å; L46-F67 HydrophobicContact CB-CZ 3.73Å; T47-F67 WeakPolarHBondContact O-CD1 3.42Å; L49-F67 HydrophobicContact CD2-CE1 4.47Å; L49-F67 HydrophobicContact CD2-CZ 4.31Å; L62-F67 HydrophobicContact CB-CD2 4.32Å; L62-F67 HydrophobicContact CB-CE2 3.91Å; L62-F67 HydrophobicContact CD1-CE2 4.47Å; L62-F67 HydrophobicContact CD2-CE2 4.13Å; L62-F67 HydrophobicContact CD2-CZ 4.25Å; L62-F67 HydrophobicContact CG-CE2 4.38Å; N65-F67 HydrophobicContact CB-CD2 3.63Å; N65-F67 HydrophobicContact CB-CE2 3.64Å; F67-L70 HydrophobicContact CB-CD1 4.41Å; F67-L70 HydrophobicContact CB-CG 4.32Å; F67-L70 HydrophobicContact CD1-CD2 3.57Å; F67-L70 HydrophobicContact CD1-CG 4.18Å; F67-L70 HydrophobicContact CE1-CD2 3.84Å; F67-L70 HydrophobicContact CG-CD1 4.35Å; F67-L70 HydrophobicContact CG-CD2 4.12Å; F67-L70 HydrophobicContact CG-CG 4.31Å; F67-N88 HydrophobicContact CB-CB 4.18Å; F67-N88 WeakPolarHBondContact CB-OD1 3.35Å; F67-N88 VanDerWaalsContact CD2-OD1 3.23Å; F67-N88 WeakPolarHBondContact CD2-OD1 3.46Å; F67-N88 PolarHBondContact N-OD1 2.72Å; F67-W89 CarbonylContact O-C 3.24Å; F67-W89 VanDerWaalsContact O-C 3.25Å; F67-W89 WeakPolarHBondContact O-CA 3.46Å; F67-W89 PolarHBondContact O-N 3.18Å; F67-L90 HydrophobicContact CB-CD2 4.13Å; F67-L90 PolarHBondContact O-N 2.98Å
68	I	96.3	Very high	95	Very high	94 Å²	94	48.8 Å²	48.8	48%	0.482	24%	0.241	S	C	.	.	S	Bend	trans	-97.4	-31	175.9	-60.2	170.4	0	0	0	110.7	Q66 W89	Q66-I68 PolarHBondContact O-N 3.01Å; I68-W89 HydrophobicContact CG1-CB 4.34Å; I68-W89 HydrophobicContact CG1-CE3 4.28Å
69	D	93.6	Very high	94.9	Very high	85 Å²	85	50.4 Å²	50.4	46%	0.455	25%	0.248	S	C	.	.			trans	-154.8	144.1	-178.3	-173.7	7.8	0	0	0	110	D71	D69-D71 VanDerWaalsContact OD1-CB 3.29Å; D69-D71 WeakPolarHBondContact OD1-CB 3.47Å; D69-D71 PolarHBondContact OD1-N 3.08Å
70	L	93.8	Very high	94.9	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.235	C	C	.	.			trans	-133.3	14.1	177.1	-72.6	171.8	0	0	0	112.1	L49 L62 F67 H72 Q73 L74 I85 L90 P94	L49-L70 HydrophobicContact CD1-CD2 4.35Å; L49-L70 HydrophobicContact CD2-CD2 4.2Å; L49-L70 HydrophobicContact CG-CD2 3.96Å; L62-L70 HydrophobicContact CD1-CD1 4.15Å; F67-L70 HydrophobicContact CB-CD1 4.41Å; F67-L70 HydrophobicContact CB-CG 4.32Å; F67-L70 HydrophobicContact CD1-CD2 3.57Å; F67-L70 HydrophobicContact CD1-CG 4.18Å; F67-L70 HydrophobicContact CE1-CD2 3.84Å; F67-L70 HydrophobicContact CG-CD1 4.35Å; F67-L70 HydrophobicContact CG-CD2 4.12Å; F67-L70 HydrophobicContact CG-CG 4.31Å; L70-H72 PolarHBondContact O-N 3.33Å; L70-Q73 PolarHBondContact O-N 2.89Å; L70-L74 HydrophobicContact CB-CD1 4.18Å; L70-L74 HydrophobicContact CD1-CD1 4.43Å; L70-I85 HydrophobicContact CD1-CB 4.46Å; L70-I85 HydrophobicContact CD1-CG2 3.69Å; L70-L90 HydrophobicContact CD1-CD2 4.36Å; L70-L90 HydrophobicContact CG-CD2 4.27Å; L70-P94 HydrophobicContact CB-CB 4.03Å; L70-P94 HydrophobicContact CB-CG 3.8Å; L70-P94 HydrophobicContact CD1-CG 4.5Å
71	D	91.3	Very high	94.8	Very high	50 Å²	50	51 Å²	51	27%	0.267	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	132.9	-177.6	-78.3	0.1	0	0	0	112	D69 Q73 P94 A95	D69-D71 VanDerWaalsContact OD1-CB 3.29Å; D69-D71 WeakPolarHBondContact OD1-CB 3.47Å; D69-D71 PolarHBondContact OD1-N 3.08Å; D71-Q73 WeakPolarHBondContact O-CG 3.1Å; D71-Q73 PolarHBondContact O-N 3.31Å; D71-P94 VanDerWaalsContact OD1-CA 3.3Å; D71-P94 WeakPolarHBondContact OD1-CA 3.16Å; D71-A95 HydrophobicContact CB-CB 4.34Å; D71-A95 PolarHBondContact OD1-N 2.97Å
72	H	87.5	Confident	94.9	Very high	118 Å²	118	51.3 Å²	51.3	55%	0.546	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	-15.2	-179	-56.3	-84.1	0	0	0	116.7	L70 L74 T75 A95 H96	L70-H72 PolarHBondContact O-N 3.33Å; H72-L74 VanDerWaalsContact C-N 3.32Å; H72-L74 PolarHBondContact O-N 2.82Å; H72-T75 PolarHBondContact O-OG1 3Å; H72-A95 PolarHBondContact N-O 3.05Å; H72-H96 AromaticContact CE1-CE1 3.2Å; H72-H96 PolarHBondContact CE1-CE1 3.01Å; H72-H96 AromaticContact CE1-CG 3.96Å; H72-H96 AromaticContact CE1-ND1 3.08Å; H72-H96 PolarHBondContact CE1-ND1 3.21Å; H72-H96 AromaticContact ND1-CE1 3.86Å; H72-H96 AromaticContact ND1-CG 3.86Å; H72-H96 AromaticContact ND1-ND1 3.36Å; H72-H96 PolarHBondContact ND1-ND1 2.87Å; H72-H96 AromaticContact NE2-CE1 3.95Å; H72-H96 AromaticContact NE2-ND1 3.77Å
73	Q	91.1	Very high	94.9	Very high	78 Å²	78	51.3 Å²	51.3	36%	0.364	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-27.1	-173.6	-50.3	-173.3	7.3	0	0	113	L49 L70 D71	L49-Q73 HydrophobicContact CD1-CB 3.54Å; L70-Q73 PolarHBondContact O-N 2.89Å; D71-Q73 WeakPolarHBondContact O-CG 3.1Å; D71-Q73 PolarHBondContact O-N 3.31Å
74	L	93.1	Very high	94.9	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.016	26%	0.258	C	S	.	.	S	Bend	trans	-87.5	-19.6	-174.6	-62.2	168.1	0	0	0	113.1	L49 L60 L62 L70 H72 R76 F77 L83 P94 L97 P98	L49-L74 HydrophobicContact CD1-CD2 4.22Å; L60-L74 HydrophobicContact CD2-CD2 4.18Å; L62-L74 HydrophobicContact CD1-CD2 4.47Å; L70-L74 HydrophobicContact CB-CD1 4.18Å; L70-L74 HydrophobicContact CD1-CD1 4.43Å; H72-L74 VanDerWaalsContact C-N 3.32Å; H72-L74 PolarHBondContact O-N 2.82Å; L74-R76 PolarHBondContact O-N 3.19Å; L74-F77 HydrophobicContact CB-CD2 4.43Å; L74-F77 HydrophobicContact CD2-CD2 4.13Å; L74-F77 HydrophobicContact CD2-CE2 4.03Å; L74-F77 VanDerWaalsContact O-CD2 3.24Å; L74-F77 WeakPolarHBondContact O-CD2 3.28Å; L74-F77 PolarHBondContact O-N 3.33Å; L74-L83 HydrophobicContact CD1-CD2 3.59Å; L74-L83 HydrophobicContact CD2-CD1 4.49Å; L74-P94 HydrophobicContact CD1-CB 4.2Å; L74-P94 HydrophobicContact CD1-CG 4.29Å; L74-L97 HydrophobicContact CD1-CD2 4.17Å; L74-P98 HydrophobicContact CB-CG 4.23Å; L74-P98 WeakPolarHBondContact O-CG 3.24Å
75	T	91.1	Very high	94.9	Very high	69 Å²	69	46.6 Å²	46.6	42%	0.423	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-30.8	-172.4	-39.5	0	0	0	0	114.2	H72 F77 H96	H72-T75 PolarHBondContact O-OG1 3Å; T75-F77 VanDerWaalsContact C-N 3.28Å; T75-F77 PolarHBondContact O-N 2.88Å; T75-H96 PolarHBondContact OG1-O 3.39Å
76	R	92.5	Very high	94.9	Very high	111 Å²	111	46.4 Å²	46.4	42%	0.419	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-22.5	-177.7	74.8	-174.6	-135.2	-145.3	-1.1	114	L53 D55 L74 T78	L53-R76 PolarHBondContact O-NH2 2.88Å; D55-R76 IonicContact OD1-CZ 2.71Å; D55-R76 IonicContact OD1-NE 3.78Å; D55-R76 PolarHBondContact OD1-NE 2.76Å; D55-R76 IonicContact OD1-NH2 3.69Å; L74-R76 PolarHBondContact O-N 3.19Å; R76-T78 PolarHBondContact O-N 2.93Å
77	F	94.2	Very high	95	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.228	C	C	.	.			trans	-81.4	68.8	-176.6	-53.4	-59.9	0	0	0	111.3	L49 L53 Q54 I57 L60 L74 T75 N79 L80 P98	L49-F77 HydrophobicContact CD1-CE2 4.48Å; L53-F77 HydrophobicContact CB-CE1 4.03Å; L53-F77 HydrophobicContact CB-CZ 4.05Å; L53-F77 HydrophobicContact CD1-CZ 3.98Å; Q54-F77 WeakPolarHBondContact O-CD1 3.19Å; Q54-F77 WeakPolarHBondContact O-CE1 3.34Å; I57-F77 HydrophobicContact CD1-CB 4.26Å; I57-F77 HydrophobicContact CD1-CD1 3.36Å; I57-F77 HydrophobicContact CD1-CD2 4.14Å; I57-F77 HydrophobicContact CD1-CE1 3.59Å; I57-F77 HydrophobicContact CD1-CE2 4.35Å; I57-F77 HydrophobicContact CD1-CG 3.67Å; I57-F77 HydrophobicContact CD1-CZ 4.09Å; I57-F77 HydrophobicContact CG1-CB 4.06Å; I57-F77 HydrophobicContact CG1-CD1 3.53Å; I57-F77 HydrophobicContact CG1-CE1 4.16Å; I57-F77 HydrophobicContact CG1-CG 3.92Å; L60-F77 HydrophobicContact CD2-CE2 4.3Å; L74-F77 HydrophobicContact CB-CD2 4.43Å; L74-F77 HydrophobicContact CD2-CD2 4.13Å; L74-F77 HydrophobicContact CD2-CE2 4.03Å; L74-F77 VanDerWaalsContact O-CD2 3.24Å; L74-F77 WeakPolarHBondContact O-CD2 3.28Å; L74-F77 PolarHBondContact O-N 3.33Å; T75-F77 VanDerWaalsContact C-N 3.28Å; T75-F77 PolarHBondContact O-N 2.88Å; F77-N79 PolarHBondContact O-N 2.97Å; F77-N79 VanDerWaalsContact O-N 3.08Å; F77-L80 HydrophobicContact CB-CB 3.84Å; F77-L80 HydrophobicContact CB-CD2 4.23Å; F77-L80 VanDerWaalsContact O-CB 3.25Å; F77-L80 WeakPolarHBondContact O-CB 3.4Å; F77-L80 PolarHBondContact O-N 2.99Å; F77-P98 HydrophobicContact CB-CG 4.49Å; F77-P98 WeakPolarHBondContact O-CB 3.27Å
78	T	93.6	Very high	95	Very high	95 Å²	95	45.7 Å²	45.7	58%	0.583	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-13	-172.7	54.9	0	0	0	0	115.2	R76 S100	R76-T78 PolarHBondContact O-N 2.93Å; T78-S100 WeakPolarHBondContact O-CB 3.4Å; T78-S100 PolarHBondContact O-OG 3.44Å; T78-S100 VanDerWaalsContact O-OG 3.13Å
79	N	94.8	Very high	95.1	Very high	74 Å²	74	47.3 Å²	47.3	40%	0.396	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	1.7	178	-66.5	-77.2	0	0	0	113	I57 F77 R81	I57-N79 CarbonylContact O-C 3.1Å; I57-N79 VanDerWaalsContact O-C 3.24Å; F77-N79 PolarHBondContact O-N 2.97Å; F77-N79 VanDerWaalsContact O-N 3.08Å; N79-R81 PolarHBondContact O-N 3.44Å
80	L	96.8	Very high	95.2	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.208	C	C	.	.			trans	-65.4	126.1	-175.7	-169.5	66.2	0	0	0	110.3	I57 L60 F77 T82 L83 P98 S100 L101	I57-L80 HydrophobicContact CD1-CD1 4.17Å; I57-L80 HydrophobicContact CG1-CD1 4.07Å; I57-L80 WeakPolarHBondContact O-CA 3.47Å; I57-L80 PolarHBondContact O-N 3.13Å; L60-L80 HydrophobicContact CB-CD1 3.66Å; L60-L80 HydrophobicContact CB-CD2 4.49Å; F77-L80 HydrophobicContact CB-CB 3.84Å; F77-L80 HydrophobicContact CB-CD2 4.23Å; F77-L80 VanDerWaalsContact O-CB 3.25Å; F77-L80 WeakPolarHBondContact O-CB 3.4Å; F77-L80 PolarHBondContact O-N 2.99Å; L80-T82 WeakPolarHBondContact CD1-O 3.41Å; L80-L83 HydrophobicContact CD2-CB 4.05Å; L80-L83 HydrophobicContact CD2-CD1 4.3Å; L80-L83 HydrophobicContact CD2-CD2 4.47Å; L80-P98 HydrophobicContact CB-CB 4.42Å; L80-P98 HydrophobicContact CB-CG 4.48Å; L80-P98 HydrophobicContact CD2-CG 4.18Å; L80-S100 PolarHBondContact N-OG 3.21Å; L80-S100 CarbonylContact O-C 3.08Å; L80-S100 VanDerWaalsContact O-CB 3.27Å; L80-S100 WeakPolarHBondContact O-CB 3.11Å; L80-S100 PolarHBondContact O-OG 3.06Å; L80-L101 HydrophobicContact CB-CD2 4.34Å; L80-L101 HydrophobicContact CD2-CD2 3.97Å; L80-L101 HydrophobicContact CG-CD2 3.82Å; L80-L101 WeakPolarHBondContact O-CA 3.3Å; L80-L101 PolarHBondContact O-N 3.3Å
81	R	97.2	Very high	95.3	Very high	82 Å²	82	49.7 Å²	49.7	31%	0.309	24%	0.236	S	C	.	.			trans	-107.2	-42.3	-179.6	-58.6	-53.4	-175	175.7	0	111.5	T58 N79 S100 W102 E103	T58-R81 WeakPolarHBondContact O-CB 3.16Å; T58-R81 PolarHBondContact O-N 2.97Å; N79-R81 PolarHBondContact O-N 3.44Å; R81-S100 WeakPolarHBondContact CD-O 3.2Å; R81-S100 PolarHBondContact NH1-O 2.95Å; R81-W102 HydrophobicContact CB-CD2 4.42Å; R81-W102 HydrophobicContact CB-CE3 4.43Å; R81-W102 HydrophobicContact CG-CD2 4.5Å; R81-W102 PolarHBondContact O-N 3.47Å; R81-E103 PolarHBondContact O-N 3.41Å
82	T	98.2	Very high	95.4	Very high	20 Å²	20	51.1 Å²	51.1	12%	0.123	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	126.7	-178.9	-57.4	0	0	0	0	109.4	T58 Y59 L60 L80 E103 Y105	T58-T82 PolarHBondContact O-N 2.69Å; T58-T82 VanDerWaalsContact O-N 3.12Å; Y59-T82 WeakPolarHBondContact CA-O 3.4Å; Y59-T82 HydrophobicContact CD2-CG2 3.73Å; Y59-T82 HydrophobicContact CE2-CG2 3.82Å; L60-T82 PolarHBondContact N-O 3.33Å; L80-T82 WeakPolarHBondContact CD1-O 3.41Å; T82-E103 HydrophobicContact CG2-CB 4.08Å; T82-E103 WeakPolarHBondContact CG2-OE2 3.36Å; T82-E103 PolarHBondContact OG1-OE2 2.94Å; T82-Y105 HydrophobicContact CG2-CD2 4.46Å; T82-Y105 HydrophobicContact CG2-CE2 4.14Å
83	L	98.1	Very high	95.6	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	122.3	175.7	175.5	61.8	0	0	0	109.6	L60 L62 L74 L80 I85 L97 L101 E103 L104 Y105	L60-L83 HydrophobicContact CB-CD1 4.15Å; L60-L83 HydrophobicContact CD2-CD1 4.07Å; L60-L83 HydrophobicContact CG-CD1 4.16Å; L60-L83 WeakPolarHBondContact O-CA 3.37Å; L62-L83 HydrophobicContact CD1-CD1 4.3Å; L74-L83 HydrophobicContact CD1-CD2 3.59Å; L74-L83 HydrophobicContact CD2-CD1 4.49Å; L80-L83 HydrophobicContact CD2-CB 4.05Å; L80-L83 HydrophobicContact CD2-CD1 4.3Å; L80-L83 HydrophobicContact CD2-CD2 4.47Å; L83-I85 HydrophobicContact CD1-CG2 3.79Å; L83-I85 HydrophobicContact CD2-CG2 4.21Å; L83-I85 HydrophobicContact CG-CG2 3.91Å; L83-L97 HydrophobicContact CD2-CD2 4.01Å; L83-L101 HydrophobicContact CB-CD2 3.78Å; L83-E103 PolarHBondContact N-O 2.87Å; L83-L104 HydrophobicContact CB-CD1 4.19Å; L83-L104 HydrophobicContact CD2-CD1 3.89Å; L83-L104 HydrophobicContact CG-CD1 4.05Å; L83-Y105 PolarHBondContact O-N 2.94Å
84	D	98.6	Very high	95.7	Very high	30 Å²	30	42 Å²	42	16%	0.16	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	115.1	171	-169.4	-7.7	0	0	0	110.1	L60 L62 S63 S86	L60-D84 PolarHBondContact O-N 3.48Å; L62-D84 CarbonylContact C-O 3.45Å; L62-D84 WeakPolarHBondContact CA-O 3.27Å; L62-D84 WeakPolarHBondContact CB-O 3.29Å; L62-D84 PolarHBondContact N-O 2.98Å; S63-D84 PolarHBondContact N-O 3.17Å; D84-S86 WeakPolarHBondContact OD1-CB 3.46Å; D84-S86 PolarHBondContact OD1-N 3.05Å; D84-S86 PolarHBondContact OD1-OG 2.78Å
85	I	97.9	Very high	95.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.211	C	C	.	.			trans	-119.9	21.8	176.6	55.6	-179.3	0	0	0	110.9	L62 L70 L83 N88 L90 P94 L104 Y105 A106 N109	L62-I85 HydrophobicContact CB-CG2 4.26Å; L62-I85 HydrophobicContact CD1-CG2 4.09Å; L70-I85 HydrophobicContact CD1-CB 4.46Å; L70-I85 HydrophobicContact CD1-CG2 3.69Å; L83-I85 HydrophobicContact CD1-CG2 3.79Å; L83-I85 HydrophobicContact CD2-CG2 4.21Å; L83-I85 HydrophobicContact CG-CG2 3.91Å; I85-N88 PolarHBondContact O-ND2 3.29Å; I85-L90 HydrophobicContact CB-CD1 3.97Å; I85-L90 HydrophobicContact CD1-CD1 3.62Å; I85-L90 HydrophobicContact CG1-CD1 3.98Å; I85-P94 HydrophobicContact CD1-CG 3.89Å; I85-L104 HydrophobicContact CD1-CD1 3.97Å; I85-L104 HydrophobicContact CG1-CD1 4.21Å; I85-Y105 VanDerWaalsContact CG1-O 3.22Å; I85-Y105 WeakPolarHBondContact CG1-O 3.44Å; I85-Y105 PolarHBondContact N-O 2.89Å; I85-A106 HydrophobicContact CD1-CB 4.11Å; I85-A106 HydrophobicContact CG1-CB 3.91Å; I85-N109 PolarHBondContact O-ND2 3.25Å
86	S	98.6	Very high	95.1	Very high	4 Å²	4	45.3 Å²	45.3	3%	0.028	22%	0.217	C	C	.	.			trans	-67.4	156.1	-177.6	-53.5	0	0	0	0	112.7	S63 F64 D84 N88 Y105 I107	S63-S86 CarbonylContact C-O 3.59Å; S63-S86 WeakPolarHBondContact CA-O 3.42Å; S63-S86 VanDerWaalsContact CB-O 3.29Å; S63-S86 WeakPolarHBondContact CB-O 3.4Å; F64-S86 PolarHBondContact N-O 3.43Å; D84-S86 WeakPolarHBondContact OD1-CB 3.46Å; D84-S86 PolarHBondContact OD1-N 3.05Å; D84-S86 PolarHBondContact OD1-OG 2.78Å; S86-N88 PolarHBondContact O-N 3.18Å; S86-N88 PolarHBondContact O-ND2 3.13Å; S86-Y105 PolarHBondContact N-O 3.12Å; S86-Y105 PolarHBondContact OG-O 3.12Å; S86-I107 CarbonylContact C-O 3.48Å; S86-I107 WeakPolarHBondContact CA-O 3.27Å; S86-I107 WeakPolarHBondContact CB-O 3.17Å; S86-I107 PolarHBondContact OG-N 3.31Å
87	N	98.5	Very high	95.1	Very high	42 Å²	42	40.4 Å²	40.4	23%	0.225	20%	0.198	C	C	.	.	S	Bend	trans	55.3	53.9	178.7	-54.8	-78.5	0	0	0	112	F64 N65 I107 N108	F64-N87 VanDerWaalsContact CA-O 3.27Å; F64-N87 WeakPolarHBondContact CA-O 3.25Å; F64-N87 HydrophobicContact CB-CB 4.48Å; F64-N87 HydrophobicContact CD1-CB 3.61Å; F64-N87 HydrophobicContact CD2-CB 4.42Å; F64-N87 HydrophobicContact CE1-CB 3.86Å; F64-N87 VanDerWaalsContact CE1-CG 3.46Å; F64-N87 WeakPolarHBondContact CE1-ND2 3.45Å; F64-N87 HydrophobicContact CG-CB 3.92Å; F64-N87 HydrophobicContact CZ-CB 4.37Å; F64-N87 WeakPolarHBondContact CZ-ND2 3.34Å; F64-N87 PolarHBondContact N-O 2.78Å; N65-N87 PolarHBondContact N-O 3.42Å; N87-I107 PolarHBondContact N-O 2.78Å; N87-N108 VanDerWaalsContact CA-O 3.32Å; N87-N108 WeakPolarHBondContact CA-O 3.46Å; N87-N108 PolarHBondContact N-O 3.37Å; N87-N108 WeakPolarHBondContact OD1-CB 3.33Å; N87-N108 PolarHBondContact OD1-ND2 3.33Å
88	N	98.4	Very high	95	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.021	20%	0.2	C	C	.	.	S	Bend	trans	-127.7	-170.1	172.8	-81	-74.5	0	0	0	108.8	L62 N65 Q66 F67 I85 S86 L90 N109	L62-N88 PolarHBondContact O-ND2 3.3Å; N65-N88 VanDerWaalsContact CA-OD1 3.28Å; N65-N88 WeakPolarHBondContact CA-OD1 3.22Å; N65-N88 WeakPolarHBondContact CB-OD1 3.47Å; N65-N88 PolarHBondContact N-OD1 2.9Å; N65-N88 PolarHBondContact O-OD1 3.4Å; Q66-N88 PolarHBondContact N-OD1 3.27Å; F67-N88 HydrophobicContact CB-CB 4.18Å; F67-N88 WeakPolarHBondContact CB-OD1 3.35Å; F67-N88 VanDerWaalsContact CD2-OD1 3.23Å; F67-N88 WeakPolarHBondContact CD2-OD1 3.46Å; F67-N88 PolarHBondContact N-OD1 2.72Å; I85-N88 PolarHBondContact O-ND2 3.29Å; S86-N88 PolarHBondContact O-N 3.18Å; S86-N88 PolarHBondContact O-ND2 3.13Å; N88-L90 HydrophobicContact CB-CG 4.18Å; N88-N109 VanDerWaalsContact CA-OD1 3.31Å; N88-N109 WeakPolarHBondContact CA-OD1 3.35Å; N88-N109 WeakPolarHBondContact CB-OD1 3.26Å; N88-N109 PolarHBondContact N-OD1 3.41Å; N88-N109 PolarHBondContact O-OD1 2.92Å; N88-N109 VanDerWaalsContact O-OD1 3.09Å
89	W	97.7	Very high	95	Very high	129 Å²	129	41.7 Å²	41.7	49%	0.489	20%	0.197	S	C	.	.			trans	-112.8	30.8	179.3	-57	-31.4	0	0	0	112.2	Q66 F67 I68 K91 N109 N110	Q66-W89 HydrophobicContact CB-CE3 3.96Å; Q66-W89 HydrophobicContact CB-CH2 3.97Å; Q66-W89 HydrophobicContact CB-CZ3 3.62Å; Q66-W89 HydrophobicContact CG-CE3 4.43Å; Q66-W89 HydrophobicContact CG-CH2 3.59Å; Q66-W89 HydrophobicContact CG-CZ2 4.03Å; Q66-W89 HydrophobicContact CG-CZ3 3.82Å; F67-W89 CarbonylContact O-C 3.24Å; F67-W89 VanDerWaalsContact O-C 3.25Å; F67-W89 WeakPolarHBondContact O-CA 3.46Å; F67-W89 PolarHBondContact O-N 3.18Å; I68-W89 HydrophobicContact CG1-CB 4.34Å; I68-W89 HydrophobicContact CG1-CE3 4.28Å; W89-K91 PolarHBondContact O-N 3.31Å; W89-N109 PolarHBondContact N-OD1 3.03Å; W89-N110 WeakPolarHBondContact CA-OD1 3.13Å
90	L	96.8	Very high	94.9	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	18%	0.181	C	C	.	.			trans	-65	130	-176.7	-63.3	172.8	0	0	0	110.5	F67 L70 I85 N88 N109 N110 I111	F67-L90 HydrophobicContact CB-CD2 4.13Å; F67-L90 PolarHBondContact O-N 2.98Å; L70-L90 HydrophobicContact CD1-CD2 4.36Å; L70-L90 HydrophobicContact CG-CD2 4.27Å; I85-L90 HydrophobicContact CB-CD1 3.97Å; I85-L90 HydrophobicContact CD1-CD1 3.62Å; I85-L90 HydrophobicContact CG1-CD1 3.98Å; N88-L90 HydrophobicContact CB-CG 4.18Å; L90-N109 HydrophobicContact CB-CB 4.23Å; L90-N109 VanDerWaalsContact CB-OD1 3.31Å; L90-N109 WeakPolarHBondContact CB-OD1 3.46Å; L90-N109 WeakPolarHBondContact CG-OD1 3.34Å; L90-N109 PolarHBondContact N-OD1 3.4Å; L90-N110 CarbonylContact O-C 3.06Å; L90-N110 VanDerWaalsContact O-CA 3.24Å; L90-N110 WeakPolarHBondContact O-CA 3.44Å; L90-N110 WeakPolarHBondContact O-CB 3.23Å; L90-N110 PolarHBondContact O-N 3.01Å; L90-I111 PolarHBondContact O-N 2.65Å
91	K	95.1	Very high	94.9	Very high	133 Å²	133	38.8 Å²	38.8	58%	0.578	18%	0.182	S	C	*	.	S	Bend	trans	-88.1	-22	177.8	-66.4	178.8	-177.5	171.8	0	113.3	W89 I111 K112	W89-K91 PolarHBondContact O-N 3.31Å; K91-I111 WeakPolarHBondContact O-CA 3.3Å; K91-K112 PolarHBondContact O-N 2.67Å
92	N	93.1	Very high	94.9	Very high	80 Å²	80	39.6 Å²	39.6	43%	0.428	19%	0.185	S	C	.	.	S	Bend	trans	-140.9	160.7	179	-57.6	-56.3	0	0	0	109
93	V	93	Very high	94.9	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.012	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-66.1	134.4	163.1	175.3	0	0	0	0	107.7	A95 L97 L104 I111 L114 D118	V93-A95 PolarHBondContact O-N 3.05Å; V93-L97 HydrophobicContact CG1-CD1 3.73Å; V93-L104 HydrophobicContact CG1-CD2 4.18Å; V93-I111 HydrophobicContact CG2-CD1 3.92Å; V93-I111 HydrophobicContact CG2-CG2 4.45Å; V93-L114 HydrophobicContact CB-CD1 4.43Å; V93-L114 HydrophobicContact CG2-CD1 3.74Å; V93-D118 HydrophobicContact CB-CB 4.21Å; V93-D118 HydrophobicContact CG1-CB 4.46Å
94	P	92	Very high	94.9	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.013	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-56.9	133.9	-175	-26.8	35.4	0	0	0	112.6	L70 D71 L74 I85 L97	L70-P94 HydrophobicContact CB-CB 4.03Å; L70-P94 HydrophobicContact CB-CG 3.8Å; L70-P94 HydrophobicContact CD1-CG 4.5Å; D71-P94 VanDerWaalsContact OD1-CA 3.3Å; D71-P94 WeakPolarHBondContact OD1-CA 3.16Å; L74-P94 HydrophobicContact CD1-CB 4.2Å; L74-P94 HydrophobicContact CD1-CG 4.29Å; I85-P94 HydrophobicContact CD1-CG 3.89Å; P94-L97 HydrophobicContact CB-CD2 4.27Å; P94-L97 WeakPolarHBondContact O-CG 3.17Å
95	A	87.6	Confident	94.9	Very high	27 Å²	27	43.2 Å²	43.2	22%	0.223	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	143.5	174.3	0	0	0	0	0	110.6	D71 H72 V93	D71-A95 HydrophobicContact CB-CB 4.34Å; D71-A95 PolarHBondContact OD1-N 2.97Å; H72-A95 PolarHBondContact N-O 3.05Å; V93-A95 PolarHBondContact O-N 3.05Å
96	H	85.6	Confident	94.9	Very high	116 Å²	116	43.2 Å²	43.2	54%	0.537	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	43.9	176.3	-51.8	84.1	0	0	0	114.5	H72 T75	H72-H96 AromaticContact CE1-CE1 3.2Å; H72-H96 PolarHBondContact CE1-CE1 3.01Å; H72-H96 AromaticContact CE1-CG 3.96Å; H72-H96 AromaticContact CE1-ND1 3.08Å; H72-H96 PolarHBondContact CE1-ND1 3.21Å; H72-H96 AromaticContact ND1-CE1 3.86Å; H72-H96 AromaticContact ND1-CG 3.86Å; H72-H96 AromaticContact ND1-ND1 3.36Å; H72-H96 PolarHBondContact ND1-ND1 2.87Å; H72-H96 AromaticContact NE2-CE1 3.95Å; H72-H96 AromaticContact NE2-ND1 3.77Å; T75-H96 PolarHBondContact OG1-O 3.39Å
97	L	91.7	Very high	94.9	Very high	7 Å²	7	45 Å²	45	4%	0.037	21%	0.206	C	C	.	.			trans	-51.6	145.4	170.6	-73.9	167.4	0	0	0	112.6	L74 L83 V93 P94 K99 L101 L104 Q122	L74-L97 HydrophobicContact CD1-CD2 4.17Å; L83-L97 HydrophobicContact CD2-CD2 4.01Å; V93-L97 HydrophobicContact CG1-CD1 3.73Å; P94-L97 HydrophobicContact CB-CD2 4.27Å; P94-L97 WeakPolarHBondContact O-CG 3.17Å; L97-K99 PolarHBondContact O-N 3.25Å; L97-L101 HydrophobicContact CB-CD1 4.06Å; L97-L101 HydrophobicContact CD2-CD1 4.07Å; L97-L101 HydrophobicContact CG-CD1 4.49Å; L97-L104 HydrophobicContact CD1-CD2 3.58Å; L97-Q122 PolarHBondContact O-NE2 2.97Å
98	P	92.5	Very high	94.9	Very high	4 Å²	4	46.8 Å²	46.8	3%	0.026	22%	0.216	C	C	.	.			trans	-58	126.4	176.9	-26.2	35.7	0	0	0	112.7	L74 F77 L80 S100 L101 Q122	L74-P98 HydrophobicContact CB-CG 4.23Å; L74-P98 WeakPolarHBondContact O-CG 3.24Å; F77-P98 HydrophobicContact CB-CG 4.49Å; F77-P98 WeakPolarHBondContact O-CB 3.27Å; L80-P98 HydrophobicContact CB-CB 4.42Å; L80-P98 HydrophobicContact CB-CG 4.48Å; L80-P98 HydrophobicContact CD2-CG 4.18Å; P98-S100 PolarHBondContact O-N 3.37Å; P98-L101 HydrophobicContact CB-CG 4.26Å; P98-L101 WeakPolarHBondContact O-CB 3.25Å; P98-L101 WeakPolarHBondContact O-CG 3.25Å; P98-L101 PolarHBondContact O-N 3.31Å; P98-L101 VanDerWaalsContact O-N 3.11Å; P98-Q122 PolarHBondContact O-OE1 3.28Å; P98-Q122 VanDerWaalsContact O-OE1 3.05Å
99	K	92.1	Very high	94.9	Very high	119 Å²	119	47 Å²	47	52%	0.517	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-14.7	-179.5	-64.2	171.8	174.9	179.7	0	114.1	L97 L101 W123 N124	L97-K99 PolarHBondContact O-N 3.25Å; K99-L101 VanDerWaalsContact C-N 3.31Å; K99-W123 HydrophobicContact CB-CZ3 3.91Å; K99-W123 HydrophobicContact CD-CH2 3.7Å; K99-W123 HydrophobicContact CD-CZ3 3.85Å; K99-W123 HydrophobicContact CG-CH2 4.22Å; K99-W123 HydrophobicContact CG-CZ3 4.05Å; K99-N124 PolarHBondContact O-ND2 3.03Å
100	S	94.4	Very high	94.9	Very high	11 Å²	11	44.3 Å²	44.3	8%	0.077	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-11.4	178.4	53	0	0	0	0	113.8	T78 L80 R81 P98	T78-S100 WeakPolarHBondContact O-CB 3.4Å; T78-S100 PolarHBondContact O-OG 3.44Å; T78-S100 VanDerWaalsContact O-OG 3.13Å; L80-S100 PolarHBondContact N-OG 3.21Å; L80-S100 CarbonylContact O-C 3.08Å; L80-S100 VanDerWaalsContact O-CB 3.27Å; L80-S100 WeakPolarHBondContact O-CB 3.11Å; L80-S100 PolarHBondContact O-OG 3.06Å; R81-S100 WeakPolarHBondContact CD-O 3.2Å; R81-S100 PolarHBondContact NH1-O 2.95Å; P98-S100 PolarHBondContact O-N 3.37Å
101	L	95.8	Very high	94.9	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	21%	0.212	C	C	.	.			trans	-61.3	137.5	-174.3	-77	174.8	0	0	0	112.5	L80 L83 L97 P98 K99 N124 L125	L80-L101 HydrophobicContact CB-CD2 4.34Å; L80-L101 HydrophobicContact CD2-CD2 3.97Å; L80-L101 HydrophobicContact CG-CD2 3.82Å; L80-L101 WeakPolarHBondContact O-CA 3.3Å; L80-L101 PolarHBondContact O-N 3.3Å; L83-L101 HydrophobicContact CB-CD2 3.78Å; L97-L101 HydrophobicContact CB-CD1 4.06Å; L97-L101 HydrophobicContact CD2-CD1 4.07Å; L97-L101 HydrophobicContact CG-CD1 4.49Å; P98-L101 HydrophobicContact CB-CG 4.26Å; P98-L101 WeakPolarHBondContact O-CB 3.25Å; P98-L101 WeakPolarHBondContact O-CG 3.25Å; P98-L101 PolarHBondContact O-N 3.31Å; P98-L101 VanDerWaalsContact O-N 3.11Å; K99-L101 VanDerWaalsContact C-N 3.31Å; L101-N124 CarbonylContact O-C 3.07Å; L101-N124 VanDerWaalsContact O-C 3.24Å; L101-N124 WeakPolarHBondContact O-CB 3.22Å; L101-L125 HydrophobicContact CB-CD1 4.01Å; L101-L125 WeakPolarHBondContact O-CA 3.07Å; L101-L125 PolarHBondContact O-N 3.08Å
102	W	97.4	Very high	94.9	Very high	99 Å²	99	44 Å²	44	38%	0.375	21%	0.211	S	C	.	.	S	Bend	trans	-109.5	-31.7	171.1	-66.5	-6.9	0	0	0	110.9	R81 K126 V127	R81-W102 HydrophobicContact CB-CD2 4.42Å; R81-W102 HydrophobicContact CB-CE3 4.43Å; R81-W102 HydrophobicContact CG-CD2 4.5Å; R81-W102 PolarHBondContact O-N 3.47Å; W102-K126 WeakPolarHBondContact O-CA 3.28Å; W102-K126 PolarHBondContact O-N 2.8Å; W102-V127 PolarHBondContact O-N 3.38Å; W102-V127 VanDerWaalsContact O-N 3.08Å
103	E	98.3	Very high	94.9	Very high	61 Å²	61	42.4 Å²	42.4	29%	0.285	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	128	-174.7	-60.9	170.7	179.1	0	0	110.1	R81 T82 L83 Y105 V127	R81-E103 PolarHBondContact O-N 3.41Å; T82-E103 HydrophobicContact CG2-CB 4.08Å; T82-E103 WeakPolarHBondContact CG2-OE2 3.36Å; T82-E103 PolarHBondContact OG1-OE2 2.94Å; L83-E103 PolarHBondContact N-O 2.87Å; E103-Y105 HydrophobicContact CB-CE2 3.9Å; E103-V127 HydrophobicContact CB-CB 4.28Å; E103-V127 HydrophobicContact CG-CB 4.03Å; E103-V127 HydrophobicContact CG-CG2 4.05Å
104	L	97.6	Very high	94.8	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	120.3	173.8	176.9	61.4	0	0	0	109.9	L83 I85 V93 L97 L125 V127 L128 D129	L83-L104 HydrophobicContact CB-CD1 4.19Å; L83-L104 HydrophobicContact CD2-CD1 3.89Å; L83-L104 HydrophobicContact CG-CD1 4.05Å; I85-L104 HydrophobicContact CD1-CD1 3.97Å; I85-L104 HydrophobicContact CG1-CD1 4.21Å; V93-L104 HydrophobicContact CG1-CD2 4.18Å; L97-L104 HydrophobicContact CD1-CD2 3.58Å; L104-L125 HydrophobicContact CB-CD1 4.03Å; L104-V127 PolarHBondContact N-O 3.23Å; L104-L128 HydrophobicContact CB-CD1 4.24Å; L104-L128 HydrophobicContact CD2-CD1 3.84Å; L104-L128 HydrophobicContact CG-CD1 4.19Å; L104-D129 PolarHBondContact O-N 2.96Å
105	Y	98.6	Very high	94.6	Very high	64 Å²	64	47 Å²	47	25%	0.251	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	116.2	173.8	-57.3	-81.5	0	0	0	109.5	T82 L83 I85 S86 E103 I107 V127 D129	T82-Y105 HydrophobicContact CG2-CD2 4.46Å; T82-Y105 HydrophobicContact CG2-CE2 4.14Å; L83-Y105 PolarHBondContact O-N 2.94Å; I85-Y105 VanDerWaalsContact CG1-O 3.22Å; I85-Y105 WeakPolarHBondContact CG1-O 3.44Å; I85-Y105 PolarHBondContact N-O 2.89Å; S86-Y105 PolarHBondContact N-O 3.12Å; S86-Y105 PolarHBondContact OG-O 3.12Å; E103-Y105 HydrophobicContact CB-CE2 3.9Å; Y105-I107 HydrophobicContact CD1-CD1 4.36Å; Y105-V127 HydrophobicContact CE1-CG1 3.88Å; Y105-D129 HydrophobicContact CD1-CB 3.86Å; Y105-D129 HydrophobicContact CE1-CB 4.47Å
106	A	97.8	Very high	94.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.24	C	C	.	.			trans	-126.9	36.9	178.4	0	0	0	0	0	111	I85 N109 I111 D129 N133	I85-A106 HydrophobicContact CD1-CB 4.11Å; I85-A106 HydrophobicContact CG1-CB 3.91Å; A106-N109 PolarHBondContact O-ND2 3.08Å; A106-I111 HydrophobicContact CB-CD1 4.05Å; A106-D129 PolarHBondContact N-O 2.99Å; A106-N133 PolarHBondContact O-ND2 2.98Å
107	I	98.6	Very high	94.1	Very high	43 Å²	43	52.1 Å²	52.1	22%	0.221	25%	0.245	C	C	.	.			trans	-67.4	144.3	-173.9	-55.4	165.2	0	0	0	109.7	S86 N87 Y105 N109 D129 S131 R132	S86-I107 CarbonylContact C-O 3.48Å; S86-I107 WeakPolarHBondContact CA-O 3.27Å; S86-I107 WeakPolarHBondContact CB-O 3.17Å; S86-I107 PolarHBondContact OG-N 3.31Å; N87-I107 PolarHBondContact N-O 2.78Å; Y105-I107 HydrophobicContact CD1-CD1 4.36Å; I107-N109 PolarHBondContact O-ND2 2.99Å; I107-D129 HydrophobicContact CD1-CB 4.37Å; I107-D129 HydrophobicContact CG1-CB 4.07Å; I107-D129 WeakPolarHBondContact CG1-OD1 3.44Å; I107-S131 WeakPolarHBondContact CA-O 3.21Å; I107-R132 HydrophobicContact CG2-CB 4.38Å
108	N	98.4	Very high	93.6	Very high	79 Å²	79	52.7 Å²	52.7	42%	0.422	25%	0.249	S	C	.	.	S	Bend	trans	56.3	59.5	172.4	-164.1	39.4	0	0	0	113.2	N87 S131 R132	N87-N108 VanDerWaalsContact CA-O 3.32Å; N87-N108 WeakPolarHBondContact CA-O 3.46Å; N87-N108 PolarHBondContact N-O 3.37Å; N87-N108 WeakPolarHBondContact OD1-CB 3.33Å; N87-N108 PolarHBondContact OD1-ND2 3.33Å; N108-S131 PolarHBondContact N-O 2.85Å; N108-R132 WeakPolarHBondContact CA-O 3.5Å; N108-R132 HydrophobicContact CB-CB 4.25Å; N108-R132 PolarHBondContact N-O 3.29Å
109	N	98.3	Very high	92.7	Very high	7 Å²	7	52.6 Å²	52.6	4%	0.037	25%	0.248	C	C	.	.	S	Bend	trans	-124	-169.9	174.1	-85.6	-81.5	0	0	0	109.8	I85 N88 W89 L90 A106 I107 I111 N133	I85-N109 PolarHBondContact O-ND2 3.25Å; N88-N109 VanDerWaalsContact CA-OD1 3.31Å; N88-N109 WeakPolarHBondContact CA-OD1 3.35Å; N88-N109 WeakPolarHBondContact CB-OD1 3.26Å; N88-N109 PolarHBondContact N-OD1 3.41Å; N88-N109 PolarHBondContact O-OD1 2.92Å; N88-N109 VanDerWaalsContact O-OD1 3.09Å; W89-N109 PolarHBondContact N-OD1 3.03Å; L90-N109 HydrophobicContact CB-CB 4.23Å; L90-N109 VanDerWaalsContact CB-OD1 3.31Å; L90-N109 WeakPolarHBondContact CB-OD1 3.46Å; L90-N109 WeakPolarHBondContact CG-OD1 3.34Å; L90-N109 PolarHBondContact N-OD1 3.4Å; A106-N109 PolarHBondContact O-ND2 3.08Å; I107-N109 PolarHBondContact O-ND2 2.99Å; N109-I111 HydrophobicContact CB-CD1 4.18Å; N109-I111 HydrophobicContact CB-CG1 4.1Å; N109-N133 VanDerWaalsContact CA-OD1 3.25Å; N109-N133 WeakPolarHBondContact CA-OD1 3.41Å; N109-N133 WeakPolarHBondContact CB-OD1 3.41Å; N109-N133 PolarHBondContact N-OD1 3Å; N109-N133 PolarHBondContact O-OD1 3.18Å; N109-N133 VanDerWaalsContact O-OD1 3.1Å
110	N	97.7	Very high	91.8	Very high	74 Å²	74	47.4 Å²	47.4	40%	0.396	23%	0.227	S	C	.	.			trans	-107.3	30	178.5	-63	98.7	0	0	0	112.7	W89 L90 K112	W89-N110 WeakPolarHBondContact CA-OD1 3.13Å; L90-N110 CarbonylContact O-C 3.06Å; L90-N110 VanDerWaalsContact O-CA 3.24Å; L90-N110 WeakPolarHBondContact O-CA 3.44Å; L90-N110 WeakPolarHBondContact O-CB 3.23Å; L90-N110 PolarHBondContact O-N 3.01Å; N110-K112 PolarHBondContact O-N 3.32Å
111	I	96.6	Very high	91.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.248	C	C	.	.			trans	-69.7	124.7	-175.3	-58.8	166.1	0	0	0	109.8	L90 K91 V93 A106 N109 V130 N133 M134 V135	L90-I111 PolarHBondContact O-N 2.65Å; K91-I111 WeakPolarHBondContact O-CA 3.3Å; V93-I111 HydrophobicContact CG2-CD1 3.92Å; V93-I111 HydrophobicContact CG2-CG2 4.45Å; A106-I111 HydrophobicContact CB-CD1 4.05Å; N109-I111 HydrophobicContact CB-CD1 4.18Å; N109-I111 HydrophobicContact CB-CG1 4.1Å; I111-V130 HydrophobicContact CB-CG1 4.47Å; I111-V130 HydrophobicContact CD1-CG1 3.75Å; I111-V130 HydrophobicContact CG2-CG1 4.45Å; I111-N133 HydrophobicContact CB-CB 4.22Å; I111-N133 VanDerWaalsContact CB-OD1 3.28Å; I111-N133 WeakPolarHBondContact CB-OD1 3.16Å; I111-N133 WeakPolarHBondContact CG1-OD1 3.36Å; I111-N133 PolarHBondContact N-OD1 2.98Å; I111-M134 CarbonylContact O-C 3.25Å; I111-M134 VanDerWaalsContact O-CA 3.27Å; I111-M134 WeakPolarHBondContact O-CA 3.44Å; I111-M134 PolarHBondContact O-N 2.96Å; I111-V135 HydrophobicContact CB-CG2 4.38Å; I111-V135 HydrophobicContact CG2-CG2 4.05Å; I111-V135 WeakPolarHBondContact O-CG2 3.18Å; I111-V135 PolarHBondContact O-N 2.8Å; I111-V135 VanDerWaalsContact O-N 3.09Å
112	K	95.1	Very high	90.9	Very high	128 Å²	128	53.3 Å²	53.3	56%	0.557	25%	0.249	S	C	*	.			trans	-101.7	-30.8	-175.6	-66.3	-172.7	179.8	-175.2	0	114.9	K91 N110 M134 V135 E136	K91-K112 PolarHBondContact O-N 2.67Å; N110-K112 PolarHBondContact O-N 3.32Å; K112-M134 WeakPolarHBondContact CA-O 3.41Å; K112-M134 HydrophobicContact CG-CB 4.32Å; K112-V135 CarbonylContact O-C 3.59Å; K112-V135 WeakPolarHBondContact O-CA 3.39Å; K112-E136 PolarHBondContact O-N 3.02Å
113	V	93.2	Very high	90.6	Very high	45 Å²	45	53.4 Å²	53.4	27%	0.273	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	138	-176.7	-177.5	0	0	0	0	107.7	Q115	V113-Q115 HydrophobicContact CG1-CG 3.81Å
114	L	91.4	Very high	90.4	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	106.4	165.8	-171.9	68	0	0	0	107.9	V93 D118 T119 R137 A138 V139 L140	V93-L114 HydrophobicContact CB-CD1 4.43Å; V93-L114 HydrophobicContact CG2-CD1 3.74Å; L114-D118 HydrophobicContact CD1-CB 4.14Å; L114-T119 HydrophobicContact CD1-CG2 4.39Å; L114-R137 PolarHBondContact N-O 3.23Å; L114-A138 HydrophobicContact CB-CB 4.12Å; L114-A138 HydrophobicContact CD2-CB 4.36Å; L114-V139 PolarHBondContact O-N 3.34Å; L114-L140 HydrophobicContact CD2-CD2 3.63Å; L114-L140 HydrophobicContact CG-CD2 4.44Å
115	Q	87.4	Confident	90.3	Very high	102 Å²	102	53.6 Å²	53.6	48%	0.477	25%	0.252	S	S	.	.			trans	-87.9	160.1	-176.9	-56.3	-170	3.9	0	0	111.8	V113 L117 D118 V139	V113-Q115 HydrophobicContact CG1-CG 3.81Å; Q115-L117 PolarHBondContact O-N 3.07Å; Q115-L117 VanDerWaalsContact O-N 3.14Å; Q115-D118 PolarHBondContact N-OD2 3.17Å; Q115-D118 PolarHBondContact O-N 2.66Å; Q115-V139 CarbonylContact C-O 3.57Å
116	K	82.7	Confident	90.2	Very high	123 Å²	123	55 Å²	55	54%	0.535	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-36.8	177.3	-179.8	171.4	-178.7	-174.6	0	113.4	V139 I141	K116-V139 HydrophobicContact CB-CG1 4.47Å; K116-V139 PolarHBondContact N-O 3.38Å; K116-I141 HydrophobicContact CB-CG1 4.5Å; K116-I141 HydrophobicContact CD-CD1 4.02Å; K116-I141 HydrophobicContact CD-CG1 4Å; K116-I141 HydrophobicContact CG-CD1 3.39Å; K116-I141 HydrophobicContact CG-CG1 3.39Å; K116-I141 WeakPolarHBondContact O-CD1 3.09Å
117	L	81.3	Confident	90.3	Very high	126 Å²	126	56.1 Å²	56.1	66%	0.66	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-21	-173.7	-68.5	174.3	0	0	0	113.7	Q115 T119 A120	Q115-L117 PolarHBondContact O-N 3.07Å; Q115-L117 VanDerWaalsContact O-N 3.14Å; L117-T119 PolarHBondContact O-N 3.32Å; L117-A120 HydrophobicContact CD2-CB 4.24Å; L117-A120 VanDerWaalsContact O-CB 3.31Å; L117-A120 WeakPolarHBondContact O-CB 3.39Å; L117-A120 PolarHBondContact O-N 3.36Å
118	D	80.6	Confident	90.2	Very high	20 Å²	20	54.1 Å²	54.1	11%	0.107	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-37.3	-175.4	-58.8	-10.9	0	0	0	111.6	V93 L114 Q115	V93-D118 HydrophobicContact CB-CB 4.21Å; V93-D118 HydrophobicContact CG1-CB 4.46Å; L114-D118 HydrophobicContact CD1-CB 4.14Å; Q115-D118 PolarHBondContact N-OD2 3.17Å; Q115-D118 PolarHBondContact O-N 2.66Å
119	T	74.1	Confident	90.2	Very high	1 Å²	1	51 Å²	51	1%	0.006	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	15.8	177.1	62.5	0	0	0	0	112.5	L114 L117 Y121 Q122 L128 T144 L145	L114-T119 HydrophobicContact CD1-CG2 4.39Å; L117-T119 PolarHBondContact O-N 3.32Å; T119-Y121 PolarHBondContact O-N 3.29Å; T119-Q122 PolarHBondContact O-N 2.63Å; T119-L128 HydrophobicContact CG2-CD2 4.12Å; T119-T144 PolarHBondContact O-OG1 3.02Å; T119-L145 HydrophobicContact CG2-CD1 4.35Å
120	A	73.3	Confident	90.1	Very high	10 Å²	10	50.7 Å²	50.7	8%	0.083	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	133.7	173.4	0	0	0	0	0	108.2	L117	L117-A120 HydrophobicContact CD2-CB 4.24Å; L117-A120 VanDerWaalsContact O-CB 3.31Å; L117-A120 WeakPolarHBondContact O-CB 3.39Å; L117-A120 PolarHBondContact O-N 3.36Å
121	Y	81.6	Confident	90.2	Very high	133 Å²	133	47.4 Å²	47.4	52%	0.522	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	13.1	178.7	-39.3	-69.2	0	0	0	117.1	T119 W123	T119-Y121 PolarHBondContact O-N 3.29Å; Y121-W123 VanDerWaalsContact C-N 3.31Å; Y121-W123 AromaticContact CD1-CZ2 3.82Å; Y121-W123 HydrophobicContact CD1-CZ2 3.82Å; Y121-W123 HydrophobicContact CG-CZ2 4.2Å; Y121-W123 VanDerWaalsContact O-CD2 3.26Å; Y121-W123 VanDerWaalsContact O-CE3 3.26Å; Y121-W123 PolarHBondContact O-N 3.16Å
122	Q	89.6	Confident	90.3	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.019	25%	0.25	C	C	.	.			trans	-91.5	53.4	177.4	-58.9	-51.9	-35.9	0	0	112.9	L97 P98 T119 N124 L125 T144 L145	L97-Q122 PolarHBondContact O-NE2 2.97Å; P98-Q122 PolarHBondContact O-OE1 3.28Å; P98-Q122 VanDerWaalsContact O-OE1 3.05Å; T119-Q122 PolarHBondContact O-N 2.63Å; Q122-N124 PolarHBondContact O-N 3.26Å; Q122-L125 HydrophobicContact CB-CB 4.01Å; Q122-L125 HydrophobicContact CB-CD2 4.41Å; Q122-L125 WeakPolarHBondContact O-CB 3.4Å; Q122-L125 PolarHBondContact O-N 3.34Å; Q122-L125 VanDerWaalsContact O-N 3.15Å; Q122-T144 CarbonylContact C-O 3.58Å; Q122-L145 HydrophobicContact CB-CD2 3.83Å
123	W	91	Very high	90.4	Very high	101 Å²	101	49.4 Å²	49.4	38%	0.383	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-23.5	-172.3	-32.6	-82.2	0	0	0	113.7	K99 Y121 T144 S146 S147	K99-W123 HydrophobicContact CB-CZ3 3.91Å; K99-W123 HydrophobicContact CD-CH2 3.7Å; K99-W123 HydrophobicContact CD-CZ3 3.85Å; K99-W123 HydrophobicContact CG-CH2 4.22Å; K99-W123 HydrophobicContact CG-CZ3 4.05Å; Y121-W123 VanDerWaalsContact C-N 3.31Å; Y121-W123 AromaticContact CD1-CZ2 3.82Å; Y121-W123 HydrophobicContact CD1-CZ2 3.82Å; Y121-W123 HydrophobicContact CG-CZ2 4.2Å; Y121-W123 VanDerWaalsContact O-CD2 3.26Å; Y121-W123 VanDerWaalsContact O-CE3 3.26Å; Y121-W123 PolarHBondContact O-N 3.16Å; W123-T144 WeakPolarHBondContact CA-O 3.37Å; W123-T144 PolarHBondContact N-O 3.46Å; W123-S146 PolarHBondContact O-OG 2.98Å; W123-S147 WeakPolarHBondContact O-CB 3.13Å; W123-S147 PolarHBondContact O-N 2.77Å; W123-S147 PolarHBondContact O-OG 3.38Å
124	N	94.1	Very high	90.6	Very high	64 Å²	64	50.7 Å²	50.7	34%	0.342	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-9.5	-179	-62.6	-51.6	0	0	0	113.2	K99 L101 Q122 K126	K99-N124 PolarHBondContact O-ND2 3.03Å; L101-N124 CarbonylContact O-C 3.07Å; L101-N124 VanDerWaalsContact O-C 3.24Å; L101-N124 WeakPolarHBondContact O-CB 3.22Å; Q122-N124 PolarHBondContact O-N 3.26Å; N124-K126 PolarHBondContact O-N 2.91Å
125	L	95.3	Very high	90.9	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.01	23%	0.229	C	C	.	.			trans	-68.4	126.8	-175.2	-164.7	74.7	0	0	0	109.6	L101 L104 Q122 L128 L145 S147 L148	L101-L125 HydrophobicContact CB-CD1 4.01Å; L101-L125 WeakPolarHBondContact O-CA 3.07Å; L101-L125 PolarHBondContact O-N 3.08Å; L104-L125 HydrophobicContact CB-CD1 4.03Å; Q122-L125 HydrophobicContact CB-CB 4.01Å; Q122-L125 HydrophobicContact CB-CD2 4.41Å; Q122-L125 WeakPolarHBondContact O-CB 3.4Å; Q122-L125 PolarHBondContact O-N 3.34Å; Q122-L125 VanDerWaalsContact O-N 3.15Å; L125-L128 HydrophobicContact CD2-CB 3.98Å; L125-L128 HydrophobicContact CD2-CD1 4.34Å; L125-L145 HydrophobicContact CB-CD2 4.08Å; L125-L145 HydrophobicContact CD2-CD2 3.8Å; L125-S147 CarbonylContact O-C 3.53Å; L125-L148 HydrophobicContact CB-CD1 4.48Å; L125-L148 HydrophobicContact CD2-CD1 4.1Å; L125-L148 HydrophobicContact CG-CD1 4.1Å; L125-L148 WeakPolarHBondContact O-CA 3.42Å; L125-L148 PolarHBondContact O-N 3.43Å
126	K	97	Very high	91.3	Very high	93 Å²	93	50.9 Å²	50.9	40%	0.404	23%	0.23	S	C	.	.			trans	-106	-36	-179.9	-62.5	-179.7	-178	176.6	0	111.8	W102 N124 K149 F150	W102-K126 WeakPolarHBondContact O-CA 3.28Å; W102-K126 PolarHBondContact O-N 2.8Å; N124-K126 PolarHBondContact O-N 2.91Å; K126-K149 PolarHBondContact O-N 3.42Å; K126-F150 PolarHBondContact O-N 2.85Å
127	V	98.2	Very high	91.8	Very high	24 Å²	24	52.7 Å²	52.7	15%	0.145	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	124.7	-177.4	-178.8	0	0	0	0	109.2	W102 E103 L104 Y105 F150	W102-V127 PolarHBondContact O-N 3.38Å; W102-V127 VanDerWaalsContact O-N 3.08Å; E103-V127 HydrophobicContact CB-CB 4.28Å; E103-V127 HydrophobicContact CG-CB 4.03Å; E103-V127 HydrophobicContact CG-CG2 4.05Å; L104-V127 PolarHBondContact N-O 3.23Å; Y105-V127 HydrophobicContact CE1-CG1 3.88Å; V127-F150 HydrophobicContact CG1-CD1 3.8Å; V127-F150 HydrophobicContact CG2-CB 4.39Å
128	L	96.9	Very high	92.3	Very high	1 Å²	1	47 Å²	47	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	108.8	170.8	177.6	57.1	0	0	0	109	L104 T119 L125 V130 L148 F150 L151 N152	L104-L128 HydrophobicContact CB-CD1 4.24Å; L104-L128 HydrophobicContact CD2-CD1 3.84Å; L104-L128 HydrophobicContact CG-CD1 4.19Å; T119-L128 HydrophobicContact CG2-CD2 4.12Å; L125-L128 HydrophobicContact CD2-CB 3.98Å; L125-L128 HydrophobicContact CD2-CD1 4.34Å; L128-V130 HydrophobicContact CD1-CG2 3.66Å; L128-V130 HydrophobicContact CG-CG2 3.91Å; L128-L148 HydrophobicContact CB-CD1 3.77Å; L128-L148 HydrophobicContact CB-CD2 4.48Å; L128-F150 PolarHBondContact N-O 3.15Å; L128-L151 HydrophobicContact CB-CD1 4.14Å; L128-L151 HydrophobicContact CD2-CD1 3.86Å; L128-L151 HydrophobicContact CG-CD1 3.99Å; L128-L151 WeakPolarHBondContact O-CA 3.5Å; L128-N152 PolarHBondContact O-N 3.32Å
129	D	98.4	Very high	92.6	Very high	13 Å²	13	48.5 Å²	48.5	7%	0.07	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	111.6	175.2	-161	-31.9	0	0	0	110.8	L104 Y105 A106 I107 S131 N152	L104-D129 PolarHBondContact O-N 2.96Å; Y105-D129 HydrophobicContact CD1-CB 3.86Å; Y105-D129 HydrophobicContact CE1-CB 4.47Å; A106-D129 PolarHBondContact N-O 2.99Å; I107-D129 HydrophobicContact CD1-CB 4.37Å; I107-D129 HydrophobicContact CG1-CB 4.07Å; I107-D129 WeakPolarHBondContact CG1-OD1 3.44Å; D129-S131 WeakPolarHBondContact OD1-CB 3.28Å; D129-S131 PolarHBondContact OD1-N 3.18Å; D129-S131 PolarHBondContact OD1-OG 3.26Å; D129-N152 HydrophobicContact CB-CB 4.29Å; D129-N152 PolarHBondContact OD1-ND2 2.92Å; D129-N152 PolarHBondContact OD2-ND2 3.18Å
130	V	97.4	Very high	93.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	22%	0.215	C	C	.	.			trans	-122.6	30	175.6	-159.3	0	0	0	0	109.3	I111 L128 N133 V135 N152 L153 N156	I111-V130 HydrophobicContact CB-CG1 4.47Å; I111-V130 HydrophobicContact CD1-CG1 3.75Å; I111-V130 HydrophobicContact CG2-CG1 4.45Å; L128-V130 HydrophobicContact CD1-CG2 3.66Å; L128-V130 HydrophobicContact CG-CG2 3.91Å; V130-N133 HydrophobicContact CG1-CB 4.42Å; V130-N133 PolarHBondContact O-ND2 3.19Å; V130-V135 HydrophobicContact CG1-CG2 4.29Å; V130-N152 CarbonylContact C-O 3.6Å; V130-N152 PolarHBondContact N-O 2.93Å; V130-L153 HydrophobicContact CB-CD2 4.18Å; V130-N156 PolarHBondContact O-ND2 3.42Å
131	S	98.6	Very high	93.4	Very high	6 Å²	6	49.6 Å²	49.6	4%	0.042	22%	0.219	C	C	.	.			trans	-67.8	160.4	179.1	61.1	0	0	0	0	112.7	I107 N108 D129 N133 N152 S154	I107-S131 WeakPolarHBondContact CA-O 3.21Å; N108-S131 PolarHBondContact N-O 2.85Å; D129-S131 WeakPolarHBondContact OD1-CB 3.28Å; D129-S131 PolarHBondContact OD1-N 3.18Å; D129-S131 PolarHBondContact OD1-OG 3.26Å; S131-N133 VanDerWaalsContact C-N 3.3Å; S131-N133 PolarHBondContact O-N 2.89Å; S131-N133 PolarHBondContact O-ND2 3.25Å; S131-N152 PolarHBondContact N-O 3.35Å; S131-S154 CarbonylContact C-O 3.54Å; S131-S154 WeakPolarHBondContact CA-O 3.5Å; S131-S154 WeakPolarHBondContact CB-O 3.48Å; S131-S154 WeakPolarHBondContact CB-OG 3.21Å
132	R	98.4	Very high	92.9	Very high	162 Å²	162	44.8 Å²	44.8	61%	0.611	20%	0.202	S	C	*	.	S	Bend	trans	56.6	42.8	178.9	-58.6	176.6	178.6	-103.8	0.5	112.4	I107 N108 S154 S155	I107-R132 HydrophobicContact CG2-CB 4.38Å; N108-R132 WeakPolarHBondContact CA-O 3.5Å; N108-R132 HydrophobicContact CB-CB 4.25Å; N108-R132 PolarHBondContact N-O 3.29Å; R132-S154 PolarHBondContact N-O 3.08Å; R132-S155 WeakPolarHBondContact CA-O 3.2Å; R132-S155 PolarHBondContact N-O 3.15Å
133	N	98.5	Very high	92	Very high	7 Å²	7	49.9 Å²	49.9	4%	0.037	23%	0.23	C	C	.	.	S	Bend	trans	-116	-164.9	177	-87.1	-86.3	0	0	0	109.8	A106 N109 I111 V130 S131 V135 S155 N156	A106-N133 PolarHBondContact O-ND2 2.98Å; N109-N133 VanDerWaalsContact CA-OD1 3.25Å; N109-N133 WeakPolarHBondContact CA-OD1 3.41Å; N109-N133 WeakPolarHBondContact CB-OD1 3.41Å; N109-N133 PolarHBondContact N-OD1 3Å; N109-N133 PolarHBondContact O-OD1 3.18Å; N109-N133 VanDerWaalsContact O-OD1 3.1Å; I111-N133 HydrophobicContact CB-CB 4.22Å; I111-N133 VanDerWaalsContact CB-OD1 3.28Å; I111-N133 WeakPolarHBondContact CB-OD1 3.16Å; I111-N133 WeakPolarHBondContact CG1-OD1 3.36Å; I111-N133 PolarHBondContact N-OD1 2.98Å; V130-N133 HydrophobicContact CG1-CB 4.42Å; V130-N133 PolarHBondContact O-ND2 3.19Å; S131-N133 VanDerWaalsContact C-N 3.3Å; S131-N133 PolarHBondContact O-N 2.89Å; S131-N133 PolarHBondContact O-ND2 3.25Å; N133-V135 HydrophobicContact CB-CG2 4.02Å; N133-S155 PolarHBondContact N-O 3.25Å; N133-N156 VanDerWaalsContact CA-OD1 3.24Å; N133-N156 WeakPolarHBondContact CA-OD1 3.46Å; N133-N156 WeakPolarHBondContact CB-OD1 3.46Å; N133-N156 PolarHBondContact N-OD1 2.65Å; N133-N156 PolarHBondContact O-OD1 2.9Å
134	M	97.7	Very high	91.6	Very high	73 Å²	73	46 Å²	46	36%	0.36	22%	0.217	S	C	.	.			trans	-114.3	29.3	179.9	-59	-65.9	-91.4	0	0	111.1	I111 K112 E136 N156 K157	I111-M134 CarbonylContact O-C 3.25Å; I111-M134 VanDerWaalsContact O-CA 3.27Å; I111-M134 WeakPolarHBondContact O-CA 3.44Å; I111-M134 PolarHBondContact O-N 2.96Å; K112-M134 WeakPolarHBondContact CA-O 3.41Å; K112-M134 HydrophobicContact CG-CB 4.32Å; M134-E136 PolarHBondContact O-N 2.9Å; M134-N156 PolarHBondContact N-OD1 3.29Å; M134-K157 HydrophobicContact CE-CD 4.24Å; M134-K157 HydrophobicContact SD-CD 4.28Å; M134-K157 VanDerWaalsContact SD-CE 3.58Å
135	V	97.5	Very high	91.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.2	C	C	.	.			trans	-69.6	114	-170.3	-176.6	0	0	0	0	110.3	I111 K112 V130 N133 R137 A138 N156 K157 L158	I111-V135 HydrophobicContact CB-CG2 4.38Å; I111-V135 HydrophobicContact CG2-CG2 4.05Å; I111-V135 WeakPolarHBondContact O-CG2 3.18Å; I111-V135 PolarHBondContact O-N 2.8Å; I111-V135 VanDerWaalsContact O-N 3.09Å; K112-V135 CarbonylContact O-C 3.59Å; K112-V135 WeakPolarHBondContact O-CA 3.39Å; V130-V135 HydrophobicContact CG1-CG2 4.29Å; N133-V135 HydrophobicContact CB-CG2 4.02Å; V135-R137 WeakPolarHBondContact CG1-O 3.2Å; V135-A138 HydrophobicContact CG1-CB 4.38Å; V135-N156 HydrophobicContact CB-CB 4.21Å; V135-N156 VanDerWaalsContact CB-OD1 3.31Å; V135-N156 WeakPolarHBondContact CB-OD1 3.38Å; V135-N156 VanDerWaalsContact CG2-OD1 3.29Å; V135-N156 WeakPolarHBondContact CG2-OD1 3.38Å; V135-N156 PolarHBondContact N-OD1 2.98Å; V135-K157 CarbonylContact O-C 3.55Å; V135-K157 VanDerWaalsContact O-CA 3.29Å; V135-K157 WeakPolarHBondContact O-CA 3.43Å; V135-K157 PolarHBondContact O-N 2.81Å; V135-L158 HydrophobicContact CG1-CD2 3.89Å; V135-L158 PolarHBondContact O-N 3.49Å; V135-L158 VanDerWaalsContact O-N 3.08Å
136	E	95.9	Very high	91	Very high	106 Å²	106	44.3 Å²	44.3	50%	0.495	21%	0.211	S	C	.	.	S	Bend	trans	-92.3	-27.7	178.3	-68.1	173.6	-172.8	0	0	112.1	K112 M134 K157	K112-E136 PolarHBondContact O-N 3.02Å; M134-E136 PolarHBondContact O-N 2.9Å; E136-K157 HydrophobicContact CG-CB 3.9Å; E136-K157 HydrophobicContact CG-CD 4.48Å
137	R	92.1	Very high	90.9	Very high	160 Å²	160	41.9 Å²	41.9	60%	0.604	21%	0.205	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-143.7	131.5	180	-172.9	-170	-60.2	-164.9	-0.5	110.3	L114 V135 V139	L114-R137 PolarHBondContact N-O 3.23Å; V135-R137 WeakPolarHBondContact CG1-O 3.2Å; R137-V139 HydrophobicContact CG-CG2 4.01Å
138	A	92.3	Very high	90.7	Very high	8 Å²	8	40.8 Å²	40.8	7%	0.066	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	119.8	170.4	0	0	0	0	0	110.3	L114 V135 L153 L158 P162	L114-A138 HydrophobicContact CB-CB 4.12Å; L114-A138 HydrophobicContact CD2-CB 4.36Å; V135-A138 HydrophobicContact CG1-CB 4.38Å; A138-L153 HydrophobicContact CB-CD1 4.29Å; A138-L158 HydrophobicContact CB-CD2 4.16Å; A138-P162 HydrophobicContact CB-CB 4.17Å; A138-P162 HydrophobicContact CB-CG 4.04Å
139	V	86.9	Confident	90.7	Very high	50 Å²	50	43.8 Å²	43.8	30%	0.303	21%	0.212	S	C	.	.	B	Isolated β-bridge	trans	-117.7	106.2	176.2	-176.6	0	0	0	0	108.4	L114 Q115 K116 R137	L114-V139 PolarHBondContact O-N 3.34Å; Q115-V139 CarbonylContact C-O 3.57Å; K116-V139 HydrophobicContact CB-CG1 4.47Å; K116-V139 PolarHBondContact N-O 3.38Å; R137-V139 HydrophobicContact CG-CG2 4.01Å
140	L	84.6	Confident	90.7	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.016	22%	0.221	C	C	.	.			trans	-97.4	160.7	178.5	-62.2	174.7	0	0	0	111	L114 L145 L151 N164 M165	L114-L140 HydrophobicContact CD2-CD2 3.63Å; L114-L140 HydrophobicContact CG-CD2 4.44Å; L140-L145 HydrophobicContact CD2-CD1 3.95Å; L140-L151 HydrophobicContact CD1-CD2 3.83Å; L140-N164 WeakPolarHBondContact O-CB 3.36Å; L140-M165 HydrophobicContact CD1-CG 4.14Å
141	I	78.6	Confident	90.7	Very high	32 Å²	32	46.1 Å²	46.1	16%	0.164	22%	0.221	C	C	.	.			trans	-109.5	115.3	164.6	-45.4	167.5	0	0	0	107.3	K116 N143 T144	K116-I141 HydrophobicContact CB-CG1 4.5Å; K116-I141 HydrophobicContact CD-CD1 4.02Å; K116-I141 HydrophobicContact CD-CG1 4Å; K116-I141 HydrophobicContact CG-CD1 3.39Å; K116-I141 HydrophobicContact CG-CG1 3.39Å; K116-I141 WeakPolarHBondContact O-CD1 3.09Å; I141-N143 PolarHBondContact O-N 3.15Å; I141-T144 HydrophobicContact CB-CG2 3.82Å; I141-T144 HydrophobicContact CD1-CG2 3.55Å; I141-T144 HydrophobicContact CG1-CG2 4.28Å; I141-T144 HydrophobicContact CG2-CG2 3.99Å; I141-T144 PolarHBondContact O-N 3.12Å; I141-T144 VanDerWaalsContact O-N 3.08Å; I141-T144 PolarHBondContact O-OG1 2.84Å
142	N	70.9	Confident	90.7	Very high	32 Å²	32	46.6 Å²	46.6	17%	0.171	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-33.5	178.4	60.5	-9.1	0	0	0	114.3	N164	N142-N164 WeakPolarHBondContact CA-O 3.28Å; N142-N164 PolarHBondContact N-O 3.33Å; N142-N164 VanDerWaalsContact N-O 3.16Å
143	N	72.4	Confident	90.7	Very high	111 Å²	111	38.9 Å²	38.9	59%	0.594	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-10.2	-176.3	-67.9	-24.2	0	0	0	114.9	I141	I141-N143 PolarHBondContact O-N 3.15Å
144	T	80.9	Confident	90.7	Very high	18 Å²	18	39 Å²	39	11%	0.11	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-17.9	-179.3	61.4	0	0	0	0	113.7	T119 Q122 W123 I141	T119-T144 PolarHBondContact O-OG1 3.02Å; Q122-T144 CarbonylContact C-O 3.58Å; W123-T144 WeakPolarHBondContact CA-O 3.37Å; W123-T144 PolarHBondContact N-O 3.46Å; I141-T144 HydrophobicContact CB-CG2 3.82Å; I141-T144 HydrophobicContact CD1-CG2 3.55Å; I141-T144 HydrophobicContact CG1-CG2 4.28Å; I141-T144 HydrophobicContact CG2-CG2 3.99Å; I141-T144 PolarHBondContact O-N 3.12Å; I141-T144 VanDerWaalsContact O-N 3.08Å; I141-T144 PolarHBondContact O-OG1 2.84Å
145	L	88.4	Confident	90.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.192	C	C	.	.			trans	-116.2	45.5	-177.9	-72.1	168.9	0	0	0	110.1	T119 Q122 L125 L140 S147 L148 P166	T119-L145 HydrophobicContact CG2-CD1 4.35Å; Q122-L145 HydrophobicContact CB-CD2 3.83Å; L125-L145 HydrophobicContact CB-CD2 4.08Å; L125-L145 HydrophobicContact CD2-CD2 3.8Å; L140-L145 HydrophobicContact CD2-CD1 3.95Å; L145-S147 PolarHBondContact O-N 2.99Å; L145-S147 VanDerWaalsContact O-N 3.17Å; L145-L148 HydrophobicContact CB-CB 3.99Å; L145-L148 HydrophobicContact CB-CD2 4.44Å; L145-L148 HydrophobicContact CD1-CD2 4.25Å; L145-L148 VanDerWaalsContact O-CB 3.3Å; L145-L148 WeakPolarHBondContact O-CB 3.25Å; L145-L148 PolarHBondContact O-N 3.24Å; L145-P166 HydrophobicContact CB-CB 4.27Å; L145-P166 HydrophobicContact CB-CG 3.57Å; L145-P166 HydrophobicContact CD1-CG 4.27Å; L145-P166 WeakPolarHBondContact O-CB 3.35Å
146	S	89.4	Confident	90.8	Very high	32 Å²	32	37.8 Å²	37.8	22%	0.224	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-26.9	-171.3	51.9	0	0	0	0	114.2	W123 N168	W123-S146 PolarHBondContact O-OG 2.98Å; S146-N168 WeakPolarHBondContact O-CB 3.26Å; S146-N168 PolarHBondContact O-ND2 2.81Å
147	S	94.1	Very high	90.9	Very high	42 Å²	42	36.8 Å²	36.8	29%	0.294	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	1.1	178.6	-53.9	0	0	0	0	113.6	W123 L125 L145 K149	W123-S147 WeakPolarHBondContact O-CB 3.13Å; W123-S147 PolarHBondContact O-N 2.77Å; W123-S147 PolarHBondContact O-OG 3.38Å; L125-S147 CarbonylContact O-C 3.53Å; L145-S147 PolarHBondContact O-N 2.99Å; L145-S147 VanDerWaalsContact O-N 3.17Å; S147-K149 PolarHBondContact O-N 2.74Å
148	L	95.4	Very high	91.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.16	C	C	.	.			trans	-69.7	123.5	-172.5	-166.5	78.5	0	0	0	110.3	L125 L128 L145 L151 P166 N168 I169	L125-L148 HydrophobicContact CB-CD1 4.48Å; L125-L148 HydrophobicContact CD2-CD1 4.1Å; L125-L148 HydrophobicContact CG-CD1 4.1Å; L125-L148 WeakPolarHBondContact O-CA 3.42Å; L125-L148 PolarHBondContact O-N 3.43Å; L128-L148 HydrophobicContact CB-CD1 3.77Å; L128-L148 HydrophobicContact CB-CD2 4.48Å; L145-L148 HydrophobicContact CB-CB 3.99Å; L145-L148 HydrophobicContact CB-CD2 4.44Å; L145-L148 HydrophobicContact CD1-CD2 4.25Å; L145-L148 VanDerWaalsContact O-CB 3.3Å; L145-L148 WeakPolarHBondContact O-CB 3.25Å; L145-L148 PolarHBondContact O-N 3.24Å; L148-L151 HydrophobicContact CD2-CB 4.21Å; L148-L151 HydrophobicContact CD2-CD1 4.5Å; L148-P166 HydrophobicContact CB-CB 4.46Å; L148-P166 HydrophobicContact CB-CG 4.27Å; L148-P166 HydrophobicContact CD2-CG 4.02Å; L148-N168 CarbonylContact O-C 3.59Å; L148-I169 HydrophobicContact CD2-CD1 4.18Å; L148-I169 WeakPolarHBondContact O-CA 3.08Å; L148-I169 PolarHBondContact O-N 2.64Å
149	K	97.1	Very high	91.4	Very high	65 Å²	65	34.8 Å²	34.8	28%	0.283	18%	0.179	S	C	.	.			trans	-109	-35.2	-179.7	-62.8	-49.4	-164.2	156.2	0	112.2	K126 S147 N168 E170 T171	K126-K149 PolarHBondContact O-N 3.42Å; S147-K149 PolarHBondContact O-N 2.74Å; K149-N168 WeakPolarHBondContact CD-O 3.37Å; K149-N168 PolarHBondContact NZ-O 3.28Å; K149-E170 HydrophobicContact CD-CG 4.07Å; K149-E170 WeakPolarHBondContact CD-OE1 3.48Å; K149-E170 WeakPolarHBondContact CE-OE1 3.32Å; K149-E170 IonicContact NZ-OE1 2.82Å; K149-E170 PolarHBondContact NZ-OE1 2.76Å; K149-E170 PolarHBondContact O-N 3.3Å; K149-T171 PolarHBondContact O-N 3.26Å
150	F	98.3	Very high	91.8	Very high	62 Å²	62	33.7 Å²	33.7	27%	0.272	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122.5	-177	-178.1	-92.6	0	0	0	110.7	K126 V127 L128 N152 T171	K126-F150 PolarHBondContact O-N 2.85Å; V127-F150 HydrophobicContact CG1-CD1 3.8Å; V127-F150 HydrophobicContact CG2-CB 4.39Å; L128-F150 PolarHBondContact N-O 3.15Å; F150-N152 HydrophobicContact CD1-CB 4.39Å; F150-N152 HydrophobicContact CE1-CB 3.51Å; F150-N152 HydrophobicContact CZ-CB 3.81Å; F150-T171 HydrophobicContact CD2-CG2 3.59Å; F150-T171 HydrophobicContact CE2-CG2 3.65Å
151	L	97.6	Very high	92.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	119.6	171.8	178.2	62.4	0	0	0	109.5	L128 L140 L148 L153 M165 I169 T171 V172 D173	L128-L151 HydrophobicContact CB-CD1 4.14Å; L128-L151 HydrophobicContact CD2-CD1 3.86Å; L128-L151 HydrophobicContact CG-CD1 3.99Å; L128-L151 WeakPolarHBondContact O-CA 3.5Å; L140-L151 HydrophobicContact CD1-CD2 3.83Å; L148-L151 HydrophobicContact CD2-CB 4.21Å; L148-L151 HydrophobicContact CD2-CD1 4.5Å; L151-L153 HydrophobicContact CD1-CD1 4.19Å; L151-L153 HydrophobicContact CD1-CG 4.04Å; L151-L153 HydrophobicContact CD2-CD1 3.87Å; L151-L153 HydrophobicContact CD2-CG 4.49Å; L151-L153 HydrophobicContact CG-CD1 4.03Å; L151-L153 HydrophobicContact CG-CG 4.11Å; L151-M165 HydrophobicContact CD2-SD 4.5Å; L151-I169 HydrophobicContact CB-CD1 3.54Å; L151-I169 HydrophobicContact CD2-CD1 4.15Å; L151-T171 PolarHBondContact N-O 2.81Å; L151-V172 WeakPolarHBondContact O-CA 3.4Å; L151-D173 PolarHBondContact O-N 2.63Å
152	N	98.6	Very high	93.1	Very high	15 Å²	15	32.2 Å²	32.2	8%	0.08	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	113.1	174.1	-173	2.5	0	0	0	110.1	L128 D129 V130 S131 F150 S154	L128-N152 PolarHBondContact O-N 3.32Å; D129-N152 HydrophobicContact CB-CB 4.29Å; D129-N152 PolarHBondContact OD1-ND2 2.92Å; D129-N152 PolarHBondContact OD2-ND2 3.18Å; V130-N152 CarbonylContact C-O 3.6Å; V130-N152 PolarHBondContact N-O 2.93Å; S131-N152 PolarHBondContact N-O 3.35Å; F150-N152 HydrophobicContact CD1-CB 4.39Å; F150-N152 HydrophobicContact CE1-CB 3.51Å; F150-N152 HydrophobicContact CZ-CB 3.81Å; N152-S154 VanDerWaalsContact OD1-CB 3.26Å; N152-S154 WeakPolarHBondContact OD1-CB 3.26Å; N152-S154 PolarHBondContact OD1-N 3.22Å; N152-S154 PolarHBondContact OD1-OG 3.21Å
153	L	98.2	Very high	94	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.17	C	C	.	.			trans	-120.9	20.2	174.4	-70.6	167.2	0	0	0	110.3	V130 A138 L151 N156 L158 P162 D173 L174 N177	V130-L153 HydrophobicContact CB-CD2 4.18Å; A138-L153 HydrophobicContact CB-CD1 4.29Å; L151-L153 HydrophobicContact CD1-CD1 4.19Å; L151-L153 HydrophobicContact CD1-CG 4.04Å; L151-L153 HydrophobicContact CD2-CD1 3.87Å; L151-L153 HydrophobicContact CD2-CG 4.49Å; L151-L153 HydrophobicContact CG-CD1 4.03Å; L151-L153 HydrophobicContact CG-CG 4.11Å; L153-N156 WeakPolarHBondContact O-CB 3.46Å; L153-N156 PolarHBondContact O-ND2 3.5Å; L153-L158 HydrophobicContact CB-CD1 3.98Å; L153-L158 HydrophobicContact CD1-CD1 4.19Å; L153-P162 HydrophobicContact CD1-CG 3.92Å; L153-D173 CarbonylContact C-O 3.4Å; L153-D173 WeakPolarHBondContact CA-O 3.21Å; L153-D173 PolarHBondContact N-O 3.46Å; L153-L174 HydrophobicContact CB-CD2 4Å; L153-L174 HydrophobicContact CD1-CD2 4.11Å; L153-N177 PolarHBondContact O-ND2 2.87Å
154	S	98.7	Very high	94.7	Very high	11 Å²	11	31.6 Å²	31.6	8%	0.077	16%	0.163	C	C	.	.			trans	-64.1	156.1	180	65.7	0	0	0	0	112.5	S131 R132 N152 N156 D173 S175	S131-S154 CarbonylContact C-O 3.54Å; S131-S154 WeakPolarHBondContact CA-O 3.5Å; S131-S154 WeakPolarHBondContact CB-O 3.48Å; S131-S154 WeakPolarHBondContact CB-OG 3.21Å; R132-S154 PolarHBondContact N-O 3.08Å; N152-S154 VanDerWaalsContact OD1-CB 3.26Å; N152-S154 WeakPolarHBondContact OD1-CB 3.26Å; N152-S154 PolarHBondContact OD1-N 3.22Å; N152-S154 PolarHBondContact OD1-OG 3.21Å; S154-N156 PolarHBondContact O-N 3.03Å; S154-N156 PolarHBondContact O-ND2 3.16Å; S154-N156 VanDerWaalsContact O-ND2 3.16Å; S154-D173 WeakPolarHBondContact CB-OD1 3.43Å; S154-D173 PolarHBondContact N-O 3.21Å; S154-S175 CarbonylContact C-O 3.28Å; S154-S175 WeakPolarHBondContact CA-O 3.43Å; S154-S175 WeakPolarHBondContact CB-O 3.42Å; S154-S175 WeakPolarHBondContact CB-OG 3.41Å
155	S	98.6	Very high	95.2	Very high	40 Å²	40	31.1 Å²	31.1	28%	0.28	16%	0.16	S	C	.	.	S	Bend	trans	57	51.4	176.4	-51.7	0	0	0	0	112.1	R132 N133 S175 N176	R132-S155 WeakPolarHBondContact CA-O 3.2Å; R132-S155 PolarHBondContact N-O 3.15Å; N133-S155 PolarHBondContact N-O 3.25Å; S155-S175 PolarHBondContact N-O 3.5Å; S155-N176 WeakPolarHBondContact CA-O 3.29Å; S155-N176 PolarHBondContact N-O 3.31Å
156	N	98.6	Very high	95.4	Very high	7 Å²	7	31.1 Å²	31.1	4%	0.037	16%	0.16	C	C	.	.	S	Bend	trans	-127	-165.9	179.4	-88.8	-71.9	0	0	0	110.2	V130 N133 M134 V135 L153 S154 L158 N176 N177	V130-N156 PolarHBondContact O-ND2 3.42Å; N133-N156 VanDerWaalsContact CA-OD1 3.24Å; N133-N156 WeakPolarHBondContact CA-OD1 3.46Å; N133-N156 WeakPolarHBondContact CB-OD1 3.46Å; N133-N156 PolarHBondContact N-OD1 2.65Å; N133-N156 PolarHBondContact O-OD1 2.9Å; M134-N156 PolarHBondContact N-OD1 3.29Å; V135-N156 HydrophobicContact CB-CB 4.21Å; V135-N156 VanDerWaalsContact CB-OD1 3.31Å; V135-N156 WeakPolarHBondContact CB-OD1 3.38Å; V135-N156 VanDerWaalsContact CG2-OD1 3.29Å; V135-N156 WeakPolarHBondContact CG2-OD1 3.38Å; V135-N156 PolarHBondContact N-OD1 2.98Å; L153-N156 WeakPolarHBondContact O-CB 3.46Å; L153-N156 PolarHBondContact O-ND2 3.5Å; S154-N156 PolarHBondContact O-N 3.03Å; S154-N156 PolarHBondContact O-ND2 3.16Å; S154-N156 VanDerWaalsContact O-ND2 3.16Å; N156-L158 HydrophobicContact CB-CG 4.47Å; N156-N176 PolarHBondContact N-O 3.24Å; N156-N177 VanDerWaalsContact CA-OD1 3.28Å; N156-N177 WeakPolarHBondContact CA-OD1 3.08Å; N156-N177 WeakPolarHBondContact CB-OD1 3.36Å; N156-N177 PolarHBondContact N-OD1 3.38Å; N156-N177 PolarHBondContact O-OD1 2.94Å
157	K	98.1	Very high	95.4	Very high	84 Å²	84	34.4 Å²	34.4	37%	0.365	17%	0.168	S	C	.	.			trans	-113.4	25.5	-178.8	-64.9	-171.3	171.2	-169.9	0	113.2	M134 V135 E136 N177 F178	M134-K157 HydrophobicContact CE-CD 4.24Å; M134-K157 HydrophobicContact SD-CD 4.28Å; M134-K157 VanDerWaalsContact SD-CE 3.58Å; V135-K157 CarbonylContact O-C 3.55Å; V135-K157 VanDerWaalsContact O-CA 3.29Å; V135-K157 WeakPolarHBondContact O-CA 3.43Å; V135-K157 PolarHBondContact O-N 2.81Å; E136-K157 HydrophobicContact CG-CB 3.9Å; E136-K157 HydrophobicContact CG-CD 4.48Å; K157-N177 PolarHBondContact N-OD1 3.21Å; K157-F178 HydrophobicContact CG-CE2 4.26Å
158	L	97.8	Very high	95.4	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.016	16%	0.163	C	C	.	.			trans	-68.1	136.3	-177.1	-64.3	171	0	0	0	110.4	V135 A138 L153 N156 P162 L174 N177 F178 L179	V135-L158 HydrophobicContact CG1-CD2 3.89Å; V135-L158 PolarHBondContact O-N 3.49Å; V135-L158 VanDerWaalsContact O-N 3.08Å; A138-L158 HydrophobicContact CB-CD2 4.16Å; L153-L158 HydrophobicContact CB-CD1 3.98Å; L153-L158 HydrophobicContact CD1-CD1 4.19Å; N156-L158 HydrophobicContact CB-CG 4.47Å; L158-P162 HydrophobicContact CD1-CG 4.26Å; L158-L174 HydrophobicContact CD1-CD2 4.18Å; L158-N177 HydrophobicContact CB-CB 4.3Å; L158-N177 WeakPolarHBondContact CB-OD1 3.13Å; L158-N177 PolarHBondContact N-OD1 2.95Å; L158-F178 CarbonylContact O-C 3.42Å; L158-F178 VanDerWaalsContact O-CA 3.25Å; L158-F178 WeakPolarHBondContact O-CA 3.4Å; L158-F178 PolarHBondContact O-N 3.01Å; L158-L179 HydrophobicContact CB-CD2 3.7Å; L158-L179 HydrophobicContact CB-CG 4.49Å; L158-L179 PolarHBondContact O-N 3.17Å; L158-L179 VanDerWaalsContact O-N 3.15Å
159	W	96.5	Very high	95.4	Very high	124 Å²	124	34.1 Å²	34.1	47%	0.47	16%	0.163	S	C	.	.	S	Bend	trans	-106.9	-21.5	178.1	75.9	-86.6	0	0	0	113.5	L179 S180 Q181	W159-L179 WeakPolarHBondContact O-CA 3.09Å; W159-S180 PolarHBondContact O-N 3.34Å; W159-S180 PolarHBondContact O-OG 3.33Å; W159-Q181 HydrophobicContact CE3-CG 4.13Å; W159-Q181 HydrophobicContact CZ3-CG 3.86Å
160	T	96.1	Very high	95.4	Very high	26 Å²	26	34.6 Å²	34.6	16%	0.16	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-132.6	146.6	177.3	-173.6	0	0	0	0	109.8	L179 Q181	T160-L179 VanDerWaalsContact O-CD2 3.26Å; T160-L179 WeakPolarHBondContact O-CD2 3.24Å; T160-Q181 PolarHBondContact OG1-NE2 2.95Å
161	V	96.1	Very high	95.4	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.006	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-59.5	132.8	175.3	174.6	0	0	0	0	109.1	T163 M165 L174 L179 Q181 I182 T186 L187 F203	V161-T163 PolarHBondContact O-N 3.27Å; V161-M165 HydrophobicContact CG1-CE 3.74Å; V161-L174 HydrophobicContact CG1-CD1 3.94Å; V161-L174 HydrophobicContact CG2-CD1 4.18Å; V161-L179 HydrophobicContact CG2-CD1 4.1Å; V161-Q181 PolarHBondContact N-O 3.39Å; V161-I182 HydrophobicContact CB-CG2 4.41Å; V161-I182 HydrophobicContact CG2-CB 4.42Å; V161-I182 HydrophobicContact CG2-CD1 4.2Å; V161-I182 HydrophobicContact CG2-CG1 3.75Å; V161-I182 HydrophobicContact CG2-CG2 4.47Å; V161-T186 HydrophobicContact CB-CG2 4.28Å; V161-T186 HydrophobicContact CG1-CG2 3.68Å; V161-L187 HydrophobicContact CG1-CD2 4.16Å; V161-F203 HydrophobicContact CG2-CZ 3.94Å
162	P	93.6	Very high	95.5	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.019	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-58.2	131	-179.1	-25.4	34.5	0	0	0	112.2	A138 L153 L158 M165 L174 T186	A138-P162 HydrophobicContact CB-CB 4.17Å; A138-P162 HydrophobicContact CB-CG 4.04Å; L153-P162 HydrophobicContact CD1-CG 3.92Å; L158-P162 HydrophobicContact CD1-CG 4.26Å; P162-M165 HydrophobicContact CB-CG 4.34Å; P162-M165 WeakPolarHBondContact O-CE 3.37Å; P162-L174 HydrophobicContact CG-CD2 4.21Å; P162-T186 VanDerWaalsContact O-CG2 3.28Å; P162-T186 WeakPolarHBondContact O-CG2 3.19Å
163	T	88.8	Confident	95.5	Very high	45 Å²	45	33.5 Å²	33.5	28%	0.276	16%	0.164	S	C	.	.	B	Isolated β-bridge	trans	-82.7	159.2	174.8	58.4	0	0	0	0	111	V161 M165 L183	V161-T163 PolarHBondContact O-N 3.27Å; T163-M165 VanDerWaalsContact C-N 3.29Å; T163-M165 PolarHBondContact O-N 2.77Å; T163-L183 HydrophobicContact CG2-CD1 3.82Å
164	N	88.5	Confident	95.5	Very high	86 Å²	86	33.6 Å²	33.6	46%	0.46	17%	0.165	S	C	.	.	S	Bend	trans	58.6	35.6	177.2	-55	-52.5	0	0	0	114.3	L140 N142	L140-N164 WeakPolarHBondContact O-CB 3.36Å; N142-N164 WeakPolarHBondContact CA-O 3.28Å; N142-N164 PolarHBondContact N-O 3.33Å; N142-N164 VanDerWaalsContact N-O 3.16Å
165	M	91.6	Very high	95.5	Very high	7 Å²	7	33.2 Å²	33.2	3%	0.034	16%	0.162	C	C	.	.			trans	-58.2	148.7	169.4	-75.2	-175.1	-80.3	0	0	111.3	L140 L151 V161 P162 T163 V172 T186 L187 L190	L140-M165 HydrophobicContact CD1-CG 4.14Å; L151-M165 HydrophobicContact CD2-SD 4.5Å; V161-M165 HydrophobicContact CG1-CE 3.74Å; P162-M165 HydrophobicContact CB-CG 4.34Å; P162-M165 WeakPolarHBondContact O-CE 3.37Å; T163-M165 VanDerWaalsContact C-N 3.29Å; T163-M165 PolarHBondContact O-N 2.77Å; M165-V172 HydrophobicContact SD-CG1 4.02Å; M165-V172 HydrophobicContact SD-CG2 4.22Å; M165-T186 HydrophobicContact CE-CG2 4.28Å; M165-L187 HydrophobicContact CE-CD2 3.55Å; M165-L190 HydrophobicContact CB-CD1 4.33Å; M165-L190 HydrophobicContact CB-CD2 4.01Å; M165-L190 HydrophobicContact CE-CD1 3.74Å; M165-L190 HydrophobicContact SD-CD1 4.31Å
166	P	91.1	Very high	95.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.164	C	C	.	.			trans	-63.3	141.3	-179.6	-21.8	35.4	0	0	0	112.1	L145 L148 N168 I169 L190	L145-P166 HydrophobicContact CB-CB 4.27Å; L145-P166 HydrophobicContact CB-CG 3.57Å; L145-P166 HydrophobicContact CD1-CG 4.27Å; L145-P166 WeakPolarHBondContact O-CB 3.35Å; L148-P166 HydrophobicContact CB-CB 4.46Å; L148-P166 HydrophobicContact CB-CG 4.27Å; L148-P166 HydrophobicContact CD2-CG 4.02Å; P166-N168 VanDerWaalsContact C-N 3.33Å; P166-N168 PolarHBondContact O-N 2.83Å; P166-I169 WeakPolarHBondContact O-CB 3.46Å; P166-I169 WeakPolarHBondContact O-CG2 3.22Å; P166-I169 PolarHBondContact O-N 2.96Å; P166-L190 WeakPolarHBondContact O-CD2 3.24Å
167	Y	90.6	Very high	95.5	Very high	102 Å²	102	34 Å²	34	40%	0.4	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-25.6	-172.8	63.8	-86.8	0	0	0	114	I169	Y167-I169 VanDerWaalsContact C-N 3.29Å; Y167-I169 PolarHBondContact O-N 3.47Å
168	N	93.3	Very high	95.5	Very high	35 Å²	35	35.3 Å²	35.3	19%	0.187	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	4.6	-178.6	-80.6	-26.7	0	0	0	114.2	S146 L148 K149 P166	S146-N168 WeakPolarHBondContact O-CB 3.26Å; S146-N168 PolarHBondContact O-ND2 2.81Å; L148-N168 CarbonylContact O-C 3.59Å; K149-N168 WeakPolarHBondContact CD-O 3.37Å; K149-N168 PolarHBondContact NZ-O 3.28Å; P166-N168 VanDerWaalsContact C-N 3.33Å; P166-N168 PolarHBondContact O-N 2.83Å
169	I	95.5	Very high	95.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.169	C	C	.	.			trans	-69	135.9	-173.8	-157.9	158.8	0	0	0	111.2	L148 L151 P166 Y167 V172 L190 H192 L193	L148-I169 HydrophobicContact CD2-CD1 4.18Å; L148-I169 WeakPolarHBondContact O-CA 3.08Å; L148-I169 PolarHBondContact O-N 2.64Å; L151-I169 HydrophobicContact CB-CD1 3.54Å; L151-I169 HydrophobicContact CD2-CD1 4.15Å; P166-I169 WeakPolarHBondContact O-CB 3.46Å; P166-I169 WeakPolarHBondContact O-CG2 3.22Å; P166-I169 PolarHBondContact O-N 2.96Å; Y167-I169 VanDerWaalsContact C-N 3.29Å; Y167-I169 PolarHBondContact O-N 3.47Å; I169-V172 HydrophobicContact CD1-CG2 3.47Å; I169-V172 VanDerWaalsContact CD1-CG2 3.47Å; I169-V172 HydrophobicContact CG1-CG2 3.76Å; I169-V172 HydrophobicContact CG2-CG2 4.03Å; I169-L190 HydrophobicContact CG2-CD1 4.32Å; I169-L190 HydrophobicContact CG2-CD2 3.88Å; I169-L190 HydrophobicContact CG2-CG 4.48Å; I169-H192 CarbonylContact O-C 3.1Å; I169-H192 VanDerWaalsContact O-C 3.28Å; I169-L193 HydrophobicContact CG2-CD1 4.2Å; I169-L193 WeakPolarHBondContact O-CA 3.41Å; I169-L193 PolarHBondContact O-N 3.28Å
170	E	97.8	Very high	95.5	Very high	75 Å²	75	31.6 Å²	31.6	35%	0.35	16%	0.162	S	C	.	.			trans	-109.3	-32.6	-175.8	-73.3	170.6	-159.8	0	0	111.6	K149 H192 T194 S195	K149-E170 HydrophobicContact CD-CG 4.07Å; K149-E170 WeakPolarHBondContact CD-OE1 3.48Å; K149-E170 WeakPolarHBondContact CE-OE1 3.32Å; K149-E170 IonicContact NZ-OE1 2.82Å; K149-E170 PolarHBondContact NZ-OE1 2.76Å; K149-E170 PolarHBondContact O-N 3.3Å; E170-H192 WeakPolarHBondContact CA-O 3.18Å; E170-T194 WeakPolarHBondContact O-CA 3.22Å; E170-T194 PolarHBondContact O-N 3.19Å; E170-T194 PolarHBondContact O-OG1 3.21Å; E170-S195 PolarHBondContact O-N 3.13Å
171	T	98.6	Very high	95.5	Very high	27 Å²	27	33.5 Å²	33.5	17%	0.166	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	127.7	179.7	-62.1	0	0	0	0	110.6	K149 F150 L151 S195 Y197	K149-T171 PolarHBondContact O-N 3.26Å; F150-T171 HydrophobicContact CD2-CG2 3.59Å; F150-T171 HydrophobicContact CE2-CG2 3.65Å; L151-T171 PolarHBondContact N-O 2.81Å; T171-S195 WeakPolarHBondContact CA-O 3.49Å; T171-Y197 HydrophobicContact CG2-CE2 4.03Å
172	V	98.3	Very high	95.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	119.3	174.3	-175.1	0	0	0	0	109.1	L151 M165 I169 L174 L193 S195 L196 Y197	L151-V172 WeakPolarHBondContact O-CA 3.4Å; M165-V172 HydrophobicContact SD-CG1 4.02Å; M165-V172 HydrophobicContact SD-CG2 4.22Å; I169-V172 HydrophobicContact CD1-CG2 3.47Å; I169-V172 VanDerWaalsContact CD1-CG2 3.47Å; I169-V172 HydrophobicContact CG1-CG2 3.76Å; I169-V172 HydrophobicContact CG2-CG2 4.03Å; V172-L174 HydrophobicContact CG1-CD1 4.16Å; V172-L174 HydrophobicContact CG1-CD2 4.14Å; V172-L174 HydrophobicContact CG1-CG 3.8Å; V172-L193 HydrophobicContact CB-CD1 4.16Å; V172-L193 HydrophobicContact CG2-CD1 3.63Å; V172-S195 PolarHBondContact N-O 2.66Å; V172-L196 HydrophobicContact CB-CD1 4.17Å; V172-L196 HydrophobicContact CG1-CD1 4.47Å; V172-Y197 PolarHBondContact O-N 3.06Å
173	D	98.8	Very high	95.5	Very high	28 Å²	28	37.2 Å²	37.2	15%	0.15	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	111.9	171.8	-169.2	-9.1	0	0	0	110.9	L151 L153 S154 S175 Y197	L151-D173 PolarHBondContact O-N 2.63Å; L153-D173 CarbonylContact C-O 3.4Å; L153-D173 WeakPolarHBondContact CA-O 3.21Å; L153-D173 PolarHBondContact N-O 3.46Å; S154-D173 WeakPolarHBondContact CB-OD1 3.43Å; S154-D173 PolarHBondContact N-O 3.21Å; D173-S175 WeakPolarHBondContact OD1-CB 3.28Å; D173-S175 PolarHBondContact OD1-N 3.2Å; D173-S175 PolarHBondContact OD1-OG 3.32Å; D173-Y197 HydrophobicContact CB-CD2 3.97Å; D173-Y197 WeakPolarHBondContact OD1-CB 3.34Å
174	L	98.5	Very high	95.5	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	21%	0.213	C	C	.	.			trans	-117.4	15.2	175.2	-60.8	174	0	0	0	111.5	L153 L158 V161 P162 V172 N177 L179 Y197 L198 N201	L153-L174 HydrophobicContact CB-CD2 4Å; L153-L174 HydrophobicContact CD1-CD2 4.11Å; L158-L174 HydrophobicContact CD1-CD2 4.18Å; V161-L174 HydrophobicContact CG1-CD1 3.94Å; V161-L174 HydrophobicContact CG2-CD1 4.18Å; P162-L174 HydrophobicContact CG-CD2 4.21Å; V172-L174 HydrophobicContact CG1-CD1 4.16Å; V172-L174 HydrophobicContact CG1-CD2 4.14Å; V172-L174 HydrophobicContact CG1-CG 3.8Å; L174-N177 PolarHBondContact O-ND2 3.35Å; L174-L179 HydrophobicContact CB-CD1 3.69Å; L174-L179 HydrophobicContact CD1-CD1 4.07Å; L174-L179 HydrophobicContact CG-CD1 4.37Å; L174-Y197 CarbonylContact C-O 3.36Å; L174-Y197 WeakPolarHBondContact CA-O 3.43Å; L174-Y197 PolarHBondContact N-O 3.08Å; L174-L198 HydrophobicContact CB-CD2 4.14Å; L174-L198 HydrophobicContact CD1-CD2 3.98Å; L174-N201 PolarHBondContact O-ND2 3.25Å
175	S	98.6	Very high	95.5	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.021	22%	0.215	C	C	.	.			trans	-63.9	159.5	-178.1	66.7	0	0	0	0	112.1	S154 S155 D173 N177 Y197 H199	S154-S175 CarbonylContact C-O 3.28Å; S154-S175 WeakPolarHBondContact CA-O 3.43Å; S154-S175 WeakPolarHBondContact CB-O 3.42Å; S154-S175 WeakPolarHBondContact CB-OG 3.41Å; S155-S175 PolarHBondContact N-O 3.5Å; D173-S175 WeakPolarHBondContact OD1-CB 3.28Å; D173-S175 PolarHBondContact OD1-N 3.2Å; D173-S175 PolarHBondContact OD1-OG 3.32Å; S175-N177 PolarHBondContact O-N 2.9Å; S175-N177 PolarHBondContact O-ND2 3.48Å; S175-Y197 PolarHBondContact N-O 3.22Å; S175-H199 CarbonylContact C-O 3.5Å; S175-H199 VanDerWaalsContact CA-O 3.24Å; S175-H199 WeakPolarHBondContact CA-O 3.4Å; S175-H199 VanDerWaalsContact CB-CD2 3.47Å; S175-H199 WeakPolarHBondContact CB-CD2 3.32Å; S175-H199 VanDerWaalsContact CB-CE1 3.42Å; S175-H199 WeakPolarHBondContact CB-CE1 3.31Å; S175-H199 WeakPolarHBondContact CB-NE2 3.46Å
176	N	98.5	Very high	95.5	Very high	60 Å²	60	39.5 Å²	39.5	32%	0.321	22%	0.218	S	C	.	.	S	Bend	trans	56.5	49.4	174.9	-53.4	-78.8	0	0	0	112.2	S155 N156 H199 N200	S155-N176 WeakPolarHBondContact CA-O 3.29Å; S155-N176 PolarHBondContact N-O 3.31Å; N156-N176 PolarHBondContact N-O 3.24Å; N176-H199 PolarHBondContact N-O 3.5Å; N176-N200 VanDerWaalsContact CA-O 3.23Å; N176-N200 WeakPolarHBondContact CA-O 3.25Å; N176-N200 HydrophobicContact CB-CB 4.42Å; N176-N200 PolarHBondContact N-O 3.05Å; N176-N200 WeakPolarHBondContact OD1-CB 3.04Å; N176-N200 PolarHBondContact OD1-ND2 3.05Å
177	N	98.8	Very high	95.6	Very high	5 Å²	5	39.7 Å²	39.7	3%	0.027	22%	0.219	C	C	.	.	S	Bend	trans	-125.5	-167.7	176.3	-87	-84.1	0	0	0	109.3	L153 N156 K157 L158 L174 S175 L179 N200 N201	L153-N177 PolarHBondContact O-ND2 2.87Å; N156-N177 VanDerWaalsContact CA-OD1 3.28Å; N156-N177 WeakPolarHBondContact CA-OD1 3.08Å; N156-N177 WeakPolarHBondContact CB-OD1 3.36Å; N156-N177 PolarHBondContact N-OD1 3.38Å; N156-N177 PolarHBondContact O-OD1 2.94Å; K157-N177 PolarHBondContact N-OD1 3.21Å; L158-N177 HydrophobicContact CB-CB 4.3Å; L158-N177 WeakPolarHBondContact CB-OD1 3.13Å; L158-N177 PolarHBondContact N-OD1 2.95Å; L174-N177 PolarHBondContact O-ND2 3.35Å; S175-N177 PolarHBondContact O-N 2.9Å; S175-N177 PolarHBondContact O-ND2 3.48Å; N177-L179 HydrophobicContact CB-CG 3.98Å; N177-N200 PolarHBondContact N-O 3.03Å; N177-N201 VanDerWaalsContact CA-OD1 3.3Å; N177-N201 WeakPolarHBondContact CA-OD1 3.25Å; N177-N201 WeakPolarHBondContact CB-OD1 3.5Å; N177-N201 PolarHBondContact N-OD1 3.45Å; N177-N201 PolarHBondContact O-OD1 3.29Å
178	F	98.3	Very high	95.6	Very high	111 Å²	111	39.2 Å²	39.2	49%	0.487	22%	0.223	S	C	.	.			trans	-112.3	29.2	176.2	-59.9	-93.6	0	0	0	111.3	K157 L158 S180 K202	K157-F178 HydrophobicContact CG-CE2 4.26Å; L158-F178 CarbonylContact O-C 3.42Å; L158-F178 VanDerWaalsContact O-CA 3.25Å; L158-F178 WeakPolarHBondContact O-CA 3.4Å; L158-F178 PolarHBondContact O-N 3.01Å; F178-S180 PolarHBondContact O-N 2.97Å; F178-K202 HydrophobicContact CB-CG 4.45Å
179	L	98.3	Very high	95.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.245	C	C	.	.			trans	-64.4	122.6	-174.5	-61.5	176.9	0	0	0	110.6	L158 W159 T160 V161 L174 N177 L198 N201 K202 F203	L158-L179 HydrophobicContact CB-CD2 3.7Å; L158-L179 HydrophobicContact CB-CG 4.49Å; L158-L179 PolarHBondContact O-N 3.17Å; L158-L179 VanDerWaalsContact O-N 3.15Å; W159-L179 WeakPolarHBondContact O-CA 3.09Å; T160-L179 VanDerWaalsContact O-CD2 3.26Å; T160-L179 WeakPolarHBondContact O-CD2 3.24Å; V161-L179 HydrophobicContact CG2-CD1 4.1Å; L174-L179 HydrophobicContact CB-CD1 3.69Å; L174-L179 HydrophobicContact CD1-CD1 4.07Å; L174-L179 HydrophobicContact CG-CD1 4.37Å; N177-L179 HydrophobicContact CB-CG 3.98Å; L179-L198 HydrophobicContact CD1-CD2 4.33Å; L179-N201 HydrophobicContact CB-CB 4.12Å; L179-N201 VanDerWaalsContact CB-OD1 3.22Å; L179-N201 WeakPolarHBondContact CB-OD1 3.33Å; L179-N201 VanDerWaalsContact CG-OD1 3.25Å; L179-N201 WeakPolarHBondContact CG-OD1 3.15Å; L179-N201 PolarHBondContact N-OD1 3.37Å; L179-K202 CarbonylContact O-C 3.55Å; L179-K202 WeakPolarHBondContact O-CA 3.27Å; L179-K202 PolarHBondContact O-N 3.48Å; L179-F203 HydrophobicContact CB-CD2 4.42Å; L179-F203 HydrophobicContact CB-CE1 4.16Å; L179-F203 HydrophobicContact CB-CE2 3.62Å; L179-F203 HydrophobicContact CB-CZ 3.48Å; L179-F203 VanDerWaalsContact CB-CZ 3.48Å; L179-F203 HydrophobicContact CD1-CE2 4.12Å; L179-F203 HydrophobicContact CD1-CZ 4.06Å; L179-F203 HydrophobicContact CG-CZ 4.4Å; L179-F203 PolarHBondContact O-N 3.39Å; L179-F203 VanDerWaalsContact O-N 3.08Å
180	S	96.9	Very high	95.4	Very high	49 Å²	49	45.7 Å²	45.7	34%	0.343	25%	0.245	S	C	.	.			trans	-115	-16.7	176.8	59.7	0	0	0	0	113.3	W159 F178	W159-S180 PolarHBondContact O-N 3.34Å; W159-S180 PolarHBondContact O-OG 3.33Å; F178-S180 PolarHBondContact O-N 2.97Å
181	Q	94.2	Very high	95.2	Very high	65 Å²	65	46.8 Å²	46.8	30%	0.304	25%	0.25	S	S	.	.	B	Isolated β-bridge	trans	-144.3	151.1	-173.6	59.8	169.8	46.1	0	0	113.4	W159 T160 V161	W159-Q181 HydrophobicContact CE3-CG 4.13Å; W159-Q181 HydrophobicContact CZ3-CG 3.86Å; T160-Q181 PolarHBondContact OG1-NE2 2.95Å; V161-Q181 PolarHBondContact N-O 3.39Å
182	I	96.1	Very high	95.1	Very high	8 Å²	8	48.8 Å²	48.8	4%	0.041	26%	0.258	C	S	.	.			trans	-117.2	122.2	167.4	-48.7	-167.4	0	0	0	106.4	V161 L187 F203 I206 P207 F211	V161-I182 HydrophobicContact CB-CG2 4.41Å; V161-I182 HydrophobicContact CG2-CB 4.42Å; V161-I182 HydrophobicContact CG2-CD1 4.2Å; V161-I182 HydrophobicContact CG2-CG1 3.75Å; V161-I182 HydrophobicContact CG2-CG2 4.47Å; I182-L187 HydrophobicContact CD1-CD1 4.08Å; I182-L187 HydrophobicContact CG2-CD1 4.23Å; I182-L187 HydrophobicContact CG2-CG 4.22Å; I182-F203 HydrophobicContact CD1-CE1 4.2Å; I182-F203 HydrophobicContact CD1-CZ 4.31Å; I182-F203 HydrophobicContact CG1-CE1 3.59Å; I182-F203 HydrophobicContact CG1-CZ 4Å; I182-I206 HydrophobicContact CD1-CD1 3.79Å; I182-I206 HydrophobicContact CD1-CG2 4.39Å; I182-I206 HydrophobicContact CG1-CD1 4.47Å; I182-P207 HydrophobicContact CB-CG 4.2Å; I182-P207 WeakPolarHBondContact O-CG 3.29Å; I182-F211 HydrophobicContact CD1-CE1 4.24Å
183	L	93.8	Very high	95.1	Very high	74 Å²	74	48.8 Å²	48.8	39%	0.387	26%	0.258	S	S	.	.			trans	-71.5	142	176.8	-64.3	173.8	0	0	0	109.9	T163 G185 T186	T163-L183 HydrophobicContact CG2-CD1 3.82Å; L183-G185 PolarHBondContact O-N 2.75Å; L183-T186 WeakPolarHBondContact CB-OG1 3.46Å; L183-T186 WeakPolarHBondContact O-CB 3.31Å; L183-T186 PolarHBondContact O-N 3.38Å; L183-T186 VanDerWaalsContact O-N 3.07Å; L183-T186 PolarHBondContact O-OG1 2.9Å
184	P	89.9	Confident	95	Very high	121 Å²	121	48.8 Å²	48.8	79%	0.786	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	134	178.4	-27.8	35.1	0	0	0	112.3	T186	P184-T186 VanDerWaalsContact C-N 3.27Å; P184-T186 PolarHBondContact O-N 2.9Å
185	G	87.6	Confident	95.1	Very high	50 Å²	50	49.5 Å²	49.5	52%	0.515	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	-5.4	-179.8	0	0	0	0	0	115.9	L183 L187 L188	L183-G185 PolarHBondContact O-N 2.75Å; G185-L187 VanDerWaalsContact C-N 3.33Å; G185-L187 PolarHBondContact O-N 2.91Å; G185-L188 WeakPolarHBondContact O-CB 3.29Å; G185-L188 PolarHBondContact O-N 2.83Å
186	T	92.3	Very high	95	Very high	15 Å²	15	49.4 Å²	49.4	9%	0.092	26%	0.263	C	S	.	.	S	Bend	trans	-57.6	-42	-177.7	-62.8	0	0	0	0	113.2	V161 P162 M165 L183 P184	V161-T186 HydrophobicContact CB-CG2 4.28Å; V161-T186 HydrophobicContact CG1-CG2 3.68Å; P162-T186 VanDerWaalsContact O-CG2 3.28Å; P162-T186 WeakPolarHBondContact O-CG2 3.19Å; M165-T186 HydrophobicContact CE-CG2 4.28Å; L183-T186 WeakPolarHBondContact CB-OG1 3.46Å; L183-T186 WeakPolarHBondContact O-CB 3.31Å; L183-T186 PolarHBondContact O-N 3.38Å; L183-T186 VanDerWaalsContact O-N 3.07Å; L183-T186 PolarHBondContact O-OG1 2.9Å; P184-T186 VanDerWaalsContact C-N 3.27Å; P184-T186 PolarHBondContact O-N 2.9Å
187	L	93.8	Very high	95.1	Very high	5 Å²	5	49.9 Å²	49.9	3%	0.026	26%	0.261	C	S	.	.	S	Bend	trans	-98.6	-6.4	-176.8	-59.4	179.7	0	0	0	113.5	V161 M165 I182 G185 R189 L190 L196 A210 F211 L214	V161-L187 HydrophobicContact CG1-CD2 4.16Å; M165-L187 HydrophobicContact CE-CD2 3.55Å; I182-L187 HydrophobicContact CD1-CD1 4.08Å; I182-L187 HydrophobicContact CG2-CD1 4.23Å; I182-L187 HydrophobicContact CG2-CG 4.22Å; G185-L187 VanDerWaalsContact C-N 3.33Å; G185-L187 PolarHBondContact O-N 2.91Å; L187-R189 PolarHBondContact O-N 3.02Å; L187-L190 HydrophobicContact CD2-CD1 3.74Å; L187-L190 PolarHBondContact O-N 2.98Å; L187-L190 VanDerWaalsContact O-N 3.12Å; L187-L196 HydrophobicContact CD1-CD2 4.37Å; L187-A210 WeakPolarHBondContact CB-O 3.32Å; L187-F211 HydrophobicContact CD1-CD1 3.83Å; L187-F211 HydrophobicContact CD1-CE1 3.63Å; L187-L214 HydrophobicContact CB-CD2 4.47Å
188	L	90.6	Very high	95	Very high	91 Å²	91	49.8 Å²	49.8	48%	0.476	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.6	-170.3	-167.6	79.3	0	0	0	113.5	G185 Q213	G185-L188 WeakPolarHBondContact O-CB 3.29Å; G185-L188 PolarHBondContact O-N 2.83Å; L188-Q213 HydrophobicContact CD1-CB 4.35Å; L188-Q213 HydrophobicContact CD1-CG 3.34Å; L188-Q213 HydrophobicContact CG-CG 3.93Å; L188-Q213 VanDerWaalsContact O-CB 3.29Å; L188-Q213 WeakPolarHBondContact O-CB 3.45Å
189	R	89.2	Confident	95	Very high	170 Å²	170	45.5 Å²	45.5	64%	0.642	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-2.9	-174.1	-53.5	-178.3	99.6	170.1	5.9	113.5	L187 Q191	L187-R189 PolarHBondContact O-N 3.02Å; R189-Q191 VanDerWaalsContact C-N 3.27Å; R189-Q191 PolarHBondContact O-N 3.09Å; R189-Q191 VanDerWaalsContact O-N 3.12Å
190	L	94.6	Very high	95	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	25%	0.254	C	S	.	.			trans	-90.8	57	-172.5	-51.2	-174.7	0	0	0	111.5	M165 P166 I169 L187 H192 L193 L214	M165-L190 HydrophobicContact CB-CD1 4.33Å; M165-L190 HydrophobicContact CB-CD2 4.01Å; M165-L190 HydrophobicContact CE-CD1 3.74Å; M165-L190 HydrophobicContact SD-CD1 4.31Å; P166-L190 WeakPolarHBondContact O-CD2 3.24Å; I169-L190 HydrophobicContact CG2-CD1 4.32Å; I169-L190 HydrophobicContact CG2-CD2 3.88Å; I169-L190 HydrophobicContact CG2-CG 4.48Å; L187-L190 HydrophobicContact CD2-CD1 3.74Å; L187-L190 PolarHBondContact O-N 2.98Å; L187-L190 VanDerWaalsContact O-N 3.12Å; L190-H192 PolarHBondContact O-N 3.08Å; L190-L193 HydrophobicContact CB-CB 4.06Å; L190-L193 HydrophobicContact CB-CD2 4.42Å; L190-L193 HydrophobicContact CD1-CD2 4.28Å; L190-L193 VanDerWaalsContact O-CB 3.27Å; L190-L193 WeakPolarHBondContact O-CB 3.48Å; L190-L193 PolarHBondContact O-N 2.82Å; L190-L193 VanDerWaalsContact O-N 3.16Å; L190-L214 HydrophobicContact CB-CD2 3.98Å; L190-L214 WeakPolarHBondContact O-CD2 3.28Å
191	Q	94.1	Very high	95.1	Very high	97 Å²	97	45.6 Å²	45.6	45%	0.453	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-21.7	-175	-64.4	179	-0.7	0	0	113.4	R189 Q216	R189-Q191 VanDerWaalsContact C-N 3.27Å; R189-Q191 PolarHBondContact O-N 3.09Å; R189-Q191 VanDerWaalsContact O-N 3.12Å; Q191-Q216 WeakPolarHBondContact O-CB 2.97Å; Q191-Q216 VanDerWaalsContact O-CG 3.31Å; Q191-Q216 WeakPolarHBondContact O-CG 3.06Å
192	H	96.1	Very high	95.3	Very high	70 Å²	70	47.8 Å²	47.8	32%	0.324	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	0.3	178	-66.6	-63.1	0	0	0	114.1	I169 E170 L190 T194 Q216	I169-H192 CarbonylContact O-C 3.1Å; I169-H192 VanDerWaalsContact O-C 3.28Å; E170-H192 WeakPolarHBondContact CA-O 3.18Å; L190-H192 PolarHBondContact O-N 3.08Å; H192-T194 PolarHBondContact O-N 2.99Å; H192-Q216 PolarHBondContact ND1-OE1 3.15Å
193	L	97.8	Very high	95.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.245	C	C	.	.			trans	-69.6	120.6	-177	-170.4	67.3	0	0	0	110.2	I169 V172 L190 L196 L214 Q216 L217	I169-L193 HydrophobicContact CG2-CD1 4.2Å; I169-L193 WeakPolarHBondContact O-CA 3.41Å; I169-L193 PolarHBondContact O-N 3.28Å; V172-L193 HydrophobicContact CB-CD1 4.16Å; V172-L193 HydrophobicContact CG2-CD1 3.63Å; L190-L193 HydrophobicContact CB-CB 4.06Å; L190-L193 HydrophobicContact CB-CD2 4.42Å; L190-L193 HydrophobicContact CD1-CD2 4.28Å; L190-L193 VanDerWaalsContact O-CB 3.27Å; L190-L193 WeakPolarHBondContact O-CB 3.48Å; L190-L193 PolarHBondContact O-N 2.82Å; L190-L193 VanDerWaalsContact O-N 3.16Å; L193-L196 HydrophobicContact CD2-CB 4.01Å; L193-L196 HydrophobicContact CD2-CD1 4.32Å; L193-L196 HydrophobicContact CD2-CD2 4.13Å; L193-L196 HydrophobicContact CD2-CG 4.37Å; L193-L214 HydrophobicContact CB-CD2 4.29Å; L193-L214 HydrophobicContact CD2-CD1 4.27Å; L193-L214 HydrophobicContact CD2-CD2 4.01Å; L193-Q216 CarbonylContact O-C 3.1Å; L193-L217 HydrophobicContact CD2-CD1 4.36Å; L193-L217 HydrophobicContact CG-CD1 4.2Å; L193-L217 VanDerWaalsContact O-CA 3.26Å; L193-L217 WeakPolarHBondContact O-CA 3.06Å; L193-L217 PolarHBondContact O-N 3.09Å; L193-L217 VanDerWaalsContact O-N 3.14Å
194	T	98.3	Very high	95.5	Very high	28 Å²	28	46.5 Å²	46.5	17%	0.172	24%	0.242	C	C	.	.			trans	-102.8	-34.5	178.9	67.2	0	0	0	0	112.2	E170 H192 Q216 Q218 V219	E170-T194 WeakPolarHBondContact O-CA 3.22Å; E170-T194 PolarHBondContact O-N 3.19Å; E170-T194 PolarHBondContact O-OG1 3.21Å; H192-T194 PolarHBondContact O-N 2.99Å; T194-Q216 WeakPolarHBondContact CA-O 2.97Å; T194-Q218 WeakPolarHBondContact O-CA 3.41Å; T194-Q218 PolarHBondContact O-N 2.03Å; T194-V219 PolarHBondContact O-N 3.47Å
195	S	98.6	Very high	95.8	Very high	16 Å²	16	44.6 Å²	44.6	11%	0.112	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	123.7	-175.4	-60.9	0	0	0	0	111	E170 T171 V172 V219	E170-S195 PolarHBondContact O-N 3.13Å; T171-S195 WeakPolarHBondContact CA-O 3.49Å; V172-S195 PolarHBondContact N-O 2.66Å; S195-V219 WeakPolarHBondContact CA-O 3.47Å
196	L	98.5	Very high	96.2	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	110.8	179.4	179.9	57.3	0	0	0	111.4	V172 L187 L193 L198 F211 L214 L217 V219 V220 T221	V172-L196 HydrophobicContact CB-CD1 4.17Å; V172-L196 HydrophobicContact CG1-CD1 4.47Å; L187-L196 HydrophobicContact CD1-CD2 4.37Å; L193-L196 HydrophobicContact CD2-CB 4.01Å; L193-L196 HydrophobicContact CD2-CD1 4.32Å; L193-L196 HydrophobicContact CD2-CD2 4.13Å; L193-L196 HydrophobicContact CD2-CG 4.37Å; L196-L198 HydrophobicContact CD1-CD2 4.23Å; L196-L198 HydrophobicContact CD1-CG 4.22Å; L196-L198 HydrophobicContact CD2-CD1 3.93Å; L196-L198 HydrophobicContact CD2-CG 4.38Å; L196-L198 HydrophobicContact CG-CD1 4.07Å; L196-L198 HydrophobicContact CG-CG 3.98Å; L196-F211 HydrophobicContact CD2-CE1 4.09Å; L196-L214 HydrophobicContact CD2-CD1 4.24Å; L196-L217 HydrophobicContact CB-CD1 3.92Å; L196-V219 PolarHBondContact N-O 2.03Å; L196-V220 HydrophobicContact CB-CG2 4.44Å; L196-V220 VanDerWaalsContact O-CA 3.28Å; L196-V220 WeakPolarHBondContact O-CA 3.23Å; L196-T221 PolarHBondContact O-N 2.92Å
197	Y	98.7	Very high	96.3	Very high	70 Å²	70	42.9 Å²	42.9	28%	0.275	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	112.4	-179.8	-54.8	-87.7	0	0	0	111.1	T171 V172 D173 L174 S175 T221	T171-Y197 HydrophobicContact CG2-CE2 4.03Å; V172-Y197 PolarHBondContact O-N 3.06Å; D173-Y197 HydrophobicContact CB-CD2 3.97Å; D173-Y197 WeakPolarHBondContact OD1-CB 3.34Å; L174-Y197 CarbonylContact C-O 3.36Å; L174-Y197 WeakPolarHBondContact CA-O 3.43Å; L174-Y197 PolarHBondContact N-O 3.08Å; S175-Y197 PolarHBondContact N-O 3.22Å; Y197-T221 VanDerWaalsContact CA-OG1 3.31Å; Y197-T221 WeakPolarHBondContact CA-OG1 3.31Å; Y197-T221 HydrophobicContact CD1-CG2 3.5Å; Y197-T221 HydrophobicContact CE1-CG2 4Å
198	L	98.3	Very high	96.3	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.01	23%	0.226	C	C	.	.			trans	-121	7.9	179.7	-63.2	170.5	0	0	0	113.5	L174 L179 L196 N201 F203 F211 T221 L222 N225	L174-L198 HydrophobicContact CB-CD2 4.14Å; L174-L198 HydrophobicContact CD1-CD2 3.98Å; L179-L198 HydrophobicContact CD1-CD2 4.33Å; L196-L198 HydrophobicContact CD1-CD2 4.23Å; L196-L198 HydrophobicContact CD1-CG 4.22Å; L196-L198 HydrophobicContact CD2-CD1 3.93Å; L196-L198 HydrophobicContact CD2-CG 4.38Å; L196-L198 HydrophobicContact CG-CD1 4.07Å; L196-L198 HydrophobicContact CG-CG 3.98Å; L198-N201 PolarHBondContact O-ND2 3.11Å; L198-F203 HydrophobicContact CB-CE2 4.24Å; L198-F203 HydrophobicContact CD2-CE2 3.95Å; L198-F203 HydrophobicContact CD2-CZ 4.29Å; L198-F203 HydrophobicContact CG-CE2 4.49Å; L198-F211 HydrophobicContact CD1-CE1 4.28Å; L198-F211 HydrophobicContact CD1-CZ 3.91Å; L198-T221 CarbonylContact C-O 3.56Å; L198-T221 WeakPolarHBondContact CA-O 3.14Å; L198-T221 WeakPolarHBondContact CB-O 3.31Å; L198-T221 PolarHBondContact N-O 3.02Å; L198-T221 PolarHBondContact N-OG1 3.03Å; L198-L222 HydrophobicContact CB-CD2 4.4Å; L198-L222 HydrophobicContact CD1-CD2 4.24Å; L198-N225 PolarHBondContact O-ND2 3.24Å
199	H	98.1	Very high	96.4	Very high	22 Å²	22	50.4 Å²	50.4	10%	0.102	23%	0.234	C	C	.	.			trans	-67.4	160.6	-178.5	69.8	89.1	0	0	0	112.8	S175 N176 N201 T221 Y223	S175-H199 CarbonylContact C-O 3.5Å; S175-H199 VanDerWaalsContact CA-O 3.24Å; S175-H199 WeakPolarHBondContact CA-O 3.4Å; S175-H199 VanDerWaalsContact CB-CD2 3.47Å; S175-H199 WeakPolarHBondContact CB-CD2 3.32Å; S175-H199 VanDerWaalsContact CB-CE1 3.42Å; S175-H199 WeakPolarHBondContact CB-CE1 3.31Å; S175-H199 WeakPolarHBondContact CB-NE2 3.46Å; N176-H199 PolarHBondContact N-O 3.5Å; H199-N201 PolarHBondContact O-ND2 3.4Å; H199-T221 PolarHBondContact CD2-OG1 2.99Å; H199-T221 PolarHBondContact N-O 2.99Å; H199-T221 PolarHBondContact N-OG1 3.39Å; H199-Y223 VanDerWaalsContact CA-O 3.25Å; H199-Y223 WeakPolarHBondContact CA-O 3.41Å; H199-Y223 HydrophobicContact CB-CD1 3.59Å; H199-Y223 HydrophobicContact CB-CD2 3.88Å; H199-Y223 HydrophobicContact CB-CE1 3.36Å; H199-Y223 HydrophobicContact CB-CE2 3.67Å; H199-Y223 HydrophobicContact CB-CG 3.84Å; H199-Y223 VanDerWaalsContact CB-CZ 3.41Å; H199-Y223 WeakPolarHBondContact CB-O 3.07Å; H199-Y223 AromaticContact CD2-CE1 3.83Å; H199-Y223 AromaticContact CD2-CZ 3.74Å; H199-Y223 PolarHBondContact CD2-OH 2.89Å; H199-Y223 AromaticContact CE1-CZ 3.85Å; H199-Y223 PolarHBondContact CE1-OH 3.03Å; H199-Y223 AromaticContact CG-CE1 3.53Å; H199-Y223 AromaticContact CG-CE2 3.77Å; H199-Y223 AromaticContact CG-CZ 3.24Å; H199-Y223 VanDerWaalsContact CG-OH 3.27Å; H199-Y223 AromaticContact ND1-CE2 3.62Å; H199-Y223 AromaticContact ND1-CZ 3.34Å; H199-Y223 VanDerWaalsContact ND1-CZ 3.34Å; H199-Y223 PolarHBondContact ND1-OH 2.91Å; H199-Y223 PolarHBondContact NE2-OH 3.1Å
200	N	98.2	Very high	96.7	Very high	49 Å²	49	43.1 Å²	43.1	26%	0.262	21%	0.21	S	C	.	.	S	Bend	trans	54.2	53.5	-178.4	-62.1	-32.2	0	0	0	112.1	N176 N177 Y223 N224	N176-N200 VanDerWaalsContact CA-O 3.23Å; N176-N200 WeakPolarHBondContact CA-O 3.25Å; N176-N200 HydrophobicContact CB-CB 4.42Å; N176-N200 PolarHBondContact N-O 3.05Å; N176-N200 WeakPolarHBondContact OD1-CB 3.04Å; N176-N200 PolarHBondContact OD1-ND2 3.05Å; N177-N200 PolarHBondContact N-O 3.03Å; N200-Y223 PolarHBondContact N-O 3.05Å; N200-N224 WeakPolarHBondContact CA-O 3.28Å; N200-N224 PolarHBondContact N-O 3.38Å; N200-N224 WeakPolarHBondContact OD1-CB 3.25Å; N200-N224 PolarHBondContact OD1-ND2 2.9Å
201	N	98.7	Very high	96.8	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.011	21%	0.21	C	C	.	.	S	Bend	trans	-126.2	-164.5	176.9	-87.3	-67.7	0	0	0	110.1	L174 N177 L179 L198 H199 F203 N224 N225	L174-N201 PolarHBondContact O-ND2 3.25Å; N177-N201 VanDerWaalsContact CA-OD1 3.3Å; N177-N201 WeakPolarHBondContact CA-OD1 3.25Å; N177-N201 WeakPolarHBondContact CB-OD1 3.5Å; N177-N201 PolarHBondContact N-OD1 3.45Å; N177-N201 PolarHBondContact O-OD1 3.29Å; L179-N201 HydrophobicContact CB-CB 4.12Å; L179-N201 VanDerWaalsContact CB-OD1 3.22Å; L179-N201 WeakPolarHBondContact CB-OD1 3.33Å; L179-N201 VanDerWaalsContact CG-OD1 3.25Å; L179-N201 WeakPolarHBondContact CG-OD1 3.15Å; L179-N201 PolarHBondContact N-OD1 3.37Å; L198-N201 PolarHBondContact O-ND2 3.11Å; H199-N201 PolarHBondContact O-ND2 3.4Å; N201-F203 HydrophobicContact CB-CD2 3.81Å; N201-F203 HydrophobicContact CB-CE2 4.01Å; N201-N224 PolarHBondContact N-O 3.18Å; N201-N225 VanDerWaalsContact CA-OD1 3.25Å; N201-N225 WeakPolarHBondContact CA-OD1 3.42Å; N201-N225 WeakPolarHBondContact CB-OD1 3.5Å; N201-N225 PolarHBondContact N-OD1 2.91Å; N201-N225 PolarHBondContact O-OD1 2.89Å
202	K	98.1	Very high	96.8	Very high	110 Å²	110	41.6 Å²	41.6	48%	0.478	21%	0.205	S	C	.	.			trans	-120.8	25.6	-177.3	-56.7	-62.1	173.9	-167.3	0	112.1	F178 L179 T204 N225	F178-K202 HydrophobicContact CB-CG 4.45Å; L179-K202 CarbonylContact O-C 3.55Å; L179-K202 WeakPolarHBondContact O-CA 3.27Å; L179-K202 PolarHBondContact O-N 3.48Å; K202-T204 PolarHBondContact O-N 3.03Å; K202-N225 PolarHBondContact N-OD1 2.93Å
203	F	97.6	Very high	96.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.203	C	C	.	.			trans	-67.3	129.9	177.8	-70	-68.9	0	0	0	110.8	V161 L179 I182 L198 N201 I206 N225 P226 W227	V161-F203 HydrophobicContact CG2-CZ 3.94Å; L179-F203 HydrophobicContact CB-CD2 4.42Å; L179-F203 HydrophobicContact CB-CE1 4.16Å; L179-F203 HydrophobicContact CB-CE2 3.62Å; L179-F203 HydrophobicContact CB-CZ 3.48Å; L179-F203 VanDerWaalsContact CB-CZ 3.48Å; L179-F203 HydrophobicContact CD1-CE2 4.12Å; L179-F203 HydrophobicContact CD1-CZ 4.06Å; L179-F203 HydrophobicContact CG-CZ 4.4Å; L179-F203 PolarHBondContact O-N 3.39Å; L179-F203 VanDerWaalsContact O-N 3.08Å; I182-F203 HydrophobicContact CD1-CE1 4.2Å; I182-F203 HydrophobicContact CD1-CZ 4.31Å; I182-F203 HydrophobicContact CG1-CE1 3.59Å; I182-F203 HydrophobicContact CG1-CZ 4Å; L198-F203 HydrophobicContact CB-CE2 4.24Å; L198-F203 HydrophobicContact CD2-CE2 3.95Å; L198-F203 HydrophobicContact CD2-CZ 4.29Å; L198-F203 HydrophobicContact CG-CE2 4.49Å; N201-F203 HydrophobicContact CB-CD2 3.81Å; N201-F203 HydrophobicContact CB-CE2 4.01Å; F203-I206 HydrophobicContact CD1-CD1 4.07Å; F203-I206 HydrophobicContact CE1-CD1 4.39Å; F203-I206 HydrophobicContact CG-CD1 4.21Å; F203-N225 HydrophobicContact CB-CB 4.32Å; F203-N225 WeakPolarHBondContact CD2-OD1 3.5Å; F203-N225 PolarHBondContact N-OD1 2.72Å; F203-P226 CarbonylContact O-C 3.48Å; F203-P226 VanDerWaalsContact O-CD 3.28Å; F203-P226 WeakPolarHBondContact O-CD 3.28Å; F203-W227 HydrophobicContact CB-CE3 4.31Å; F203-W227 HydrophobicContact CB-CH2 3.59Å; F203-W227 HydrophobicContact CB-CZ2 4.45Å; F203-W227 HydrophobicContact CB-CZ3 3.51Å; F203-W227 HydrophobicContact CG-CH2 4.32Å
204	T	96.4	Very high	96.6	Very high	55 Å²	55	41.7 Å²	41.7	34%	0.337	21%	0.206	S	C	.	.	S	Bend	trans	-97.4	-30.1	170.3	53.5	0	0	0	0	111.5	K202 P226 W227 S228 I235	K202-T204 PolarHBondContact O-N 3.03Å; T204-P226 WeakPolarHBondContact CA-O 3.24Å; T204-W227 WeakPolarHBondContact O-CA 3.35Å; T204-S228 PolarHBondContact O-N 2.75Å; T204-I235 VanDerWaalsContact O-CD1 3.28Å; T204-I235 WeakPolarHBondContact O-CD1 3.44Å
205	Y	95.8	Very high	96.4	Very high	82 Å²	82	47 Å²	47	32%	0.322	23%	0.226	S	C	.	.			trans	-153.2	172.5	172.5	66.8	-84.6	0	0	0	109.5	P207 N234	Y205-P207 HydrophobicContact CE2-CG 4.26Å; Y205-N234 HydrophobicContact CD1-CB 4.02Å; Y205-N234 HydrophobicContact CD2-CB 3.73Å; Y205-N234 HydrophobicContact CE2-CB 4.29Å; Y205-N234 HydrophobicContact CG-CB 3.59Å
206	I	95.9	Very high	96.3	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.242	C	C	.	.			trans	-114.3	130.8	168.5	-62.1	-61.6	0	0	0	107.6	I182 F203 A210 F211 W227 Y237 L238	I182-I206 HydrophobicContact CD1-CD1 3.79Å; I182-I206 HydrophobicContact CD1-CG2 4.39Å; I182-I206 HydrophobicContact CG1-CD1 4.47Å; F203-I206 HydrophobicContact CD1-CD1 4.07Å; F203-I206 HydrophobicContact CE1-CD1 4.39Å; F203-I206 HydrophobicContact CG-CD1 4.21Å; I206-A210 HydrophobicContact CG2-CB 3.65Å; I206-F211 HydrophobicContact CB-CE2 4.33Å; I206-F211 HydrophobicContact CB-CZ 4.5Å; I206-F211 HydrophobicContact CD1-CE2 4.48Å; I206-F211 HydrophobicContact CD1-CZ 3.99Å; I206-F211 HydrophobicContact CG1-CE2 3.98Å; I206-F211 HydrophobicContact CG1-CZ 4Å; I206-F211 HydrophobicContact CG2-CD2 4.18Å; I206-F211 HydrophobicContact CG2-CE1 4.23Å; I206-F211 HydrophobicContact CG2-CE2 3.73Å; I206-F211 HydrophobicContact CG2-CZ 3.76Å; I206-W227 HydrophobicContact CD1-CH2 4.01Å; I206-W227 HydrophobicContact CD1-CZ3 4.16Å; I206-W227 HydrophobicContact CG1-CH2 3.97Å; I206-W227 HydrophobicContact CG1-CZ3 3.91Å; I206-Y237 HydrophobicContact CG2-CD1 4.44Å; I206-Y237 HydrophobicContact CG2-CE1 4.01Å; I206-L238 HydrophobicContact CB-CD1 4.19Å; I206-L238 HydrophobicContact CG1-CD1 3.87Å; I206-L238 HydrophobicContact CG1-CD2 4.09Å; I206-L238 HydrophobicContact CG1-CG 4.48Å
207	P	95.1	Very high	96.3	Very high	28 Å²	28	51.3 Å²	51.3	18%	0.182	25%	0.245	C	C	.	.			trans	-58.9	148.2	179.5	-21.9	30.6	0	0	0	112.8	I182 Y205 K209 A210 Y237	I182-P207 HydrophobicContact CB-CG 4.2Å; I182-P207 WeakPolarHBondContact O-CG 3.29Å; Y205-P207 HydrophobicContact CE2-CG 4.26Å; P207-K209 PolarHBondContact O-N 3.07Å; P207-A210 WeakPolarHBondContact O-CB 3.43Å; P207-A210 PolarHBondContact O-N 2.88Å; P207-A210 VanDerWaalsContact O-N 3.13Å; P207-Y237 WeakPolarHBondContact O-CD1 3.3Å; P207-Y237 WeakPolarHBondContact O-CE1 3.19Å
208	D	93.6	Very high	96.2	Very high	106 Å²	106	54.1 Å²	54.1	57%	0.567	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	134.7	175.5	-75.2	12	0	0	0	111.9	A210 Y237	D208-A210 PolarHBondContact O-N 2.9Å; D208-Y237 WeakPolarHBondContact OD1-CB 3.42Å
209	K	93.7	Very high	96.2	Very high	148 Å²	148	55.6 Å²	55.6	64%	0.643	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	8.6	177.8	-46.4	179.2	-178.6	174.9	0	115.6	P207 F211 D212 Y237	P207-K209 PolarHBondContact O-N 3.07Å; K209-F211 PolarHBondContact O-N 3.12Å; K209-D212 VanDerWaalsContact CA-CG 3.46Å; K209-D212 WeakPolarHBondContact CA-OD1 3.42Å; K209-D212 WeakPolarHBondContact CA-OD2 3.41Å; K209-D212 HydrophobicContact CB-CB 4.39Å; K209-D212 WeakPolarHBondContact CB-OD2 3.21Å; K209-D212 WeakPolarHBondContact CG-OD2 3.39Å; K209-D212 PolarHBondContact O-N 3.4Å; K209-Y237 VanDerWaalsContact C-OH 3.32Å; K209-Y237 WeakPolarHBondContact CA-OH 3.31Å
210	A	95.3	Very high	96.2	Very high	17 Å²	17	54.6 Å²	54.6	14%	0.14	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-31.3	-177.9	0	0	0	0	0	113.5	L187 I206 P207 D208 Y237	L187-A210 WeakPolarHBondContact CB-O 3.32Å; I206-A210 HydrophobicContact CG2-CB 3.65Å; P207-A210 WeakPolarHBondContact O-CB 3.43Å; P207-A210 PolarHBondContact O-N 2.88Å; P207-A210 VanDerWaalsContact O-N 3.13Å; D208-A210 PolarHBondContact O-N 2.9Å; A210-Y237 PolarHBondContact N-OH 3.25Å
211	F	95.9	Very high	96.2	Very high	3 Å²	3	52.4 Å²	52.4	1%	0.013	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-0.1	-178.1	-59.3	-31.1	0	0	0	114.2	I182 L187 L196 L198 I206 K209 Q213 L214 Y237 L238 W241	I182-F211 HydrophobicContact CD1-CE1 4.24Å; L187-F211 HydrophobicContact CD1-CD1 3.83Å; L187-F211 HydrophobicContact CD1-CE1 3.63Å; L196-F211 HydrophobicContact CD2-CE1 4.09Å; L198-F211 HydrophobicContact CD1-CE1 4.28Å; L198-F211 HydrophobicContact CD1-CZ 3.91Å; I206-F211 HydrophobicContact CB-CE2 4.33Å; I206-F211 HydrophobicContact CB-CZ 4.5Å; I206-F211 HydrophobicContact CD1-CE2 4.48Å; I206-F211 HydrophobicContact CD1-CZ 3.99Å; I206-F211 HydrophobicContact CG1-CE2 3.98Å; I206-F211 HydrophobicContact CG1-CZ 4Å; I206-F211 HydrophobicContact CG2-CD2 4.18Å; I206-F211 HydrophobicContact CG2-CE1 4.23Å; I206-F211 HydrophobicContact CG2-CE2 3.73Å; I206-F211 HydrophobicContact CG2-CZ 3.76Å; K209-F211 PolarHBondContact O-N 3.12Å; F211-Q213 VanDerWaalsContact C-N 3.25Å; F211-Q213 PolarHBondContact O-N 3.42Å; F211-L214 HydrophobicContact CB-CD1 4.13Å; F211-L214 HydrophobicContact CD1-CD1 3.7Å; F211-L214 HydrophobicContact CG-CD1 4.25Å; F211-L214 WeakPolarHBondContact O-CB 3.2Å; F211-L214 PolarHBondContact O-N 3.25Å; F211-L214 VanDerWaalsContact O-N 3.13Å; F211-Y237 PolarHBondContact N-OH 3.38Å; F211-L238 HydrophobicContact CE2-CD1 4.14Å; F211-W241 HydrophobicContact CB-CD2 4.11Å; F211-W241 VanDerWaalsContact CB-CE2 3.46Å; F211-W241 HydrophobicContact CB-CG 4.49Å; F211-W241 HydrophobicContact CB-CH2 4.44Å; F211-W241 HydrophobicContact CB-CZ2 3.66Å; F211-W241 AromaticContact CD2-CD2 3.89Å; F211-W241 HydrophobicContact CD2-CD2 3.89Å; F211-W241 AromaticContact CD2-CE2 3.97Å; F211-W241 AromaticContact CD2-CE3 3.86Å; F211-W241 HydrophobicContact CD2-CE3 3.86Å; F211-W241 HydrophobicContact CD2-CH2 4.04Å; F211-W241 HydrophobicContact CD2-CZ2 4.06Å; F211-W241 AromaticContact CD2-CZ3 3.94Å; F211-W241 HydrophobicContact CD2-CZ3 3.94Å; F211-W241 HydrophobicContact CE2-CZ3 4.42Å; F211-W241 HydrophobicContact CG-CH2 4.48Å; F211-W241 HydrophobicContact CG-CZ2 4.16Å
212	D	94	Very high	96.1	Very high	64 Å²	64	52.3 Å²	52.3	34%	0.342	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-25.1	-169.4	-70.7	12	0	0	0	113.8	K209 F215 Y237	K209-D212 VanDerWaalsContact CA-CG 3.46Å; K209-D212 WeakPolarHBondContact CA-OD1 3.42Å; K209-D212 WeakPolarHBondContact CA-OD2 3.41Å; K209-D212 HydrophobicContact CB-CB 4.39Å; K209-D212 WeakPolarHBondContact CB-OD2 3.21Å; K209-D212 WeakPolarHBondContact CG-OD2 3.39Å; K209-D212 PolarHBondContact O-N 3.4Å; D212-F215 WeakPolarHBondContact O-CE1 3.27Å; D212-Y237 VanDerWaalsContact OD1-CE2 3.27Å; D212-Y237 WeakPolarHBondContact OD1-CE2 3.39Å; D212-Y237 PolarHBondContact OD1-OH 3.27Å
213	Q	94.8	Very high	96.1	Very high	63 Å²	63	50.9 Å²	50.9	29%	0.294	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	1.6	-179.9	-60.7	-59.7	-64.2	0	0	113.7	L188 F211 F215	L188-Q213 HydrophobicContact CD1-CB 4.35Å; L188-Q213 HydrophobicContact CD1-CG 3.34Å; L188-Q213 HydrophobicContact CG-CG 3.93Å; L188-Q213 VanDerWaalsContact O-CB 3.29Å; L188-Q213 WeakPolarHBondContact O-CB 3.45Å; F211-Q213 VanDerWaalsContact C-N 3.25Å; F211-Q213 PolarHBondContact O-N 3.42Å; Q213-F215 HydrophobicContact CB-CE2 4.36Å; Q213-F215 HydrophobicContact CB-CZ 4.46Å; Q213-F215 VanDerWaalsContact O-CD2 3.32Å; Q213-F215 WeakPolarHBondContact O-CD2 3.17Å; Q213-F215 PolarHBondContact O-N 3.22Å; Q213-F215 VanDerWaalsContact OE1-CZ 3.31Å
214	L	95.9	Very high	96	Very high	10 Å²	10	56.2 Å²	56.2	5%	0.052	27%	0.274	C	S	.	.			trans	-84	60.4	-179.7	-54.6	-178.5	0	0	0	110.1	L187 L190 L193 L196 F211 Q216 L217	L187-L214 HydrophobicContact CB-CD2 4.47Å; L190-L214 HydrophobicContact CB-CD2 3.98Å; L190-L214 WeakPolarHBondContact O-CD2 3.28Å; L193-L214 HydrophobicContact CB-CD2 4.29Å; L193-L214 HydrophobicContact CD2-CD1 4.27Å; L193-L214 HydrophobicContact CD2-CD2 4.01Å; L196-L214 HydrophobicContact CD2-CD1 4.24Å; F211-L214 HydrophobicContact CB-CD1 4.13Å; F211-L214 HydrophobicContact CD1-CD1 3.7Å; F211-L214 HydrophobicContact CG-CD1 4.25Å; F211-L214 WeakPolarHBondContact O-CB 3.2Å; F211-L214 PolarHBondContact O-N 3.25Å; F211-L214 VanDerWaalsContact O-N 3.13Å; L214-Q216 VanDerWaalsContact C-N 3.26Å; L214-Q216 PolarHBondContact O-N 3.05Å; L214-L217 HydrophobicContact CB-CB 3.97Å; L214-L217 HydrophobicContact CB-CD2 4.21Å; L214-L217 HydrophobicContact CD1-CD2 4.08Å; L214-L217 WeakPolarHBondContact O-CB 3.49Å; L214-L217 PolarHBondContact O-N 2.9Å; L214-L217 VanDerWaalsContact O-N 3.16Å
215	F	93.4	Very high	96	Very high	138 Å²	138	54.3 Å²	54.3	61%	0.605	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-26	-171.1	-54.7	-60.1	0	0	0	114.3	D212 Q213	D212-F215 WeakPolarHBondContact O-CE1 3.27Å; Q213-F215 HydrophobicContact CB-CE2 4.36Å; Q213-F215 HydrophobicContact CB-CZ 4.46Å; Q213-F215 VanDerWaalsContact O-CD2 3.32Å; Q213-F215 WeakPolarHBondContact O-CD2 3.17Å; Q213-F215 PolarHBondContact O-N 3.22Å; Q213-F215 VanDerWaalsContact OE1-CZ 3.31Å
216	Q	96.7	Very high	96	Very high	96 Å²	96	53.9 Å²	53.9	45%	0.449	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	7.5	179.7	-62.4	-171.4	-12.7	0	0	112.8	Q191 H192 L193 T194 L214 Q218	Q191-Q216 WeakPolarHBondContact O-CB 2.97Å; Q191-Q216 VanDerWaalsContact O-CG 3.31Å; Q191-Q216 WeakPolarHBondContact O-CG 3.06Å; H192-Q216 PolarHBondContact ND1-OE1 3.15Å; L193-Q216 CarbonylContact O-C 3.1Å; T194-Q216 WeakPolarHBondContact CA-O 2.97Å; L214-Q216 VanDerWaalsContact C-N 3.26Å; L214-Q216 PolarHBondContact O-N 3.05Å; Q216-Q218 PolarHBondContact O-N 3.19Å
217	L	97.8	Very high	96	Very high	13 Å²	13	55.4 Å²	55.4	7%	0.068	28%	0.275	C	S	.	.			trans	-67.5	122.9	-176.6	-166.1	70.3	0	0	0	110.4	L193 L196 L214 V220 W241 A247	L193-L217 HydrophobicContact CD2-CD1 4.36Å; L193-L217 HydrophobicContact CG-CD1 4.2Å; L193-L217 VanDerWaalsContact O-CA 3.26Å; L193-L217 WeakPolarHBondContact O-CA 3.06Å; L193-L217 PolarHBondContact O-N 3.09Å; L193-L217 VanDerWaalsContact O-N 3.14Å; L196-L217 HydrophobicContact CB-CD1 3.92Å; L214-L217 HydrophobicContact CB-CB 3.97Å; L214-L217 HydrophobicContact CB-CD2 4.21Å; L214-L217 HydrophobicContact CD1-CD2 4.08Å; L214-L217 WeakPolarHBondContact O-CB 3.49Å; L214-L217 PolarHBondContact O-N 2.9Å; L214-L217 VanDerWaalsContact O-N 3.16Å; L217-V220 HydrophobicContact CD2-CB 4.16Å; L217-W241 HydrophobicContact CD2-CH2 3.86Å; L217-W241 HydrophobicContact CD2-CZ2 3.96Å; L217-A247 HydrophobicContact CB-CB 4.39Å; L217-A247 HydrophobicContact CD2-CB 4.3Å; L217-A247 HydrophobicContact CG-CB 4.18Å; L217-A247 VanDerWaalsContact O-CB 3.32Å; L217-A247 WeakPolarHBondContact O-CB 3.5Å
218	Q	97.9	Very high	96	Very high	129 Å²	129	56.4 Å²	56.4	60%	0.603	28%	0.282	S	S	*	.			trans	-107.5	-35.5	179.5	-64.1	177.8	9	0	0	111.4	T194 Q216 N248	T194-Q218 WeakPolarHBondContact O-CA 3.41Å; T194-Q218 PolarHBondContact O-N 2.03Å; Q216-Q218 PolarHBondContact O-N 3.19Å; Q218-N248 WeakPolarHBondContact O-CB 3.37Å; Q218-N248 PolarHBondContact O-N 3.08Å
219	V	98.3	Very high	95.9	Very high	33 Å²	33	52.5 Å²	52.5	20%	0.2	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	131	-176.7	-177.9	0	0	0	0	110.3	T194 S195 L196 I250	T194-V219 PolarHBondContact O-N 3.47Å; S195-V219 WeakPolarHBondContact CA-O 3.47Å; L196-V219 PolarHBondContact N-O 2.03Å; V219-I250 HydrophobicContact CG1-CD1 4.1Å
220	V	98	Very high	95.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	138.4	169	65.4	0	0	0	0	110.5	L196 L217 L222 W241 N248 V249 I250	L196-V220 HydrophobicContact CB-CG2 4.44Å; L196-V220 VanDerWaalsContact O-CA 3.28Å; L196-V220 WeakPolarHBondContact O-CA 3.23Å; L217-V220 HydrophobicContact CD2-CB 4.16Å; V220-L222 HydrophobicContact CG2-CD2 4.11Å; V220-L222 HydrophobicContact CG2-CG 4.23Å; V220-W241 HydrophobicContact CG1-CH2 3.92Å; V220-W241 HydrophobicContact CG1-CZ3 4.05Å; V220-N248 PolarHBondContact N-O 3.36Å; V220-V249 HydrophobicContact CG1-CB 4.11Å; V220-V249 HydrophobicContact CG1-CG1 4.1Å; V220-V249 HydrophobicContact CG1-CG2 3.73Å; V220-V249 WeakPolarHBondContact O-CA 3.29Å; V220-I250 PolarHBondContact O-N 3.39Å
221	T	98.1	Very high	95.7	Very high	4 Å²	4	51.3 Å²	51.3	3%	0.025	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	127.1	176.5	67.7	0	0	0	0	110.9	L196 Y197 L198 H199 Y223 I250	L196-T221 PolarHBondContact O-N 2.92Å; Y197-T221 VanDerWaalsContact CA-OG1 3.31Å; Y197-T221 WeakPolarHBondContact CA-OG1 3.31Å; Y197-T221 HydrophobicContact CD1-CG2 3.5Å; Y197-T221 HydrophobicContact CE1-CG2 4Å; L198-T221 CarbonylContact C-O 3.56Å; L198-T221 WeakPolarHBondContact CA-O 3.14Å; L198-T221 WeakPolarHBondContact CB-O 3.31Å; L198-T221 PolarHBondContact N-O 3.02Å; L198-T221 PolarHBondContact N-OG1 3.03Å; H199-T221 PolarHBondContact CD2-OG1 2.99Å; H199-T221 PolarHBondContact N-O 2.99Å; H199-T221 PolarHBondContact N-OG1 3.39Å; T221-Y223 HydrophobicContact CG2-CE1 4.25Å; T221-I250 CarbonylContact C-O 3.21Å; T221-I250 WeakPolarHBondContact CA-O 3.38Å; T221-I250 HydrophobicContact CG2-CB 4.08Å; T221-I250 HydrophobicContact CG2-CD1 4.18Å
222	L	97.1	Very high	95.3	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.308	C	S	.	.			trans	-125.8	-2.7	-176	-63.7	178.8	0	0	0	113.6	L198 V220 N225 W227 L238 V242 V249 I250 P253	L198-L222 HydrophobicContact CB-CD2 4.4Å; L198-L222 HydrophobicContact CD1-CD2 4.24Å; V220-L222 HydrophobicContact CG2-CD2 4.11Å; V220-L222 HydrophobicContact CG2-CG 4.23Å; L222-N225 PolarHBondContact O-ND2 3.46Å; L222-W227 HydrophobicContact CB-CZ2 3.89Å; L222-W227 HydrophobicContact CD2-CH2 4.23Å; L222-W227 HydrophobicContact CD2-CZ2 4.07Å; L222-W227 HydrophobicContact CG-CZ2 4.46Å; L222-W227 WeakPolarHBondContact O-CZ2 3.44Å; L222-W227 PolarHBondContact O-NE1 3.38Å; L222-W227 VanDerWaalsContact O-NE1 3.08Å; L222-L238 HydrophobicContact CD1-CD1 4.02Å; L222-V242 HydrophobicContact CD1-CG2 4.09Å; L222-V249 HydrophobicContact CD1-CG1 3.84Å; L222-V249 HydrophobicContact CG-CG1 4.37Å; L222-I250 PolarHBondContact N-O 3.45Å; L222-P253 HydrophobicContact CB-CG 4.28Å; L222-P253 HydrophobicContact CD1-CG 4.01Å
223	Y	96.3	Very high	95.1	Very high	80 Å²	80	64.8 Å²	64.8	31%	0.314	33%	0.327	S	S	.	.			trans	-62.5	159.4	179.7	66.5	-88.3	0	0	0	112.8	H199 N200 T221 N225 I250	H199-Y223 VanDerWaalsContact CA-O 3.25Å; H199-Y223 WeakPolarHBondContact CA-O 3.41Å; H199-Y223 HydrophobicContact CB-CD1 3.59Å; H199-Y223 HydrophobicContact CB-CD2 3.88Å; H199-Y223 HydrophobicContact CB-CE1 3.36Å; H199-Y223 HydrophobicContact CB-CE2 3.67Å; H199-Y223 HydrophobicContact CB-CG 3.84Å; H199-Y223 VanDerWaalsContact CB-CZ 3.41Å; H199-Y223 WeakPolarHBondContact CB-O 3.07Å; H199-Y223 AromaticContact CD2-CE1 3.83Å; H199-Y223 AromaticContact CD2-CZ 3.74Å; H199-Y223 PolarHBondContact CD2-OH 2.89Å; H199-Y223 AromaticContact CE1-CZ 3.85Å; H199-Y223 PolarHBondContact CE1-OH 3.03Å; H199-Y223 AromaticContact CG-CE1 3.53Å; H199-Y223 AromaticContact CG-CE2 3.77Å; H199-Y223 AromaticContact CG-CZ 3.24Å; H199-Y223 VanDerWaalsContact CG-OH 3.27Å; H199-Y223 AromaticContact ND1-CE2 3.62Å; H199-Y223 AromaticContact ND1-CZ 3.34Å; H199-Y223 VanDerWaalsContact ND1-CZ 3.34Å; H199-Y223 PolarHBondContact ND1-OH 2.91Å; H199-Y223 PolarHBondContact NE2-OH 3.1Å; N200-Y223 PolarHBondContact N-O 3.05Å; T221-Y223 HydrophobicContact CG2-CE1 4.25Å; Y223-N225 PolarHBondContact O-N 3.49Å; Y223-N225 PolarHBondContact O-ND2 3.22Å; Y223-I250 HydrophobicContact CD1-CG2 4.03Å; Y223-I250 HydrophobicContact CE1-CG2 4.16Å; Y223-I250 PolarHBondContact N-O 3.01Å
224	N	96.3	Very high	95	Very high	112 Å²	112	63.9 Å²	63.9	60%	0.599	32%	0.324	S	S	*	.	S	Bend	trans	53.4	49.3	180	-66.2	-4.9	0	0	0	113.5	N200 N201	N200-N224 WeakPolarHBondContact CA-O 3.28Å; N200-N224 PolarHBondContact N-O 3.38Å; N200-N224 WeakPolarHBondContact OD1-CB 3.25Å; N200-N224 PolarHBondContact OD1-ND2 2.9Å; N201-N224 PolarHBondContact N-O 3.18Å
225	N	97.1	Very high	94.9	Very high	15 Å²	15	63.6 Å²	63.6	8%	0.08	32%	0.322	C	S	.	.			trans	-125.1	142.1	166.7	-81.9	-79	0	0	0	108.8	L198 N201 K202 F203 L222 Y223 W227	L198-N225 PolarHBondContact O-ND2 3.24Å; N201-N225 VanDerWaalsContact CA-OD1 3.25Å; N201-N225 WeakPolarHBondContact CA-OD1 3.42Å; N201-N225 WeakPolarHBondContact CB-OD1 3.5Å; N201-N225 PolarHBondContact N-OD1 2.91Å; N201-N225 PolarHBondContact O-OD1 2.89Å; K202-N225 PolarHBondContact N-OD1 2.93Å; F203-N225 HydrophobicContact CB-CB 4.32Å; F203-N225 WeakPolarHBondContact CD2-OD1 3.5Å; F203-N225 PolarHBondContact N-OD1 2.72Å; L222-N225 PolarHBondContact O-ND2 3.46Å; Y223-N225 PolarHBondContact O-N 3.49Å; Y223-N225 PolarHBondContact O-ND2 3.22Å; N225-W227 HydrophobicContact CB-CD2 4.06Å; N225-W227 VanDerWaalsContact CB-CE2 3.44Å; N225-W227 HydrophobicContact CB-CG 4.5Å; N225-W227 HydrophobicContact CB-CH2 4.2Å; N225-W227 HydrophobicContact CB-CZ2 3.53Å; N225-W227 VanDerWaalsContact O-CD1 3.27Å; N225-W227 PolarHBondContact O-N 3.16Å
226	P	96.1	Very high	94.9	Very high	73 Å²	73	60.1 Å²	60.1	47%	0.474	31%	0.314	S	S	.	.			trans	-78.1	64.9	-179.5	34.6	-37.4	0	0	0	111.7	F203 T204 S228	F203-P226 CarbonylContact O-C 3.48Å; F203-P226 VanDerWaalsContact O-CD 3.28Å; F203-P226 WeakPolarHBondContact O-CD 3.28Å; T204-P226 WeakPolarHBondContact CA-O 3.24Å; P226-S228 PolarHBondContact O-N 2.9Å
227	W	95.5	Very high	94.9	Very high	32 Å²	32	57 Å²	57	12%	0.121	30%	0.298	C	S	.	.			trans	-57.4	126.2	-179.1	-57.9	113	0	0	0	111.7	F203 T204 I206 L222 N225 C229 L238 P253	F203-W227 HydrophobicContact CB-CE3 4.31Å; F203-W227 HydrophobicContact CB-CH2 3.59Å; F203-W227 HydrophobicContact CB-CZ2 4.45Å; F203-W227 HydrophobicContact CB-CZ3 3.51Å; F203-W227 HydrophobicContact CG-CH2 4.32Å; T204-W227 WeakPolarHBondContact O-CA 3.35Å; I206-W227 HydrophobicContact CD1-CH2 4.01Å; I206-W227 HydrophobicContact CD1-CZ3 4.16Å; I206-W227 HydrophobicContact CG1-CH2 3.97Å; I206-W227 HydrophobicContact CG1-CZ3 3.91Å; L222-W227 HydrophobicContact CB-CZ2 3.89Å; L222-W227 HydrophobicContact CD2-CH2 4.23Å; L222-W227 HydrophobicContact CD2-CZ2 4.07Å; L222-W227 HydrophobicContact CG-CZ2 4.46Å; L222-W227 WeakPolarHBondContact O-CZ2 3.44Å; L222-W227 PolarHBondContact O-NE1 3.38Å; L222-W227 VanDerWaalsContact O-NE1 3.08Å; N225-W227 HydrophobicContact CB-CD2 4.06Å; N225-W227 VanDerWaalsContact CB-CE2 3.44Å; N225-W227 HydrophobicContact CB-CG 4.5Å; N225-W227 HydrophobicContact CB-CH2 4.2Å; N225-W227 HydrophobicContact CB-CZ2 3.53Å; N225-W227 VanDerWaalsContact O-CD1 3.27Å; N225-W227 PolarHBondContact O-N 3.16Å; W227-C229 VanDerWaalsContact C-N 3.29Å; W227-C229 PolarHBondContact O-N 3.46Å; W227-C229 PolarHBondContact O-SG 3.02Å; W227-C229 VanDerWaalsContact O-SG 3.39Å; W227-L238 HydrophobicContact CD2-CD2 4.13Å; W227-L238 HydrophobicContact CE3-CD2 3.67Å; W227-L238 HydrophobicContact CH2-CD2 3.94Å; W227-L238 HydrophobicContact CZ2-CD2 4.35Å; W227-L238 HydrophobicContact CZ3-CD2 3.57Å; W227-P253 HydrophobicContact CD2-CB 4.18Å; W227-P253 HydrophobicContact CG-CB 3.95Å
228	S	94.1	Very high	94.8	Very high	48 Å²	48	56.4 Å²	56.4	34%	0.336	30%	0.295	S	S	.	.			trans	-85.9	65.4	-176.7	-177.5	0	0	0	0	111.3	T204 P226 S230 D231 I235	T204-S228 PolarHBondContact O-N 2.75Å; P226-S228 PolarHBondContact O-N 2.9Å; S228-S230 PolarHBondContact O-N 2.98Å; S228-S230 VanDerWaalsContact O-N 3.13Å; S228-D231 VanDerWaalsContact O-CB 3.27Å; S228-D231 WeakPolarHBondContact O-CB 3.27Å; S228-D231 PolarHBondContact O-N 2.89Å; S228-I235 WeakPolarHBondContact O-CG1 3.47Å
229	C	92.2	Very high	94.6	Very high	24 Å²	24	51.6 Å²	51.6	16%	0.162	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-25.4	-169.5	-57.9	0	0	0	0	115.2	W227 D231 C254 E257	W227-C229 VanDerWaalsContact C-N 3.29Å; W227-C229 PolarHBondContact O-N 3.46Å; W227-C229 PolarHBondContact O-SG 3.02Å; W227-C229 VanDerWaalsContact O-SG 3.39Å; C229-D231 VanDerWaalsContact C-N 3.26Å; C229-D231 PolarHBondContact O-N 3.38Å; C229-C254 VanDerWaalsContact CA-SG 3.56Å; C229-C254 HydrophobicContact CB-CB 3.66Å; C229-C254 WeakPolarHBondContact CB-SG 3.48Å; C229-C254 WeakPolarHBondContact SG-CA 3.43Å; C229-C254 WeakPolarHBondContact SG-CB 3.49Å; C229-C254 CovalentContact SG-SG 2.02Å; C229-C254 PolarHBondContact SG-SG 3.41Å; C229-E257 HydrophobicContact CB-CG 4.09Å; C229-E257 WeakPolarHBondContact CB-OE1 3.17Å; C229-E257 WeakPolarHBondContact CB-OE2 3.45Å
230	S	91.5	Very high	94.4	Very high	94 Å²	94	57.7 Å²	57.7	66%	0.657	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-16.5	172.9	-58	0	0	0	0	114	S228 K232 E257	S228-S230 PolarHBondContact O-N 2.98Å; S228-S230 VanDerWaalsContact O-N 3.13Å; S230-K232 PolarHBondContact O-N 3.29Å; S230-E257 PolarHBondContact OG-OE1 3.28Å
231	D	92	Very high	94.3	Very high	47 Å²	47	59.2 Å²	59.2	25%	0.251	30%	0.303	S	S	.	.			trans	-80	97.8	178.5	-176.1	-9.1	0	0	0	111	S228 C229 Q233 N234 I235	S228-D231 VanDerWaalsContact O-CB 3.27Å; S228-D231 WeakPolarHBondContact O-CB 3.27Å; S228-D231 PolarHBondContact O-N 2.89Å; C229-D231 VanDerWaalsContact C-N 3.26Å; C229-D231 PolarHBondContact O-N 3.38Å; D231-Q233 PolarHBondContact O-N 3.33Å; D231-Q233 WeakPolarHBondContact OD1-CB 3.36Å; D231-Q233 PolarHBondContact OD1-N 3.14Å; D231-N234 PolarHBondContact OD1-N 3.03Å; D231-N234 PolarHBondContact OD2-ND2 3.21Å; D231-I235 WeakPolarHBondContact O-CB 3.42Å; D231-I235 PolarHBondContact O-N 3.08Å
232	K	88.5	Confident	94.2	Very high	191 Å²	191	60.9 Å²	60.9	83%	0.83	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-10.8	179.8	-63	-175.4	-179.2	179.8	0	114.1	S230 P236	S230-K232 PolarHBondContact O-N 3.29Å; K232-P236 WeakPolarHBondContact O-CG 3.24Å
233	Q	90.7	Very high	94	Very high	158 Å²	158	68 Å²	68	74%	0.738	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-44.9	-179.5	-170.7	171.9	10.6	0	0	111.6	D231	D231-Q233 PolarHBondContact O-N 3.33Å; D231-Q233 WeakPolarHBondContact OD1-CB 3.36Å; D231-Q233 PolarHBondContact OD1-N 3.14Å
234	N	91.9	Very high	93.9	Very high	44 Å²	44	67.6 Å²	67.6	24%	0.235	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-28.2	-168.3	-65.1	-52.4	0	0	0	115.1	Y205 D231 P236	Y205-N234 HydrophobicContact CD1-CB 4.02Å; Y205-N234 HydrophobicContact CD2-CB 3.73Å; Y205-N234 HydrophobicContact CE2-CB 4.29Å; Y205-N234 HydrophobicContact CG-CB 3.59Å; D231-N234 PolarHBondContact OD1-N 3.03Å; D231-N234 PolarHBondContact OD2-ND2 3.21Å; N234-P236 VanDerWaalsContact C-CD 3.47Å
235	I	94.1	Very high	93.8	Very high	4 Å²	4	64.1 Å²	64.1	2%	0.021	35%	0.349	C	S	.	.	S	Bend	trans	-74	-32.8	-179.5	-73.3	-63.7	0	0	0	115.8	T204 S228 D231 Y237 L238 L239	T204-I235 VanDerWaalsContact O-CD1 3.28Å; T204-I235 WeakPolarHBondContact O-CD1 3.44Å; S228-I235 WeakPolarHBondContact O-CG1 3.47Å; D231-I235 WeakPolarHBondContact O-CB 3.42Å; D231-I235 PolarHBondContact O-N 3.08Å; I235-Y237 PolarHBondContact O-N 3.18Å; I235-Y237 VanDerWaalsContact O-N 3.09Å; I235-L238 PolarHBondContact O-N 2.85Å; I235-L239 HydrophobicContact CG2-CD1 3.49Å; I235-L239 VanDerWaalsContact CG2-CD1 3.49Å; I235-L239 HydrophobicContact CG2-CD2 4.44Å; I235-L239 HydrophobicContact CG2-CG 3.64Å; I235-L239 PolarHBondContact O-N 3.17Å
236	P	93.9	Very high	93.7	Very high	66 Å²	66	68.7 Å²	68.7	43%	0.429	39%	0.389	S	S	.	.	H	α-helix	trans	-55	-35.8	-171.1	-29	34.6	0	0	0	114.8	K232 N234 K240	K232-P236 WeakPolarHBondContact O-CG 3.24Å; N234-P236 VanDerWaalsContact C-CD 3.47Å; P236-K240 VanDerWaalsContact O-CB 3.3Å; P236-K240 WeakPolarHBondContact O-CB 3.43Å; P236-K240 PolarHBondContact O-N 2.86Å
237	Y	95.1	Very high	93.7	Very high	30 Å²	30	65.6 Å²	65.6	12%	0.118	37%	0.369	C	S	.	.	H	α-helix	trans	-56.9	-52.3	176.1	167.2	-104.9	0	0	0	111.9	I206 P207 D208 K209 A210 F211 D212 I235 L239 K240 W241	I206-Y237 HydrophobicContact CG2-CD1 4.44Å; I206-Y237 HydrophobicContact CG2-CE1 4.01Å; P207-Y237 WeakPolarHBondContact O-CD1 3.3Å; P207-Y237 WeakPolarHBondContact O-CE1 3.19Å; D208-Y237 WeakPolarHBondContact OD1-CB 3.42Å; K209-Y237 VanDerWaalsContact C-OH 3.32Å; K209-Y237 WeakPolarHBondContact CA-OH 3.31Å; A210-Y237 PolarHBondContact N-OH 3.25Å; F211-Y237 PolarHBondContact N-OH 3.38Å; D212-Y237 VanDerWaalsContact OD1-CE2 3.27Å; D212-Y237 WeakPolarHBondContact OD1-CE2 3.39Å; D212-Y237 PolarHBondContact OD1-OH 3.27Å; I235-Y237 PolarHBondContact O-N 3.18Å; I235-Y237 VanDerWaalsContact O-N 3.09Å; Y237-L239 PolarHBondContact O-N 3.36Å; Y237-K240 PolarHBondContact O-N 2.74Å; Y237-W241 VanDerWaalsContact O-CB 3.3Å; Y237-W241 WeakPolarHBondContact O-CB 3.49Å; Y237-W241 PolarHBondContact O-N 2.67Å
238	L	95.7	Very high	93.7	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-62	-46	-176.8	179.9	61.6	0	0	0	111.1	I206 F211 L222 W227 I235 K240 W241 V242 P253	I206-L238 HydrophobicContact CB-CD1 4.19Å; I206-L238 HydrophobicContact CG1-CD1 3.87Å; I206-L238 HydrophobicContact CG1-CD2 4.09Å; I206-L238 HydrophobicContact CG1-CG 4.48Å; F211-L238 HydrophobicContact CE2-CD1 4.14Å; L222-L238 HydrophobicContact CD1-CD1 4.02Å; W227-L238 HydrophobicContact CD2-CD2 4.13Å; W227-L238 HydrophobicContact CE3-CD2 3.67Å; W227-L238 HydrophobicContact CH2-CD2 3.94Å; W227-L238 HydrophobicContact CZ2-CD2 4.35Å; W227-L238 HydrophobicContact CZ3-CD2 3.57Å; I235-L238 PolarHBondContact O-N 2.85Å; L238-K240 PolarHBondContact O-N 2.87Å; L238-W241 PolarHBondContact O-N 3.39Å; L238-V242 HydrophobicContact CD1-CG2 4.11Å; L238-V242 HydrophobicContact CG-CG2 4.42Å; L238-V242 WeakPolarHBondContact O-CB 3.47Å; L238-V242 VanDerWaalsContact O-CG2 3.27Å; L238-V242 WeakPolarHBondContact O-CG2 3.38Å; L238-V242 PolarHBondContact O-N 2.82Å; L238-P253 HydrophobicContact CD2-CB 4.02Å; L238-P253 HydrophobicContact CD2-CG 3.96Å; L238-P253 HydrophobicContact CG-CG 4.35Å
239	L	94.4	Very high	93.9	Very high	29 Å²	29	68.1 Å²	68.1	15%	0.152	38%	0.382	C	S	.	.	H	α-helix	trans	-62.9	-44.1	179.9	-64.7	-178.9	0	0	0	111.8	I235 Y237 W241 V242 Q243 P253 C254 L260	I235-L239 HydrophobicContact CG2-CD1 3.49Å; I235-L239 VanDerWaalsContact CG2-CD1 3.49Å; I235-L239 HydrophobicContact CG2-CD2 4.44Å; I235-L239 HydrophobicContact CG2-CG 3.64Å; I235-L239 PolarHBondContact O-N 3.17Å; Y237-L239 PolarHBondContact O-N 3.36Å; L239-W241 VanDerWaalsContact C-N 3.35Å; L239-V242 PolarHBondContact O-N 3.41Å; L239-Q243 WeakPolarHBondContact O-CG 3.49Å; L239-Q243 PolarHBondContact O-N 2.88Å; L239-Q243 VanDerWaalsContact O-N 3.17Å; L239-P253 HydrophobicContact CD2-CB 4.31Å; L239-C254 HydrophobicContact CD2-CB 4.26Å; L239-L260 HydrophobicContact CD1-CD1 4.45Å
240	K	95	Very high	94.1	Very high	161 Å²	161	70.3 Å²	70.3	70%	0.7	39%	0.392	S	S	*	.	H	α-helix	trans	-63.2	-42.2	176.1	-176.3	-178.9	178.4	-178	0	111.5	P236 Y237 L238 Q243 G244	P236-K240 VanDerWaalsContact O-CB 3.3Å; P236-K240 WeakPolarHBondContact O-CB 3.43Å; P236-K240 PolarHBondContact O-N 2.86Å; Y237-K240 PolarHBondContact O-N 2.74Å; L238-K240 PolarHBondContact O-N 2.87Å; K240-Q243 PolarHBondContact O-N 3.21Å; K240-G244 PolarHBondContact O-N 3.26Å; K240-G244 VanDerWaalsContact O-N 3.14Å
241	W	95.9	Very high	94	Very high	32 Å²	32	67.2 Å²	67.2	12%	0.121	38%	0.375	C	S	.	.	H	α-helix	trans	-65	-44.5	179	-177.8	91	0	0	0	111.6	F211 L217 V220 Y237 L238 L239 Q243 G244 T245 V249	F211-W241 HydrophobicContact CB-CD2 4.11Å; F211-W241 VanDerWaalsContact CB-CE2 3.46Å; F211-W241 HydrophobicContact CB-CG 4.49Å; F211-W241 HydrophobicContact CB-CH2 4.44Å; F211-W241 HydrophobicContact CB-CZ2 3.66Å; F211-W241 AromaticContact CD2-CD2 3.89Å; F211-W241 HydrophobicContact CD2-CD2 3.89Å; F211-W241 AromaticContact CD2-CE2 3.97Å; F211-W241 AromaticContact CD2-CE3 3.86Å; F211-W241 HydrophobicContact CD2-CE3 3.86Å; F211-W241 HydrophobicContact CD2-CH2 4.04Å; F211-W241 HydrophobicContact CD2-CZ2 4.06Å; F211-W241 AromaticContact CD2-CZ3 3.94Å; F211-W241 HydrophobicContact CD2-CZ3 3.94Å; F211-W241 HydrophobicContact CE2-CZ3 4.42Å; F211-W241 HydrophobicContact CG-CH2 4.48Å; F211-W241 HydrophobicContact CG-CZ2 4.16Å; L217-W241 HydrophobicContact CD2-CH2 3.86Å; L217-W241 HydrophobicContact CD2-CZ2 3.96Å; V220-W241 HydrophobicContact CG1-CH2 3.92Å; V220-W241 HydrophobicContact CG1-CZ3 4.05Å; Y237-W241 VanDerWaalsContact O-CB 3.3Å; Y237-W241 WeakPolarHBondContact O-CB 3.49Å; Y237-W241 PolarHBondContact O-N 2.67Å; L238-W241 PolarHBondContact O-N 3.39Å; L239-W241 VanDerWaalsContact C-N 3.35Å; W241-Q243 VanDerWaalsContact C-N 3.27Å; W241-Q243 PolarHBondContact O-N 3.4Å; W241-G244 PolarHBondContact O-N 2.74Å; W241-G244 VanDerWaalsContact O-N 3.16Å; W241-T245 HydrophobicContact CD2-CG2 4.5Å; W241-T245 HydrophobicContact CE3-CG2 4.19Å; W241-T245 HydrophobicContact CH2-CG2 4.06Å; W241-T245 HydrophobicContact CZ2-CG2 4.36Å; W241-T245 HydrophobicContact CZ3-CG2 3.96Å; W241-T245 VanDerWaalsContact O-CB 3.32Å; W241-T245 WeakPolarHBondContact O-CB 3.46Å; W241-T245 WeakPolarHBondContact O-CG2 3.29Å; W241-T245 PolarHBondContact O-N 2.99Å; W241-V249 HydrophobicContact CZ3-CG2 4.15Å
242	V	95.1	Very high	93.9	Very high	39 Å²	39	67.6 Å²	67.6	24%	0.236	39%	0.385	C	S	.	.	H	α-helix	trans	-61.1	-35.4	177.7	169.2	0	0	0	0	111.9	L222 L238 L239 V249 P253	L222-V242 HydrophobicContact CD1-CG2 4.09Å; L238-V242 HydrophobicContact CD1-CG2 4.11Å; L238-V242 HydrophobicContact CG-CG2 4.42Å; L238-V242 WeakPolarHBondContact O-CB 3.47Å; L238-V242 VanDerWaalsContact O-CG2 3.27Å; L238-V242 WeakPolarHBondContact O-CG2 3.38Å; L238-V242 PolarHBondContact O-N 2.82Å; L239-V242 PolarHBondContact O-N 3.41Å; V242-V249 HydrophobicContact CG1-CB 4.37Å; V242-V249 HydrophobicContact CG1-CG1 4.13Å; V242-V249 HydrophobicContact CG1-CG2 4.28Å; V242-V249 HydrophobicContact CG2-CG1 4.17Å; V242-V249 HydrophobicContact CG2-CG2 4.5Å; V242-P253 HydrophobicContact CG2-CG 4.5Å
243	Q	92.7	Very high	93.9	Very high	150 Å²	150	58.7 Å²	58.7	70%	0.701	35%	0.346	S	S	*	.	H	α-helix	trans	-74.4	-29.3	176.9	-71.2	174.2	-5.6	0	0	113.7	L239 K240 W241	L239-Q243 WeakPolarHBondContact O-CG 3.49Å; L239-Q243 PolarHBondContact O-N 2.88Å; L239-Q243 VanDerWaalsContact O-N 3.17Å; K240-Q243 PolarHBondContact O-N 3.21Å; W241-Q243 VanDerWaalsContact C-N 3.27Å; W241-Q243 PolarHBondContact O-N 3.4Å
244	G	93.2	Very high	93.8	Very high	70 Å²	70	51.9 Å²	51.9	72%	0.722	32%	0.316	S	S	*	.	H	α-helix	trans	-101.9	-8.2	-173.8	0	0	0	0	0	115.4	K240 W241	K240-G244 PolarHBondContact O-N 3.26Å; K240-G244 VanDerWaalsContact O-N 3.14Å; W241-G244 PolarHBondContact O-N 2.74Å; W241-G244 VanDerWaalsContact O-N 3.16Å
245	T	94.8	Very high	93.2	Very high	40 Å²	40	51.5 Å²	51.5	25%	0.245	32%	0.319	C	S	.	.			trans	-80.8	145	-177	-170.8	0	0	0	0	112.1	W241 A247 V249	W241-T245 HydrophobicContact CD2-CG2 4.5Å; W241-T245 HydrophobicContact CE3-CG2 4.19Å; W241-T245 HydrophobicContact CH2-CG2 4.06Å; W241-T245 HydrophobicContact CZ2-CG2 4.36Å; W241-T245 HydrophobicContact CZ3-CG2 3.96Å; W241-T245 VanDerWaalsContact O-CB 3.32Å; W241-T245 WeakPolarHBondContact O-CB 3.46Å; W241-T245 WeakPolarHBondContact O-CG2 3.29Å; W241-T245 PolarHBondContact O-N 2.99Å; T245-A247 VanDerWaalsContact C-N 3.3Å; T245-A247 HydrophobicContact CG2-CB 4.34Å; T245-A247 WeakPolarHBondContact OG1-CB 3.44Å; T245-A247 PolarHBondContact OG1-N 3.2Å; T245-V249 HydrophobicContact CG2-CG2 3.63Å
246	A	95.3	Very high	91.9	Very high	111 Å²	111	58.9 Å²	58.9	92%	0.917	36%	0.358	S	S	*	.	S	Bend	trans	-82	-11	170.3	0	0	0	0	0	112.6
247	A	95.6	Very high	90.3	Very high	8 Å²	8	60.1 Å²	60.1	7%	0.066	36%	0.358	C	S	.	.	S	Bend	trans	-70	144.7	178.6	0	0	0	0	0	111.1	L217 T245 V249	L217-A247 HydrophobicContact CB-CB 4.39Å; L217-A247 HydrophobicContact CD2-CB 4.3Å; L217-A247 HydrophobicContact CG-CB 4.18Å; L217-A247 VanDerWaalsContact O-CB 3.32Å; L217-A247 WeakPolarHBondContact O-CB 3.5Å; T245-A247 VanDerWaalsContact C-N 3.3Å; T245-A247 HydrophobicContact CG2-CB 4.34Å; T245-A247 WeakPolarHBondContact OG1-CB 3.44Å; T245-A247 PolarHBondContact OG1-N 3.2Å; A247-V249 PolarHBondContact O-N 3.26Å; A247-V249 VanDerWaalsContact O-N 3.15Å
248	N	96.9	Very high	88.1	Confident	99 Å²	99	64.6 Å²	64.6	53%	0.529	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	106.5	170	-175.6	22.7	0	0	0	110	Q218 V220	Q218-N248 WeakPolarHBondContact O-CB 3.37Å; Q218-N248 PolarHBondContact O-N 3.08Å; V220-N248 PolarHBondContact N-O 3.36Å
249	V	96.9	Very high	85.8	Confident	33 Å²	33	71 Å²	71	20%	0.2	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	111.5	177.7	-174.1	0	0	0	0	109.6	V220 L222 W241 V242 T245 A247	V220-V249 HydrophobicContact CG1-CB 4.11Å; V220-V249 HydrophobicContact CG1-CG1 4.1Å; V220-V249 HydrophobicContact CG1-CG2 3.73Å; V220-V249 WeakPolarHBondContact O-CA 3.29Å; L222-V249 HydrophobicContact CD1-CG1 3.84Å; L222-V249 HydrophobicContact CG-CG1 4.37Å; W241-V249 HydrophobicContact CZ3-CG2 4.15Å; V242-V249 HydrophobicContact CG1-CB 4.37Å; V242-V249 HydrophobicContact CG1-CG1 4.13Å; V242-V249 HydrophobicContact CG1-CG2 4.28Å; V242-V249 HydrophobicContact CG2-CG1 4.17Å; V242-V249 HydrophobicContact CG2-CG2 4.5Å; T245-V249 HydrophobicContact CG2-CG2 3.63Å; A247-V249 PolarHBondContact O-N 3.26Å; A247-V249 VanDerWaalsContact O-N 3.15Å
250	I	95.9	Very high	83.5	Confident	71 Å²	71	75.7 Å²	75.7	36%	0.364	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	114.9	177.6	-54.2	177.6	0	0	0	109.3	V219 V220 T221 L222 Y223	V219-I250 HydrophobicContact CG1-CD1 4.1Å; V220-I250 PolarHBondContact O-N 3.39Å; T221-I250 CarbonylContact C-O 3.21Å; T221-I250 WeakPolarHBondContact CA-O 3.38Å; T221-I250 HydrophobicContact CG2-CB 4.08Å; T221-I250 HydrophobicContact CG2-CD1 4.18Å; L222-I250 PolarHBondContact N-O 3.45Å; Y223-I250 HydrophobicContact CD1-CG2 4.03Å; Y223-I250 HydrophobicContact CE1-CG2 4.16Å; Y223-I250 PolarHBondContact N-O 3.01Å
251	G	90.9	Very high	81.2	Confident	28 Å²	28	73.5 Å²	73.5	29%	0.289	44%	0.44	S	S	.	.	S	Bend	trans	98.9	142.3	-172.5	0	0	0	0	0	111.1	P253	G251-P253 WeakPolarHBondContact O-CD 3.45Å
252	A	88.4	Confident	78.2	Confident	56 Å²	56	80.3 Å²	80.3	46%	0.463	48%	0.475	S	S	.	.			trans	-116.9	103.2	-174.3	0	0	0	0	0	109.6	C254 A255 W261	A252-C254 PolarHBondContact O-N 3.17Å; A252-A255 HydrophobicContact CB-CB 4.23Å; A252-A255 PolarHBondContact O-N 3.03Å; A252-W261 HydrophobicContact CB-CH2 3.4Å; A252-W261 HydrophobicContact CB-CZ2 3.89Å; A252-W261 HydrophobicContact CB-CZ3 4.5Å
253	P	88.9	Confident	75.5	Confident	3 Å²	3	86.5 Å²	86.5	2%	0.019	51%	0.507	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	134.9	173.6	-23.2	33.5	0	0	0	109.9	L222 W227 L238 L239 V242 G251 A255 W261	L222-P253 HydrophobicContact CB-CG 4.28Å; L222-P253 HydrophobicContact CD1-CG 4.01Å; W227-P253 HydrophobicContact CD2-CB 4.18Å; W227-P253 HydrophobicContact CG-CB 3.95Å; L238-P253 HydrophobicContact CD2-CB 4.02Å; L238-P253 HydrophobicContact CD2-CG 3.96Å; L238-P253 HydrophobicContact CG-CG 4.35Å; L239-P253 HydrophobicContact CD2-CB 4.31Å; V242-P253 HydrophobicContact CG2-CG 4.5Å; G251-P253 WeakPolarHBondContact O-CD 3.45Å; P253-A255 VanDerWaalsContact C-N 3.32Å; P253-A255 PolarHBondContact O-N 3.07Å; P253-W261 WeakPolarHBondContact O-CZ2 3.4Å
254	C	88.6	Confident	72.8	Confident	16 Å²	16	83 Å²	83	11%	0.108	50%	0.503	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	21.5	176.3	-50.9	0	0	0	0	117.1	C229 L239 A252 N256 E257	C229-C254 VanDerWaalsContact CA-SG 3.56Å; C229-C254 HydrophobicContact CB-CB 3.66Å; C229-C254 WeakPolarHBondContact CB-SG 3.48Å; C229-C254 WeakPolarHBondContact SG-CA 3.43Å; C229-C254 WeakPolarHBondContact SG-CB 3.49Å; C229-C254 CovalentContact SG-SG 2.02Å; C229-C254 PolarHBondContact SG-SG 3.41Å; L239-C254 HydrophobicContact CD2-CB 4.26Å; A252-C254 PolarHBondContact O-N 3.17Å; C254-N256 PolarHBondContact O-N 3.43Å; C254-N256 VanDerWaalsContact O-N 3.14Å; C254-E257 PolarHBondContact O-N 2.86Å; C254-E257 VanDerWaalsContact O-N 3.14Å
255	A	79.7	Confident	69.9	Low	36 Å²	36	85.8 Å²	85.8	30%	0.298	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-30.6	179.4	0	0	0	0	0	116.1	A252 P253 W261	A252-A255 HydrophobicContact CB-CB 4.23Å; A252-A255 PolarHBondContact O-N 3.03Å; P253-A255 VanDerWaalsContact C-N 3.32Å; P253-A255 PolarHBondContact O-N 3.07Å; A255-W261 VanDerWaalsContact CA-CZ3 3.43Å; A255-W261 HydrophobicContact CB-CH2 3.18Å; A255-W261 HydrophobicContact CB-CZ2 4.05Å; A255-W261 HydrophobicContact CB-CZ3 3.55Å
256	N	66.8	Low	67.1	Low	158 Å²	158	89.7 Å²	89.7	85%	0.845	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-10.2	-175.7	-67.6	-3.2	0	0	0	113	C254 T258	C254-N256 PolarHBondContact O-N 3.43Å; C254-N256 VanDerWaalsContact O-N 3.14Å; N256-T258 PolarHBondContact O-N 2.9Å
257	E	59.7	Low	64.1	Low	92 Å²	92	90.9 Å²	90.9	43%	0.43	53%	0.529	S	S	.	.			trans	-93.3	80.7	173	-69.2	-166.1	-175.2	0	0	108.6	C229 S230 C254 V259	C229-E257 HydrophobicContact CB-CG 4.09Å; C229-E257 WeakPolarHBondContact CB-OE1 3.17Å; C229-E257 WeakPolarHBondContact CB-OE2 3.45Å; S230-E257 PolarHBondContact OG-OE1 3.28Å; C254-E257 PolarHBondContact O-N 2.86Å; C254-E257 VanDerWaalsContact O-N 3.14Å; E257-V259 PolarHBondContact O-N 3.06Å
258	T	49.5	Very low	61.3	Low	124 Å²	124	95.9 Å²	95.9	76%	0.761	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	73.5	174.5	50.7	0	0	0	0	111.2	N256	N256-T258 PolarHBondContact O-N 2.9Å
259	V	48.3	Very low	58.1	Low	135 Å²	135	95.2 Å²	95.2	82%	0.818	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.5	-17.1	162.9	-171.6	0	0	0	0	112.7	E257	E257-V259 PolarHBondContact O-N 3.06Å
260	L	46.3	Very low	54.8	Low	128 Å²	128	98.3 Å²	98.3	67%	0.67	60%	0.601	S	S	*	*	S	Bend	trans	-111.8	2.2	-177.3	-76	168.6	0	0	0	115.8	L239	L239-L260 HydrophobicContact CD1-CD1 4.45Å
261	W	44.8	Very low	51.8	Low	115 Å²	115	99.8 Å²	99.8	44%	0.436	62%	0.615	S	S	.	*			trans	-109.5	71.6	178.5	-64.3	-4.7	0	0	0	111.3	A252 P253 A255	A252-W261 HydrophobicContact CB-CH2 3.4Å; A252-W261 HydrophobicContact CB-CZ2 3.89Å; A252-W261 HydrophobicContact CB-CZ3 4.5Å; P253-W261 WeakPolarHBondContact O-CZ2 3.4Å; A255-W261 VanDerWaalsContact CA-CZ3 3.43Å; A255-W261 HydrophobicContact CB-CH2 3.18Å; A255-W261 HydrophobicContact CB-CZ2 4.05Å; A255-W261 HydrophobicContact CB-CZ3 3.55Å
262	M	34.2	Very low	48.9	Very low	175 Å²	175	105.2 Å²	105.2	86%	0.862	64%	0.643	S	S	*	*	S	Bend	trans	-96.5	117.1	148.9	-73.1	-177.4	177.1	0	0	106.3
263	N	38	Very low	46	Very low	168 Å²	168	108.5 Å²	108.5	90%	0.898	66%	0.657	S	S	*	*	S	Bend	trans	105.7	35	171.8	-49.8	-12.1	0	0	0	118
264	A	36.2	Very low	43	Very low	76 Å²	76	113.8 Å²	113.8	63%	0.628	69%	0.689	S	S	*	*			trans	-128.9	114.6	155	0	0	0	0	0	109.5	P266	A264-P266 WeakPolarHBondContact O-CD 2.87Å
265	T	32.6	Very low	40.5	Very low	130 Å²	130	122.5 Å²	122.5	80%	0.798	73%	0.728	S	S	*	*			trans	-61.2	122.1	171.6	39.2	0	0	0	0	109.7	T267	T265-T267 PolarHBondContact O-N 3.5Å
266	P	36.1	Very low	37.9	Very low	122 Å²	122	125.5 Å²	125.5	79%	0.792	75%	0.747	S	S	*	*			trans	-74.8	111.9	178.8	27.3	-29.9	0	0	0	109.6	A264 S268	A264-P266 WeakPolarHBondContact O-CD 2.87Å; P266-S268 VanDerWaalsContact C-N 3.31Å; P266-S268 PolarHBondContact O-N 3.38Å
267	T	32.3	Very low	36.1	Very low	135 Å²	135	125.4 Å²	125.4	83%	0.828	75%	0.746	S	S	*	*			trans	-85.1	87.5	160.8	-43.8	0	0	0	0	107	T265 A269	T265-T267 PolarHBondContact O-N 3.5Å; T267-A269 PolarHBondContact O-N 3.08Å
268	S	36	Very low	34.6	Very low	113 Å²	113	129 Å²	129	79%	0.79	77%	0.768	S	S	*	*			trans	-66.2	109.6	168.4	167.3	0	0	0	0	109	P266	P266-S268 VanDerWaalsContact C-N 3.31Å; P266-S268 PolarHBondContact O-N 3.38Å
269	A	28.8	Very low	33.4	Very low	85 Å²	85	129 Å²	129	70%	0.702	77%	0.768	S	S	*	*			trans	-143.2	97.1	155.7	0	0	0	0	0	107.4	T267 P271	T267-A269 PolarHBondContact O-N 3.08Å; A269-P271 WeakPolarHBondContact O-CD 3.44Å
270	A	29.1	Very low	32.7	Very low	99 Å²	99	130 Å²	130	82%	0.818	77%	0.767	S	S	*	*			trans	-72.4	127.5	161.5	0	0	0	0	0	108.4
271	P	31.7	Very low	31.8	Very low	101 Å²	101	133.7 Å²	133.7	66%	0.656	78%	0.778	S	S	*	*			trans	-101.9	119.4	156.8	28.9	-14.7	0	0	0	108.9	A269 V273	A269-P271 WeakPolarHBondContact O-CD 3.44Å; P271-V273 HydrophobicContact CB-CG2 4.32Å; P271-V273 HydrophobicContact CG-CG2 4.49Å; P271-V273 PolarHBondContact O-N 3.46Å; P271-V273 VanDerWaalsContact O-N 3.16Å
272	T	30	Very low	30.8	Very low	143 Å²	143	131.5 Å²	131.5	88%	0.877	79%	0.791	S	S	*	*			trans	-55.5	107.8	150	22.7	0	0	0	0	108.2
273	V	29.1	Very low	30.4	Very low	125 Å²	125	132.7 Å²	132.7	76%	0.758	80%	0.797	S	S	*	*			trans	-99.3	99	170.6	-179.4	0	0	0	0	107.9	P271	P271-V273 HydrophobicContact CB-CG2 4.32Å; P271-V273 HydrophobicContact CG-CG2 4.49Å; P271-V273 PolarHBondContact O-N 3.46Å; P271-V273 VanDerWaalsContact O-N 3.16Å
274	T	26.1	Very low	29.8	Very low	114 Å²	114	134.5 Å²	134.5	70%	0.699	80%	0.797	S	S	*	*			trans	-60.9	134	153	39	0	0	0	0	108.9	S276	T274-S276 PolarHBondContact O-N 3.04Å
275	E	34.5	Very low	29.2	Very low	198 Å²	198	135.9 Å²	135.9	93%	0.925	81%	0.808	S	S	*	*			trans	-46.1	121.6	173	-72.3	177.8	142.1	0	0	110.9
276	S	26.1	Very low	28.8	Very low	100 Å²	100	134.8 Å²	134.8	70%	0.699	81%	0.812	S	S	*	*			trans	-150.2	120	170.8	-65.4	0	0	0	0	108.2	T274 L278	T274-S276 PolarHBondContact O-N 3.04Å; S276-L278 PolarHBondContact O-N 3.43Å
277	N	28.8	Very low	28	Very low	155 Å²	155	135.7 Å²	135.7	83%	0.829	81%	0.811	S	S	*	*			trans	-44.4	120.8	-179.2	-66.1	-37.3	0	0	0	112.8	T279	N277-T279 PolarHBondContact O-N 3.47Å
278	L	27.6	Very low	27.7	Very low	169 Å²	169	139 Å²	139	89%	0.885	81%	0.808	S	S	*	*			trans	-75.1	81.9	163.5	-94.9	145.2	0	0	0	108.8	S276 I280	S276-L278 PolarHBondContact O-N 3.43Å; L278-I280 PolarHBondContact O-N 2.87Å; L278-I280 VanDerWaalsContact O-N 3.17Å
279	T	25.7	Very low	27	Very low	124 Å²	124	139.4 Å²	139.4	76%	0.761	81%	0.806	S	S	*	*			trans	-64.9	105.1	159.1	47.2	0	0	0	0	108.2	N277 K281	N277-T279 PolarHBondContact O-N 3.47Å; T279-K281 PolarHBondContact O-N 2.83Å
280	I	31.7	Very low	26.7	Very low	156 Å²	156	142.2 Å²	142.2	80%	0.8	81%	0.814	S	S	*	*			trans	-65.7	115.4	169.1	-64.4	180	0	0	0	107.7	L278 G282	L278-I280 PolarHBondContact O-N 2.87Å; L278-I280 VanDerWaalsContact O-N 3.17Å; I280-G282 PolarHBondContact O-N 3.29Å
281	K	28.4	Very low	26.4	Very low	204 Å²	204	143 Å²	143	89%	0.887	81%	0.814	S	S	*	*			trans	-62.4	124.3	176.6	-145.8	173	-175.5	177.1	0	108.6	T279	T279-K281 PolarHBondContact O-N 2.83Å
282	G	24.1	Very low	26	Very low	70 Å²	70	144.1 Å²	144.1	72%	0.722	82%	0.821	S	S	*	*			trans	-65.5	154.6	-162.8	0	0	0	0	0	117.2	I280	I280-G282 PolarHBondContact O-N 3.29Å
283	M	25.3	Very low	25.6	Very low	199 Å²	199	146.5 Å²	146.5	98%	0.98	82%	0.824	S	S	*	*			trans	-93.6	105.2	154.8	-69.1	-178.2	178.3	0	0	107.5
284	K	25.4	Very low	25.3	Very low	206 Å²	206	144.8 Å²	144.8	90%	0.896	82%	0.823	S	S	*	*			trans	-70.1	140.4	171.3	-91.7	180	174	178.9	0	110.1
285	A	22.8	Very low	25	Very low	105 Å²	105	146.3 Å²	146.3	87%	0.868	83%	0.833	S	S	*	*			trans	-59	140.7	166.5	0	0	0	0	0	111.7
286	A	24.4	Very low	24.3	Very low	107 Å²	107	144.8 Å²	144.8	88%	0.884	83%	0.826	S	S	*	*			trans	-132.7	126.4	159.4	0	0	0	0	0	108.7
287	D	20.4	Very low	24.2	Very low	142 Å²	142	146.1 Å²	146.1	76%	0.759	83%	0.832	S	S	*	*			trans	-100.3	154.9	178.7	-163.1	11.3	0	0	0	109.3
288	R	24.8	Very low	23.9	Very low	205 Å²	205	143.6 Å²	143.6	77%	0.774	83%	0.827	S	S	*	*			trans	85.6	112.3	158.9	-70.8	-174.9	-177.5	-162.6	-3.4	123.9
289	T	21.9	Very low	23.8	Very low	121 Å²	121	141.1 Å²	141.1	74%	0.742	82%	0.82	S	S	*	*				72.3	111.4	127.2	51.2	0	0	0	0	122.1
290	T	23	Very low	23.7	Very low	143 Å²	143	142 Å²	142	88%	0.877	83%	0.826	S	S	*	*				-176.1	141.5	103.7	22.7	0	0	0	0	111.4
291	S	22.1	Very low	23.2	Very low	116 Å²	116	140.3 Å²	140.3	81%	0.811	82%	0.823	S	S	*	*			trans	-82.3	165.3	175.9	-53.6	0	0	0	0	112.1
292	P	24.5	Very low	22.9	Very low	125 Å²	125	140.4 Å²	140.4	81%	0.812	82%	0.823	S	S	*	*				-147.1	150.3	94.6	36.1	-18.2	0	0	0	117.3
293	M	20.6	Very low	22.9	Very low	192 Å²	192	143 Å²	143	95%	0.946	83%	0.825	S	S	*	*			trans	50.8	135.6	141.5	-119.5	159.1	77.1	0	0	123.4
294	A	22	Very low	22.8	Very low	89 Å²	89	142.8 Å²	142.8	74%	0.736	82%	0.821	S	S	*	*			trans	-100.4	163.3	-166.2	0	0	0	0	0	113.9
295	T	20	Very low	22.7	Very low	147 Å²	147	141.9 Å²	141.9	90%	0.902	82%	0.817	S	S	*	*			trans	-145	128.6	151.9	-35.8	0	0	0	0	108.7
296	E	20.6	Very low	22.7	Very low	166 Å²	166	146.3 Å²	146.3	78%	0.776	82%	0.82	S	S	*	*			trans	-72.1	159.8	-176.7	-122.4	-177.6	-175.1	0	0	112.9
297	P	23.4	Very low	22.6	Very low	128 Å²	128	150.6 Å²	150.6	83%	0.831	82%	0.819	S	S	*	*				-148.2	176.5	86	36	-14.9	0	0	0	117.6
298	S	22.7	Very low	22.6	Very low	102 Å²	102	154 Å²	154	71%	0.713	83%	0.827	S	S	*	*			trans	-79.3	176.1	-153	-36	0	0	0	0	118.7
299	P	25.9	Very low	22.5	Very low	116 Å²	116	149.1 Å²	149.1	75%	0.753	83%	0.831	S	S	*	*			trans	-108	164.1	-152.2	40.9	-34.1	0	0	0	116.4
300	V	22.8	Very low	22.5	Very low	144 Å²	144	153.2 Å²	153.2	87%	0.873	84%	0.839	S	S	*	*			trans	-127.3	121.7	164.5	-179.5	0	0	0	0	111.1
301	T	21	Very low	22.4	Very low	120 Å²	120	155.1 Å²	155.1	74%	0.736	84%	0.838	S	S	*	*			trans	-82.2	136.8	-178.5	-8.2	0	0	0	0	111.7
302	K	23.5	Very low	22.4	Very low	205 Å²	205	156.3 Å²	156.3	89%	0.891	84%	0.839	S	S	*	*			trans	-131.8	115.7	158.5	-82.1	-172.8	179.1	177.5	0	110.7
303	T	23.3	Very low	22.2	Very low	125 Å²	125	156.1 Å²	156.1	77%	0.767	84%	0.836	S	S	*	*			trans	-89	139.1	178.8	43.9	0	0	0	0	112
304	H	22.7	Very low	22.3	Very low	195 Å²	195	155 Å²	155	90%	0.903	83%	0.833	S	S	*	*			trans	-72.6	145	169.5	-72.3	-79.9	0	0	0	112
305	K	24.7	Very low	22.2	Very low	186 Å²	186	156.7 Å²	156.7	81%	0.809	84%	0.835	S	S	*	*			trans	-128.5	139.4	166.7	-83.6	-173.8	178.3	179.5	0	111.5
306	Q	21.9	Very low	22.4	Very low	198 Å²	198	154.9 Å²	154.9	93%	0.925	84%	0.835	S	S	*	*			trans	-98.4	142.4	-175.4	-156	173.5	15.1	0	0	108.8
307	F	22.9	Very low	22.5	Very low	197 Å²	197	153.3 Å²	153.3	86%	0.864	84%	0.836	S	S	*	*			trans	-120.9	142.8	-179.8	-75.5	-85.8	0	0	0	112
308	K	21.1	Very low	22.5	Very low	213 Å²	213	155.5 Å²	155.5	93%	0.926	84%	0.84	S	S	*	*			trans	-111.2	137.2	178.9	-135.1	179.9	-174.8	-178.8	0	108.7
309	A	22	Very low	22.5	Very low	104 Å²	104	155.4 Å²	155.4	86%	0.86	84%	0.839	S	S	*	*			trans	-109	149.1	-178.9	0	0	0	0	0	112.3
310	K	22.8	Very low	22.5	Very low	207 Å²	207	159 Å²	159	90%	0.9	85%	0.846	S	S	*	*			trans	-138	129.7	170.3	-165.5	177.3	-177.1	-177.3	0	107.9
311	E	20.9	Very low	22.4	Very low	183 Å²	183	159.2 Å²	159.2	86%	0.855	85%	0.848	S	S	*	*			trans	-95	147	-175.6	-74.5	179.1	153.1	0	0	112.6
312	V	22.2	Very low	22.5	Very low	140 Å²	140	158.7 Å²	158.7	85%	0.848	84%	0.844	S	S	*	*			trans	-143.2	133.9	166.1	-178.7	0	0	0	0	108.5
313	T	20.2	Very low	22.3	Very low	122 Å²	122	156.3 Å²	156.3	75%	0.748	84%	0.841	S	S	*	*			trans	-114.2	134.9	-171.4	-36.9	0	0	0	0	111.4
314	L	21.2	Very low	22.3	Very low	168 Å²	168	159.5 Å²	159.5	88%	0.88	84%	0.844	S	S	*	*			trans	-143.5	139	167.5	-84.8	165.1	0	0	0	111
315	T	20.8	Very low	22.3	Very low	125 Å²	125	156.5 Å²	156.5	77%	0.767	84%	0.84	S	S	*	*			trans	-112.1	136.6	-174.4	44.9	0	0	0	0	112.4
316	A	23.3	Very low	22.1	Very low	109 Å²	109	152.9 Å²	152.9	90%	0.901	84%	0.838	S	S	*	*			trans	-154.2	140.2	162.4	0	0	0	0	0	112.6
317	T	22.6	Very low	22.2	Very low	132 Å²	132	149.5 Å²	149.5	81%	0.81	83%	0.831	S	S	*	*			trans	-104.9	138.1	-178.5	42.2	0	0	0	0	111.2
318	L	24.7	Very low	22.2	Very low	175 Å²	175	147.5 Å²	147.5	92%	0.916	83%	0.829	S	S	*	*			trans	-160.3	146	144.3	-130.7	93.1	0	0	0	113.1
319	S	22	Very low	22.5	Very low	99 Å²	99	148.5 Å²	148.5	69%	0.692	83%	0.827	S	S	*	*			trans	-101.6	135.5	-171.9	38.1	0	0	0	0	111.9
320	Q	25.2	Very low	22.8	Very low	193 Å²	193	148.4 Å²	148.4	90%	0.902	82%	0.818	S	S	*	*			trans	-175	139.6	146.5	-105.3	165.1	15	0	0	112.7
321	T	21.1	Very low	22.7	Very low	147 Å²	147	147 Å²	147	90%	0.902	82%	0.819	S	S	*	*			trans	-85.4	133	178.1	-10.7	0	0	0	0	110.2
322	V	23.6	Very low	22.8	Very low	110 Å²	110	145.4 Å²	145.4	67%	0.667	82%	0.816	S	S	*	*			trans	-130.1	124	168	-176.1	0	0	0	0	109.8	F324	V322-F324 HydrophobicContact CB-CE2 4.41Å; V322-F324 HydrophobicContact CG1-CD2 4.24Å; V322-F324 HydrophobicContact CG1-CE2 3.64Å; V322-F324 HydrophobicContact CG1-CZ 3.94Å
323	L	20	Very low	22.8	Very low	155 Å²	155	146.5 Å²	146.5	81%	0.812	82%	0.816	S	S	*	*			trans	-82.6	136.9	177.7	-156.6	88.5	0	0	0	108.9
324	F	22.6	Very low	22.8	Very low	191 Å²	191	150.4 Å²	150.4	84%	0.838	82%	0.818	S	S	*	*			trans	-126.1	125.4	166.4	-76.8	-77.7	0	0	0	111.2	V322	V322-F324 HydrophobicContact CB-CE2 4.41Å; V322-F324 HydrophobicContact CG1-CD2 4.24Å; V322-F324 HydrophobicContact CG1-CE2 3.64Å; V322-F324 HydrophobicContact CG1-CZ 3.94Å
325	T	21.8	Very low	23.1	Very low	133 Å²	133	147.4 Å²	147.4	82%	0.816	81%	0.809	S	S	*	*			trans	-86.1	150.1	179.6	45.8	0	0	0	0	112
326	S	22.2	Very low	23.3	Very low	110 Å²	110	149.5 Å²	149.5	77%	0.769	81%	0.81	S	S	*	*			trans	-87.7	143.1	-176	160.3	0	0	0	0	113.6
327	T	23.1	Very low	23.3	Very low	126 Å²	126	151.6 Å²	151.6	77%	0.773	81%	0.806	S	S	*	*			trans	-152.4	126	151.8	50.7	0	0	0	0	105
328	D	23.8	Very low	23.3	Very low	155 Å²	155	153 Å²	153	83%	0.829	81%	0.808	S	S	*	*			cis	-147.1	165.5	22.2	-94.6	-44.4	0	0	0	112
329	R	26	Very low	23.3	Very low	234 Å²	234	150.9 Å²	150.9	88%	0.883	80%	0.802	S	S	*	*			trans	-79.5	-179.1	-165.3	-118.8	-172.1	-169.8	-167.4	3.1	114
330	P	28.2	Very low	23.3	Very low	103 Å²	103	152.4 Å²	152.4	67%	0.669	81%	0.807	S	S	*	*				-131.9	165.7	-82.2	37.5	-17.6	0	0	0	113.3
331	L	22.1	Very low	23.1	Very low	178 Å²	178	154.9 Å²	154.9	93%	0.932	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-94.6	122.6	160.3	-86.2	168.9	0	0	0	109.7
332	L	22.5	Very low	23.4	Very low	148 Å²	148	157.7 Å²	157.7	78%	0.775	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-63.9	122.8	175.3	-82.5	158.4	0	0	0	111.1	Y334	L332-Y334 HydrophobicContact CD2-CE2 4.21Å
333	L	21.5	Very low	23.5	Very low	163 Å²	163	159.1 Å²	159.1	85%	0.853	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-102.4	139.2	153.1	-87.2	150.6	0	0	0	107
334	Y	20.5	Very low	23.6	Very low	205 Å²	205	156.9 Å²	156.9	80%	0.804	81%	0.814	S	S	*	*			trans	-110.3	138.7	157.2	-99	-85	0	0	0	110.3	L332	L332-Y334 HydrophobicContact CD2-CE2 4.21Å
335	P	28.5	Very low	23.7	Very low	104 Å²	104	155.5 Å²	155.5	68%	0.675	82%	0.815	S	S	*	*			trans	-92.8	165.2	-177.1	34	-17.8	0	0	0	109.9
336	E	24.2	Very low	23.8	Very low	169 Å²	169	157.8 Å²	157.8	79%	0.79	82%	0.816	S	S	*	*				-170.8	147.2	68.9	-76.8	179.8	150.7	0	0	105.1
337	D	23.4	Very low	24	Very low	154 Å²	154	162 Å²	162	82%	0.824	82%	0.823	S	S	*	*				-156.3	135.7	65.1	-95.6	-41.1	0	0	0	111.5
338	L	23	Very low	24.1	Very low	161 Å²	161	160.3 Å²	160.3	84%	0.843	82%	0.822	S	S	*	*			trans	-78.6	131.6	163.5	-93.3	84.8	0	0	0	109.6
339	T	23.4	Very low	24.2	Very low	130 Å²	130	158 Å²	158	80%	0.798	82%	0.824	S	S	*	*			trans	-159.8	100.2	130.1	30.8	0	0	0	0	111.5
340	T	23.4	Very low	24.1	Very low	131 Å²	131	150.9 Å²	150.9	80%	0.804	82%	0.816	S	S	*	*			trans	33.6	93.1	135.7	47.2	0	0	0	0	119.9
341	R	21.6	Very low	23.9	Very low	245 Å²	245	152.9 Å²	152.9	93%	0.925	83%	0.826	S	S	*	*			trans	-154.6	127.9	134.1	-146.5	166.5	176.7	170	-2.3	112.8
342	K	26.8	Very low	24.1	Very low	206 Å²	206	155.2 Å²	155.2	90%	0.896	82%	0.823	S	S	*	*			trans	-43.2	128.9	-179.1	-69.3	170.4	172.1	176	0	114.1
343	V	24.2	Very low	24.2	Very low	140 Å²	140	153.8 Å²	153.8	85%	0.848	82%	0.82	S	S	*	*			trans	-137.6	138.2	155.5	-178	0	0	0	0	109.7
344	S	23.7	Very low	24.6	Very low	109 Å²	109	152.9 Å²	152.9	76%	0.762	82%	0.815	S	S	*	*			trans	-66.8	146.7	-171.6	46.6	0	0	0	0	115.4
345	L	23.4	Very low	24.8	Very low	161 Å²	161	152.9 Å²	152.9	84%	0.843	82%	0.815	S	S	*	*			trans	-54.6	138.1	167.8	-76.1	90.2	0	0	0	112.7
346	H	25.6	Very low	24.8	Very low	181 Å²	181	155.2 Å²	155.2	84%	0.838	82%	0.82	S	S	*	*				-179.2	97.7	119.5	-99	45.4	0	0	0	111.6
347	E	25.3	Very low	24.9	Very low	199 Å²	199	156.5 Å²	156.5	93%	0.93	82%	0.823	S	S	*	*			trans	-179	141.8	155.4	-104.7	171.7	-170.1	0	0	105.5
348	A	26.3	Very low	25	Very low	90 Å²	90	156.4 Å²	156.4	74%	0.744	82%	0.822	S	S	*	*			cis	-158.7	147.5	7.6	0	0	0	0	0	107.9	A350	A348-A350 PolarHBondContact O-N 3.47Å
349	A	24.5	Very low	25.1	Very low	106 Å²	106	153.9 Å²	153.9	88%	0.876	82%	0.818	S	S	*	*			trans	-79.2	100.2	167.5	0	0	0	0	0	109
350	A	25	Very low	25.4	Very low	85 Å²	85	153.9 Å²	153.9	70%	0.702	82%	0.818	S	S	*	*			trans	-82.9	116.9	173.7	0	0	0	0	0	110.2	A348	A348-A350 PolarHBondContact O-N 3.47Å
351	T	24.1	Very low	25.5	Very low	145 Å²	145	156.7 Å²	156.7	89%	0.89	82%	0.822	S	S	*	*			trans	-81	121.4	168	-0.5	0	0	0	0	108.2
352	R	25.3	Very low	25.8	Very low	227 Å²	227	151.8 Å²	151.8	86%	0.857	82%	0.819	S	S	*	*			trans	-112.5	128.3	174.1	-72.9	-175.3	175.4	177.6	-1.2	109.6
353	T	25.6	Very low	25.7	Very low	118 Å²	118	149.7 Å²	149.7	72%	0.724	82%	0.818	S	S	*	*			trans	-97	127.5	174	-39.5	0	0	0	0	108.4
354	I	28.1	Very low	25.9	Very low	145 Å²	145	148.8 Å²	148.8	74%	0.744	82%	0.818	S	S	*	*			trans	-114.7	133.4	177.3	-58.7	175.1	0	0	0	108.2	I356	I354-I356 HydrophobicContact CG2-CG1 4.37Å
355	Y	26.5	Very low	25.9	Very low	205 Å²	205	148.6 Å²	148.6	80%	0.804	82%	0.816	S	S	*	*			trans	-99.6	121.3	172.4	-63.9	-87.8	0	0	0	108.8
356	I	28.5	Very low	26	Very low	152 Å²	152	147 Å²	147	78%	0.779	81%	0.813	S	S	*	*			trans	-103	124.5	171.5	-57.8	177.3	0	0	0	107.3	I354	I354-I356 HydrophobicContact CG2-CG1 4.37Å
357	K	24.7	Very low	26	Very low	196 Å²	196	144.7 Å²	144.7	85%	0.852	81%	0.812	S	S	*	*			trans	-100.4	114.4	173	-173.8	179.6	-178.4	-176.9	0	106.9	S359	K357-S359 PolarHBondContact O-N 3.47Å
358	D	26.8	Very low	25.8	Very low	152 Å²	152	146.8 Å²	146.8	81%	0.813	81%	0.811	S	S	*	*			trans	-72.2	124.5	174.1	-108.2	-20.5	0	0	0	109.6
359	S	24.3	Very low	25.7	Very low	108 Å²	108	148 Å²	148	76%	0.755	81%	0.814	S	S	*	*			trans	-117.7	100.5	171.3	56.8	0	0	0	0	108.5	K357	K357-S359 PolarHBondContact O-N 3.47Å
360	T	29.4	Very low	25.8	Very low	130 Å²	130	149.2 Å²	149.2	80%	0.798	81%	0.81	S	S	*	*			trans	-122	97.8	163	54.2	0	0	0	0	108.2
361	E	26	Very low	25.8	Very low	191 Å²	191	154.4 Å²	154.4	89%	0.893	82%	0.82	S	S	*	*			trans	-80.9	122.1	162	-75.8	-176.6	159.9	0	0	108.7
362	V	28.3	Very low	25.9	Very low	142 Å²	142	152.8 Å²	152.8	86%	0.861	82%	0.815	S	S	*	*			trans	-134.9	119.8	153.4	178.6	0	0	0	0	107.5
363	N	24.9	Very low	26	Very low	161 Å²	161	147.7 Å²	147.7	86%	0.861	81%	0.814	S	S	*	*			trans	-59.1	126.4	178	-83.4	-28.6	0	0	0	112.7
364	S	27	Very low	26	Very low	121 Å²	121	148 Å²	148	85%	0.846	82%	0.816	S	S	*	*			trans	-168.3	154.3	133.2	55.3	0	0	0	0	110.8
365	S	25.4	Very low	26	Very low	105 Å²	105	147.8 Å²	147.8	73%	0.734	82%	0.821	S	S	*	*			trans	-80.9	159	-157.6	49.3	0	0	0	0	116.6
366	V	25.2	Very low	26.1	Very low	127 Å²	127	144 Å²	144	77%	0.77	82%	0.82	S	S	*	*			trans	93.6	128	152.8	-151.4	0	0	0	0	117.9
367	V	24.4	Very low	26	Very low	134 Å²	134	142.5 Å²	142.5	81%	0.812	82%	0.82	S	S	*	*			trans	88.9	117	159.4	-159	0	0	0	0	119.1
368	R	22.7	Very low	26.2	Very low	243 Å²	243	142.4 Å²	142.4	92%	0.917	83%	0.825	S	S	*	*			trans	-54.9	127	169.3	-166.9	-177.9	-152.2	157.4	2.7	113.3
369	S	23.6	Very low	26.3	Very low	116 Å²	116	141.5 Å²	141.5	81%	0.811	83%	0.825	S	S	*	*			trans	-167	143	136	41.9	0	0	0	0	111
370	T	25.1	Very low	26.4	Very low	130 Å²	130	143.9 Å²	143.9	80%	0.798	83%	0.828	S	S	*	*			trans	-66.3	135.8	-178.5	41.1	0	0	0	0	112.9
371	E	25.4	Very low	26.3	Very low	195 Å²	195	142.5 Å²	142.5	91%	0.911	82%	0.824	S	S	*	*			trans	-172.9	144	140.5	-106.2	162.9	-157.2	0	0	112.9
372	S	26.2	Very low	26.5	Very low	110 Å²	110	140.2 Å²	140.2	77%	0.769	82%	0.817	S	S	*	*			trans	-76	124.2	-172	53.7	0	0	0	0	113.2
373	S	27.4	Very low	26.5	Very low	120 Å²	120	140 Å²	140	84%	0.839	82%	0.816	S	S	*	*			trans	-87.4	114.5	169.9	52.5	0	0	0	0	111.6
374	T	25.9	Very low	26.9	Very low	125 Å²	125	137.1 Å²	137.1	77%	0.767	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-72.5	124.2	173.6	46.1	0	0	0	0	111
375	T	27.4	Very low	27.1	Very low	140 Å²	140	134.8 Å²	134.8	86%	0.859	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-85.3	121.1	172.3	40.4	0	0	0	0	110
376	T	29.6	Very low	27.3	Very low	125 Å²	125	138.5 Å²	138.5	77%	0.767	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-100.2	130.2	174.9	47.2	0	0	0	0	110.5
377	P	26.9	Very low	27.6	Very low	122 Å²	122	137.9 Å²	137.9	79%	0.792	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-81.4	126	176.8	29.5	-30.9	0	0	0	111.2
378	M	29.2	Very low	28.1	Very low	193 Å²	193	138.1 Å²	138.1	95%	0.951	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-93.8	130.2	169.2	-129.2	179.1	-102.4	0	0	109.2
379	T	27.8	Very low	28.3	Very low	133 Å²	133	133.6 Å²	133.6	82%	0.816	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-103.3	125.7	177.7	-53.7	0	0	0	0	109.6
380	L	26.8	Very low	28.7	Very low	158 Å²	158	139.3 Å²	139.3	83%	0.827	81%	0.811	S	S	*	*			trans	-102.8	107.9	178.2	-149.1	128.9	0	0	0	109.2	I382	L380-I382 HydrophobicContact CD2-CD1 4.32Å; L380-I382 HydrophobicContact CD2-CG1 3.98Å
381	S	26.3	Very low	29.1	Very low	101 Å²	101	137.8 Å²	137.8	71%	0.706	81%	0.806	S	S	*	*			trans	-100.7	114.3	176.9	56.1	0	0	0	0	110.4
382	I	31.2	Very low	29.3	Very low	143 Å²	143	138.3 Å²	138.3	73%	0.733	81%	0.805	S	S	*	*			trans	-95.1	108.8	173	-56	174	0	0	0	107.8	L380	L380-I382 HydrophobicContact CD2-CD1 4.32Å; L380-I382 HydrophobicContact CD2-CG1 3.98Å
383	T	28.6	Very low	29.4	Very low	139 Å²	139	141.1 Å²	141.1	85%	0.853	81%	0.809	S	S	*	*			trans	-100	104.6	166.5	42.6	0	0	0	0	108.8
384	S	33.8	Very low	29.3	Very low	100 Å²	100	141 Å²	141	70%	0.699	80%	0.804	S	S	*	*			trans	-113.9	123.9	159.5	68.3	0	0	0	0	109.3
385	G	30.8	Very low	29.6	Very low	72 Å²	72	143.1 Å²	143.1	74%	0.742	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-70.8	131.6	162.7	0	0	0	0	0	108.6	P387	G385-P387 WeakPolarHBondContact O-CD 3.25Å
386	M	29.2	Very low	29.5	Very low	182 Å²	182	141.7 Å²	141.7	90%	0.897	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-73	125.9	175.1	-75.3	-162.6	-174.2	0	0	110.5
387	P	30.8	Very low	29.4	Very low	114 Å²	114	142.7 Å²	142.7	74%	0.74	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-81.6	122.9	158.9	5.3	12.7	0	0	0	109.1	G385 N389	G385-P387 WeakPolarHBondContact O-CD 3.25Å; P387-N389 VanDerWaalsContact C-N 3.33Å; P387-N389 PolarHBondContact O-N 3.45Å; P387-N389 VanDerWaalsContact O-N 3.1Å
388	T	35.8	Very low	29.3	Very low	140 Å²	140	142.2 Å²	142.2	86%	0.859	80%	0.803	S	S	*	*	S	Bend	trans	-78.9	75.1	169.8	50.8	0	0	0	0	110.4
389	N	27	Very low	29.1	Very low	147 Å²	147	137.4 Å²	137.4	79%	0.786	79%	0.794	S	S	*	*			trans	-178.4	133.1	149.6	-123.6	-32.7	0	0	0	112.6	P387 S391	P387-N389 VanDerWaalsContact C-N 3.33Å; P387-N389 PolarHBondContact O-N 3.45Å; P387-N389 VanDerWaalsContact O-N 3.1Å; N389-S391 PolarHBondContact O-N 3.44Å
390	Y	32.2	Very low	28.9	Very low	236 Å²	236	137.7 Å²	137.7	93%	0.925	80%	0.796	S	S	*	*			trans	-82.8	91	170.5	-80	-90.6	0	0	0	110.3
391	S	31.8	Very low	28.8	Very low	99 Å²	99	138.7 Å²	138.7	69%	0.692	80%	0.801	S	S	*	*	S	Bend	trans	-174.9	115.3	145.2	59.3	0	0	0	0	109.4	N389	N389-S391 PolarHBondContact O-N 3.44Å
392	K	30.2	Very low	28.7	Very low	205 Å²	205	144.7 Å²	144.7	89%	0.891	81%	0.808	S	S	*	*			trans	109.1	115.9	174.8	-66.5	175	174.1	178.4	0	114.4
393	M	27.7	Very low	28.5	Very low	170 Å²	170	145.7 Å²	145.7	84%	0.837	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-60.4	131.4	171.3	-133.4	169.8	108.5	0	0	110.5
394	P	26.6	Very low	28.3	Very low	116 Å²	116	147.3 Å²	147.3	75%	0.753	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-84	122.4	156.7	-4.5	22.6	0	0	0	108.9
395	Q	31.5	Very low	28	Very low	170 Å²	170	149.2 Å²	149.2	79%	0.794	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-74.2	130.8	166.3	-71.1	176.2	-30	0	0	108.6
396	S	26.5	Very low	27.7	Very low	110 Å²	110	151.4 Å²	151.4	77%	0.769	81%	0.807	S	S	*	*			trans	80.4	124	172.7	74.8	0	0	0	0	118.6
397	T	26.7	Very low	27.4	Very low	146 Å²	146	149.1 Å²	149.1	90%	0.896	80%	0.803	S	S	*	*			trans	-112.9	117.5	166	-47.8	0	0	0	0	107.3
398	T	24.3	Very low	27.3	Very low	112 Å²	112	149.6 Å²	149.6	69%	0.687	80%	0.804	S	S	*	*			trans	-88.4	120.6	177.6	-41.9	0	0	0	0	109.5
399	A	25.6	Very low	26.7	Very low	93 Å²	93	149.8 Å²	149.8	77%	0.769	80%	0.8	S	S	*	*			trans	-100	121.1	172.6	0	0	0	0	0	109.7
400	T	23.8	Very low	26.6	Very low	139 Å²	139	150 Å²	150	85%	0.853	80%	0.799	S	S	*	*			trans	-90.2	115	175.6	40	0	0	0	0	110.8
401	L	23.7	Very low	26.3	Very low	178 Å²	178	145.5 Å²	145.5	93%	0.932	79%	0.79	S	S	*	*			trans	-82.5	128.5	168.3	-108.3	119.1	0	0	0	109.7
402	R	25.7	Very low	26	Very low	228 Å²	228	148.5 Å²	148.5	86%	0.86	80%	0.799	S	S	*	*			trans	-112.1	118.2	172.5	-161	175.8	-174.1	151.7	0.9	108.9
403	K	26.3	Very low	25.8	Very low	164 Å²	164	144.1 Å²	144.1	71%	0.713	79%	0.79	S	S	*	*			trans	-97	122.6	171.7	-166.6	-174.9	-168.5	-170.9	0	107.9	E405	K403-E405 HydrophobicContact CD-CG 4.24Å; K403-E405 WeakPolarHBondContact CE-OE1 3.08Å; K403-E405 HydrophobicContact CG-CG 4.37Å; K403-E405 IonicContact NZ-OE1 2.61Å; K403-E405 PolarHBondContact NZ-OE1 3.32Å
404	E	25.3	Very low	25.7	Very low	173 Å²	173	144.7 Å²	144.7	81%	0.808	79%	0.79	S	S	*	*			trans	-100.5	115.4	165.9	-74.1	-175.7	168	0	0	107.7
405	E	26.1	Very low	25.8	Very low	140 Å²	140	144.6 Å²	144.6	65%	0.654	79%	0.787	S	S	*	*			trans	-104.7	122	168.7	-81.9	179.1	172	0	0	108.8	K403	K403-E405 HydrophobicContact CD-CG 4.24Å; K403-E405 WeakPolarHBondContact CE-OE1 3.08Å; K403-E405 HydrophobicContact CG-CG 4.37Å; K403-E405 IonicContact NZ-OE1 2.61Å; K403-E405 PolarHBondContact NZ-OE1 3.32Å
406	S	24	Very low	25.5	Very low	118 Å²	118	142.5 Å²	142.5	83%	0.825	79%	0.788	S	S	*	*			trans	-93.8	114.8	165.8	67.6	0	0	0	0	108.8
407	T	24.5	Very low	25.5	Very low	133 Å²	133	142.5 Å²	142.5	82%	0.816	79%	0.788	S	S	*	*			trans	-109.5	113.4	165.5	43.2	0	0	0	0	109.6
408	T	27.3	Very low	25.6	Very low	124 Å²	124	145.1 Å²	145.1	76%	0.761	79%	0.787	S	S	*	*			trans	-74.5	126.8	161.4	42.3	0	0	0	0	108.7
409	N	24.4	Very low	25.8	Very low	144 Å²	144	144.1 Å²	144.1	77%	0.77	79%	0.79	S	S	*	*			trans	-167.1	122.6	143.7	-95.7	-22.7	0	0	0	113.5
410	I	25.1	Very low	25.9	Very low	151 Å²	151	149 Å²	149	77%	0.774	80%	0.797	S	S	*	*			trans	62.2	121.1	131.1	-52.3	170.1	0	0	0	120.1
411	L	26	Very low	26.2	Very low	142 Å²	142	149.4 Å²	149.4	74%	0.743	79%	0.792	S	S	*	*			trans	-29.3	129.3	161.2	-170.5	71.1	0	0	0	115.9
412	N	25	Very low	26.3	Very low	162 Å²	162	146.4 Å²	146.4	87%	0.866	79%	0.785	S	S	*	*			trans	-144.6	130.6	143	-107.6	-14.1	0	0	0	110.9
413	T	25.6	Very low	26.8	Very low	114 Å²	114	144 Å²	144	70%	0.699	78%	0.783	S	S	*	*			trans	-67.5	134.4	-177.1	43.3	0	0	0	0	113
414	H	26.1	Very low	27.2	Very low	181 Å²	181	143 Å²	143	84%	0.838	78%	0.784	S	S	*	*			trans	-155.9	127.5	145.9	-130.4	-57.8	0	0	0	114.6
415	V	28.9	Very low	27.9	Very low	115 Å²	115	141.3 Å²	141.3	70%	0.697	78%	0.776	S	S	*	*			trans	-13.6	141.6	160.9	-175.8	0	0	0	0	118.3
416	P	25.7	Very low	28.4	Very low	126 Å²	126	141 Å²	141	82%	0.818	78%	0.778	S	S	*	*			trans	-83.1	138.1	178.2	34.6	-32.2	0	0	0	111.6
417	S	25.6	Very low	29.2	Very low	109 Å²	109	144.1 Å²	144.1	76%	0.762	78%	0.777	S	S	*	*			trans	-141.2	120.4	165.7	80.2	0	0	0	0	113
418	K	28.5	Very low	30	Very low	202 Å²	202	145.9 Å²	145.9	88%	0.878	77%	0.77	S	S	*	*			trans	56.9	107.5	146.2	-67.6	179.3	176.8	178.8	0	119.2
419	A	28	Very low	30.8	Very low	91 Å²	91	144 Å²	144	75%	0.752	76%	0.758	S	S	*	*			trans	-59.3	133.6	157.7	0	0	0	0	0	111.6
420	H	27.5	Very low	31.8	Very low	196 Å²	196	142.5 Å²	142.5	91%	0.907	75%	0.749	S	S	*	*			trans	-95.2	104.1	160	-113.7	-54.4	0	0	0	107.9
421	I	30.2	Very low	32.7	Very low	147 Å²	147	141.5 Å²	141.5	75%	0.754	74%	0.742	S	S	*	*			trans	-79.5	133.1	168.7	-73.6	169.7	0	0	0	107.8	E423	I421-E423 PolarHBondContact O-N 3.09Å
422	C	25.9	Very low	33.6	Very low	115 Å²	115	140.3 Å²	140.3	78%	0.777	74%	0.736	S	S	*	*			trans	-56.9	111	169.6	-159.1	0	0	0	0	109	I424	C422-I424 PolarHBondContact O-N 3.35Å
423	E	37.7	Very low	34.4	Very low	178 Å²	178	137.8 Å²	137.8	83%	0.832	72%	0.722	S	S	*	*			trans	-60.8	121.2	158.1	-83	-169.3	143.7	0	0	107.8	I421	I421-E423 PolarHBondContact O-N 3.09Å
424	I	34.6	Very low	35.3	Very low	142 Å²	142	134.9 Å²	134.9	73%	0.728	71%	0.71	S	S	*	*			trans	175.7	132	140.8	-88.8	150.7	0	0	0	106.9	C422	C422-I424 PolarHBondContact O-N 3.35Å
425	H	39	Very low	36.4	Very low	138 Å²	138	130.8 Å²	130.8	64%	0.639	70%	0.698	S	S	*	*			trans	85.7	44.4	176	-66.9	-64.7	0	0	0	120.1
426	L	36.8	Very low	37.4	Very low	132 Å²	132	130.7 Å²	130.7	69%	0.691	70%	0.697	S	S	*	*	S	Bend	trans	-96.3	-9.6	153.7	-158.9	66.6	0	0	0	113.5	I430	L426-I430 HydrophobicContact CG-CD1 4.46Å
427	F	41.3	Very low	38.3	Very low	184 Å²	184	132.6 Å²	132.6	81%	0.807	70%	0.697	S	S	*	*	H	α-helix	trans	-78.4	-21.4	178.9	-107.3	-86.5	0	0	0	114.3
428	Y	40.1	Very low	39.3	Very low	171 Å²	171	136.4 Å²	136.4	67%	0.671	70%	0.7	S	S	*	*	H	α-helix	trans	-85.6	-26.9	-176.1	-131.9	-93	0	0	0	113.2	L432	Y428-L432 PolarHBondContact O-N 3.21Å
429	V	44	Very low	40.4	Very low	85 Å²	85	133.5 Å²	133.5	52%	0.515	69%	0.693	S	S	.	*	H	α-helix	trans	-81.9	-28.8	-178	-177.9	0	0	0	0	111.9	N433	V429-N433 PolarHBondContact O-N 2.61Å; V429-N433 PolarHBondContact O-ND2 3.1Å
430	I	46.7	Very low	41.2	Very low	111 Å²	111	136 Å²	136	57%	0.569	73%	0.728	S	S	*	*	H	α-helix	trans	-76.7	-33.8	178.2	-60.8	174.8	0	0	0	111	L426 A434	L426-I430 HydrophobicContact CG-CD1 4.46Å; I430-A434 PolarHBondContact O-N 3.23Å
431	M	43.7	Very low	41.9	Very low	130 Å²	130	133.1 Å²	133.1	64%	0.64	72%	0.719	S	S	*	*	H	α-helix	trans	-72.4	-27.8	175.8	-67.1	-64.1	-88.3	0	0	112.9	V435	M431-V435 WeakPolarHBondContact O-CG2 3.37Å
432	L	45.9	Very low	42.5	Very low	118 Å²	118	132.3 Å²	132.3	62%	0.618	72%	0.717	S	S	*	*	H	α-helix	trans	-73.3	-35.6	177.6	-142.7	84.4	0	0	0	112.2	Y428	Y428-L432 PolarHBondContact O-N 3.21Å
433	N	41.1	Very low	43.4	Very low	108 Å²	108	133.3 Å²	133.3	58%	0.578	71%	0.714	S	S	*	*	H	α-helix	trans	-77.2	-25.6	178.1	-77	-39.8	0	0	0	113.4	V429	V429-N433 PolarHBondContact O-N 2.61Å; V429-N433 PolarHBondContact O-ND2 3.1Å
434	A	44.6	Very low	43.7	Very low	53 Å²	53	130.6 Å²	130.6	44%	0.438	71%	0.707	S	S	.	*	H	α-helix	trans	-73.1	-27	175.6	0	0	0	0	0	113.1	I430	I430-A434 PolarHBondContact O-N 3.23Å
435	V	48.9	Very low	44.3	Very low	96 Å²	96	129.9 Å²	129.9	58%	0.582	71%	0.705	S	S	*	*	H	α-helix	trans	-80.3	-26	179.1	176.1	0	0	0	0	112.2	M431 M437	M431-V435 WeakPolarHBondContact O-CG2 3.37Å; V435-M437 VanDerWaalsContact C-N 3.33Å
436	V	49.8	Very low	44.7	Very low	113 Å²	113	129.4 Å²	129.4	69%	0.685	71%	0.71	S	S	*	*	H	α-helix	trans	-76.6	-20	176.4	177.4	0	0	0	0	112.4
437	M	44.8	Very low	45.2	Very low	165 Å²	165	129.2 Å²	129.2	81%	0.813	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-5.8	178	-74.6	-85.5	-72.1	0	0	114.3	V435	V435-M437 VanDerWaalsContact C-N 3.33Å
438	F	46.9	Very low	45.5	Very low	189 Å²	189	125 Å²	125	83%	0.829	70%	0.704	S	S	*	*	S	Bend	trans	-110.9	9.2	-178.9	-99	-80.7	0	0	0	114.4
439	I	50.8	Low	46	Very low	142 Å²	142	121.2 Å²	121.2	73%	0.728	71%	0.707	S	S	*	*			trans	-129.3	54.6	171.4	-46.7	178.7	0	0	0	109.5
440	G	44.8	Very low	46.2	Very low	144 Å²	144	124.5 Å²	124.5	100%	1.485	72%	0.724	S	S	*	*			trans	-114.4	0	166.3	0	0	0	0	0	109.9

Retrieved 440 of 440 residues in 345.6 ms (Link to these results)

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