A0A093HGC1_STRCA Loading...

Leucine-rich repeat transmembrane protein FLRT3

AlphaFold DB , UniProt , Accession A0A093HGC1, Species STRCA (Struthio camelus australis), Gene n/a, Length 649 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	50.1	Low	49.4	Very low	234 Å²	234	133.1 Å²	133.1	100%	1.153	68%	0.682	S	S	*	*				0	73	0	-70	156.1	58.7	0	0	110.2
2	I	48.7	Very low	49.2	Very low	153 Å²	153	138.1 Å²	138.1	79%	0.785	69%	0.686	S	S	*	*			trans	-126.4	-7.3	-175	-65.3	173.9	0	0	0	112.6
3	S	48.3	Very low	49	Very low	104 Å²	104	132.9 Å²	132.9	73%	0.727	67%	0.667	S	S	*	*	S	Bend	trans	-92.5	-5.5	-174.4	-151.4	0	0	0	0	115.7
4	V	49.3	Very low	48.8	Very low	111 Å²	111	134.6 Å²	134.6	67%	0.673	67%	0.668	S	S	*	*	S	Bend	trans	-99.5	-24.9	-171.1	-175.1	0	0	0	0	112.9
5	T	47.9	Very low	48.8	Very low	102 Å²	102	131.8 Å²	131.8	63%	0.626	66%	0.655	S	S	*	*	H	α-helix	trans	-79.8	-23.1	-175.4	45.5	0	0	0	0	114.2
6	W	46	Very low	48.4	Very low	204 Å²	204	126.9 Å²	126.9	77%	0.773	65%	0.649	S	S	*	*	H	α-helix	trans	-78.2	-35.1	-179.9	-112.2	51.6	0	0	0	113.9	I8 F9 L10	W6-I8 VanDerWaalsContact C-N 3.34Å; W6-I8 PolarHBondContact O-N 3.22Å; W6-F9 PolarHBondContact O-N 3.17Å; W6-L10 HydrophobicContact CE3-CD1 4.43Å; W6-L10 PolarHBondContact O-N 3.42Å
7	N	46.8	Very low	48.1	Very low	108 Å²	108	127.6 Å²	127.6	58%	0.578	65%	0.653	S	S	*	*	H	α-helix	trans	-69	-30.3	179.2	-86.6	-21.1	0	0	0	113.1	I11	N7-I11 WeakPolarHBondContact O-CD1 3.35Å; N7-I11 VanDerWaalsContact O-CG1 3.32Å; N7-I11 WeakPolarHBondContact O-CG1 3.33Å; N7-I11 PolarHBondContact O-N 2.9Å
8	I	52.5	Low	47.9	Very low	100 Å²	100	129.3 Å²	129.3	51%	0.513	66%	0.663	S	S	.	*	H	α-helix	trans	-69.3	-39.6	176.6	-60.9	173	0	0	0	110.2	W6 L10 I11 W12	W6-I8 VanDerWaalsContact C-N 3.34Å; W6-I8 PolarHBondContact O-N 3.22Å; I8-L10 PolarHBondContact O-N 2.96Å; I8-I11 PolarHBondContact O-N 3.23Å; I8-W12 PolarHBondContact O-N 3.05Å
9	F	50.7	Low	47.6	Very low	158 Å²	158	129 Å²	129	69%	0.693	66%	0.662	S	S	*	*	H	α-helix	trans	-65.3	-37.2	179.1	-137.8	-94.3	0	0	0	112.6	W6 T13	W6-F9 PolarHBondContact O-N 3.17Å; F9-T13 PolarHBondContact O-N 3.34Å; F9-T13 PolarHBondContact O-OG1 2.97Å
10	L	49.9	Very low	47	Very low	90 Å²	90	129.1 Å²	129.1	47%	0.471	66%	0.664	S	S	.	*	H	α-helix	trans	-73.7	-20.5	176.8	-82.3	160.8	0	0	0	114.6	W6 I8 T13 K14	W6-L10 HydrophobicContact CE3-CD1 4.43Å; W6-L10 PolarHBondContact O-N 3.42Å; I8-L10 PolarHBondContact O-N 2.96Å; L10-T13 PolarHBondContact O-OG1 3.4Å; L10-K14 PolarHBondContact O-N 3.5Å
11	I	53.7	Low	46.8	Very low	100 Å²	100	130.7 Å²	130.7	51%	0.513	67%	0.671	S	S	.	*	H	α-helix	trans	-78	-41.2	173.7	-71.3	165.6	0	0	0	110.2	N7 I8 K14 I15	N7-I11 WeakPolarHBondContact O-CD1 3.35Å; N7-I11 VanDerWaalsContact O-CG1 3.32Å; N7-I11 WeakPolarHBondContact O-CG1 3.33Å; N7-I11 PolarHBondContact O-N 2.9Å; I8-I11 PolarHBondContact O-N 3.23Å; I11-K14 PolarHBondContact O-N 3.01Å; I11-I15 HydrophobicContact CG2-CD1 3.84Å; I11-I15 WeakPolarHBondContact O-CG1 3.34Å; I11-I15 PolarHBondContact O-N 3.02Å
12	W	46.2	Very low	46.2	Very low	193 Å²	193	122.2 Å²	122.2	73%	0.731	64%	0.638	S	S	*	*	H	α-helix	trans	-67.7	-35.5	178	-81.2	73.3	0	0	0	113.1	I8 K14 I15 G16	I8-W12 PolarHBondContact O-N 3.05Å; W12-K14 VanDerWaalsContact C-N 3.34Å; W12-K14 PolarHBondContact O-N 3.42Å; W12-I15 PolarHBondContact O-N 3.41Å; W12-G16 PolarHBondContact O-N 3.17Å
13	T	47.3	Very low	45.6	Very low	71 Å²	71	120.4 Å²	120.4	44%	0.436	64%	0.636	S	S	.	*	H	α-helix	trans	-69.9	-28.3	174	53.9	0	0	0	0	113.4	F9 L10 L17	F9-T13 PolarHBondContact O-N 3.34Å; F9-T13 PolarHBondContact O-OG1 2.97Å; L10-T13 PolarHBondContact O-OG1 3.4Å; T13-L17 PolarHBondContact O-N 3.36Å
14	K	45.9	Very low	45	Very low	156 Å²	156	126 Å²	126	68%	0.678	64%	0.643	S	S	*	*	H	α-helix	trans	-79.6	-28.7	173.3	-79.6	-170	172.4	-173.6	0	114.2	L10 I11 W12 L17	L10-K14 PolarHBondContact O-N 3.5Å; I11-K14 PolarHBondContact O-N 3.01Å; W12-K14 VanDerWaalsContact C-N 3.34Å; W12-K14 PolarHBondContact O-N 3.42Å; K14-L17 PolarHBondContact O-N 3.35Å
15	I	48.2	Very low	44.4	Very low	93 Å²	93	125.8 Å²	125.8	48%	0.477	65%	0.646	S	S	.	*	H	α-helix	trans	-73.8	-37.3	172.9	-67.3	168.5	0	0	0	110.5	I11 W12 L17 L18 L19	I11-I15 HydrophobicContact CG2-CD1 3.84Å; I11-I15 WeakPolarHBondContact O-CG1 3.34Å; I11-I15 PolarHBondContact O-N 3.02Å; W12-I15 PolarHBondContact O-N 3.41Å; I15-L17 PolarHBondContact O-N 3.49Å; I15-L18 PolarHBondContact O-N 3.05Å; I15-L18 VanDerWaalsContact O-N 3.14Å; I15-L19 PolarHBondContact O-N 2.96Å
16	G	43	Very low	44	Very low	54 Å²	54	126.6 Å²	126.6	56%	0.557	65%	0.65	S	S	*	*	H	α-helix	trans	-62.5	-22	172.2	0	0	0	0	0	114.7	W12	W12-G16 PolarHBondContact O-N 3.17Å
17	L	44.1	Very low	43.8	Very low	139 Å²	139	121.7 Å²	121.7	73%	0.728	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-1.8	176.5	-96.7	157	0	0	0	114.3	T13 K14 I15	T13-L17 PolarHBondContact O-N 3.36Å; K14-L17 PolarHBondContact O-N 3.35Å; I15-L17 PolarHBondContact O-N 3.49Å
18	L	43.9	Very low	43.9	Very low	157 Å²	157	120.6 Å²	120.6	82%	0.822	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.2	-5.2	170.7	-83.5	163.7	0	0	0	112.7	I15 D20	I15-L18 PolarHBondContact O-N 3.05Å; I15-L18 VanDerWaalsContact O-N 3.14Å; L18-D20 VanDerWaalsContact C-N 3.33Å
19	L	42.1	Very low	44.4	Very low	124 Å²	124	121 Å²	121	65%	0.649	65%	0.651	S	S	*	*			trans	-101.7	39.5	161.2	-80.2	165.2	0	0	0	110.7	I15 M21	I15-L19 PolarHBondContact O-N 2.96Å; L19-M21 PolarHBondContact O-N 3.4Å
20	D	36.3	Very low	45.7	Very low	130 Å²	130	117.5 Å²	117.5	70%	0.695	65%	0.645	S	S	*	*			trans	-71.5	68.3	153.2	-156.8	13.6	0	0	0	107.5	L18 A22	L18-D20 VanDerWaalsContact C-N 3.33Å; D20-A22 PolarHBondContact O-N 3.05Å
21	M	42.6	Very low	47.7	Very low	164 Å²	164	115.4 Å²	115.4	81%	0.808	64%	0.637	S	S	*	*			trans	-62.5	89.1	148.5	-82	-157.6	165.6	0	0	104.7	L19 P23	L19-M21 PolarHBondContact O-N 3.4Å; M21-P23 VanDerWaalsContact O-N 3.15Å
22	A	36.2	Very low	49.7	Very low	56 Å²	56	111.1 Å²	111.1	46%	0.463	62%	0.616	S	S	.	*			trans	-38.7	127.8	157.9	0	0	0	0	0	105.9	D20 Y24	D20-A22 PolarHBondContact O-N 3.05Å; A22-Y24 VanDerWaalsContact C-N 3.26Å; A22-Y24 PolarHBondContact O-N 3.46Å
23	P	37.7	Very low	51.9	Low	115 Å²	115	108 Å²	108	75%	0.747	62%	0.624	S	S	*	*			trans	-54.4	112	161.1	24.8	-30.3	0	0	0	103.9	M21 S25	M21-P23 VanDerWaalsContact O-N 3.15Å; P23-S25 PolarHBondContact O-N 3.34Å
24	Y	35.3	Very low	54.1	Low	222 Å²	222	108.2 Å²	108.2	87%	0.871	63%	0.625	S	S	*	*			trans	-55.9	93.3	150.3	-81.5	-87.8	0	0	0	102.8	A22 V26	A22-Y24 VanDerWaalsContact C-N 3.26Å; A22-Y24 PolarHBondContact O-N 3.46Å; Y24-V26 PolarHBondContact O-N 3.01Å
25	S	36.2	Very low	56.5	Low	105 Å²	105	101.5 Å²	101.5	73%	0.734	60%	0.597	S	S	*	*			trans	-55.8	92.7	145.7	48.2	0	0	0	0	102.9	P23 S27	P23-S25 PolarHBondContact O-N 3.34Å; S25-S27 PolarHBondContact O-N 3.43Å
26	V	39.2	Very low	58.8	Low	119 Å²	119	104.3 Å²	104.3	72%	0.721	60%	0.602	S	S	*	*			trans	-53.6	94.1	151.7	177.6	0	0	0	0	101.9	Y24 A28	Y24-V26 PolarHBondContact O-N 3.01Å; V26-A28 VanDerWaalsContact C-N 3.32Å; V26-A28 WeakPolarHBondContact O-CA 3.43Å; V26-A28 PolarHBondContact O-N 3.38Å
27	S	41.4	Very low	61.2	Low	101 Å²	101	103.5 Å²	103.5	71%	0.706	59%	0.587	S	S	*	*			trans	-49.9	108.5	175	-179.7	0	0	0	0	103.7	S25 K29	S25-S27 PolarHBondContact O-N 3.43Å; S27-K29 PolarHBondContact O-N 3.26Å
28	A	49.8	Very low	63.6	Low	86 Å²	86	100.2 Å²	100.2	71%	0.711	57%	0.57	S	S	*	*			trans	-59.3	108.8	-163.1	0	0	0	0	0	105.6	V26	V26-A28 VanDerWaalsContact C-N 3.32Å; V26-A28 WeakPolarHBondContact O-CA 3.43Å; V26-A28 PolarHBondContact O-N 3.38Å
29	K	62.4	Low	65.7	Low	107 Å²	107	98.1 Å²	98.1	47%	0.465	56%	0.563	S	S	.	*			trans	-50	123.3	-170.4	-80	-163.8	172	-161.5	0	106.3	S27 C31 D59	S27-K29 PolarHBondContact O-N 3.26Å; K29-C31 VanDerWaalsContact C-N 3.35Å; K29-C31 VanDerWaalsContact O-CB 3.31Å; K29-C31 WeakPolarHBondContact O-CB 3.48Å; K29-C31 PolarHBondContact O-N 2.96Å; K29-D59 IonicContact NZ-OD2 2.65Å; K29-D59 PolarHBondContact NZ-OD2 3.5Å
30	P	79.2	Confident	67.9	Low	86 Å²	86	92.5 Å²	92.5	56%	0.558	54%	0.535	S	S	*	.			trans	-60.9	102.6	-168.7	23.4	-33.3	0	0	0	107.5	G55 P57	P30-G55 CarbonylContact C-O 3.6Å; P30-G55 VanDerWaalsContact C-O 3.31Å; P30-P57 WeakPolarHBondContact O-CD 3.37Å; P30-P57 WeakPolarHBondContact O-CG 3.43Å
31	C	92.2	Very high	70.8	Confident	46 Å²	46	89.8 Å²	89.8	31%	0.311	52%	0.517	S	S	.	.			trans	-129.1	131.7	-172.4	-177.1	0	0	0	0	106.5	K29 S33 C37	K29-C31 VanDerWaalsContact C-N 3.35Å; K29-C31 VanDerWaalsContact O-CB 3.31Å; K29-C31 WeakPolarHBondContact O-CB 3.48Å; K29-C31 PolarHBondContact O-N 2.96Å; C31-S33 PolarHBondContact O-N 3.37Å; C31-C37 VanDerWaalsContact CA-SG 3.57Å; C31-C37 HydrophobicContact CB-CB 3.81Å; C31-C37 WeakPolarHBondContact CB-SG 2.99Å; C31-C37 WeakPolarHBondContact SG-CB 3.33Å; C31-C37 PolarHBondContact SG-N 2.89Å; C31-C37 CovalentContact SG-SG 2.04Å; C31-C37 PolarHBondContact SG-SG 3.41Å
32	P	94.1	Very high	73.4	Confident	9 Å²	9	82 Å²	82	6%	0.058	48%	0.479	C	S	.	.			trans	-60.4	133.6	178.8	-19.6	30.9	0	0	0	110.3	V34 C35 P53 G55 I56	P32-V34 HydrophobicContact CB-CG2 4.29Å; P32-V34 PolarHBondContact O-N 2.91Å; P32-V34 VanDerWaalsContact O-N 3.11Å; P32-C35 HydrophobicContact CB-CB 4.21Å; P32-C35 HydrophobicContact CG-CB 4.43Å; P32-C35 PolarHBondContact O-N 3.25Å; P32-C35 VanDerWaalsContact O-O 3.13Å; P32-P53 HydrophobicContact CB-CB 3.8Å; P32-P53 HydrophobicContact CB-CG 3.76Å; P32-P53 HydrophobicContact CG-CB 4.26Å; P32-P53 HydrophobicContact CG-CG 3.95Å; P32-G55 WeakPolarHBondContact CD-O 3.38Å; P32-I56 HydrophobicContact CG-CG1 4.14Å
33	S	92.6	Very high	76.4	Confident	129 Å²	129	83.1 Å²	83.1	90%	0.902	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.4	-175.1	54	0	0	0	0	114.4	C31	C31-S33 PolarHBondContact O-N 3.37Å
34	V	94.8	Very high	79.2	Confident	75 Å²	75	77.6 Å²	77.6	46%	0.455	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-20.6	174.1	-65.4	0	0	0	0	113.1	P32 R47 L49 P53	P32-V34 HydrophobicContact CB-CG2 4.29Å; P32-V34 PolarHBondContact O-N 2.91Å; P32-V34 VanDerWaalsContact O-N 3.11Å; V34-R47 VanDerWaalsContact O-CD 3.26Å; V34-R47 WeakPolarHBondContact O-CD 3.5Å; V34-R47 PolarHBondContact O-NE 3.19Å; V34-L49 HydrophobicContact CG2-CD2 4.19Å; V34-P53 HydrophobicContact CG2-CB 3.88Å; V34-P53 HydrophobicContact CG2-CG 3.87Å
35	C	95.8	Very high	82.2	Confident	14 Å²	14	68.4 Å²	68.4	10%	0.095	40%	0.402	C	S	.	.	S	Bend	trans	-104.3	169.2	-177.6	-60	0	0	0	0	112	P32 Y43 C44 P53	P32-C35 HydrophobicContact CB-CB 4.21Å; P32-C35 HydrophobicContact CG-CB 4.43Å; P32-C35 PolarHBondContact O-N 3.25Å; P32-C35 VanDerWaalsContact O-O 3.13Å; C35-Y43 WeakPolarHBondContact CA-O 3.47Å; C35-Y43 WeakPolarHBondContact CB-O 3.43Å; C35-C44 HydrophobicContact CB-CB 4.17Å; C35-C44 WeakPolarHBondContact CB-SG 3.34Å; C35-C44 VanDerWaalsContact SG-CA 3.54Å; C35-C44 WeakPolarHBondContact SG-CB 3.49Å; C35-C44 CovalentContact SG-SG 2.03Å; C35-C44 PolarHBondContact SG-SG 3.35Å; C35-P53 VanDerWaalsContact SG-CG 3.52Å
36	R	95.3	Very high	85.1	Confident	153 Å²	153	67.9 Å²	67.9	58%	0.577	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	130.2	167.9	172.9	179.2	168.7	-174.7	-7.1	108.6	D38 Y43	R36-D38 IonicContact NH2-OD2 2.73Å; R36-D38 PolarHBondContact NH2-OD2 3.18Å; R36-Y43 PolarHBondContact N-O 3.26Å; R36-Y43 WeakPolarHBondContact O-CA 3.24Å; R36-Y43 WeakPolarHBondContact O-CB 3.49Å; R36-Y43 WeakPolarHBondContact O-CD2 3.44Å; R36-Y43 PolarHBondContact O-N 2.91Å
37	C	95.3	Very high	87.9	Confident	36 Å²	36	66.2 Å²	66.2	24%	0.243	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	135.5	176.8	-49.5	0	0	0	0	109.9	C31 I42 P57	C31-C37 VanDerWaalsContact CA-SG 3.57Å; C31-C37 HydrophobicContact CB-CB 3.81Å; C31-C37 WeakPolarHBondContact CB-SG 2.99Å; C31-C37 WeakPolarHBondContact SG-CB 3.33Å; C31-C37 PolarHBondContact SG-N 2.89Å; C31-C37 CovalentContact SG-SG 2.04Å; C31-C37 PolarHBondContact SG-SG 3.41Å; C37-I42 HydrophobicContact CB-CD1 3.83Å; C37-P57 HydrophobicContact CB-CG 4.49Å
38	D	92.7	Very high	90.5	Very high	71 Å²	71	67 Å²	67	38%	0.38	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	108.2	179.8	-157.9	-16.1	0	0	0	109.1	R36 G40 F41 Y43	R36-D38 IonicContact NH2-OD2 2.73Å; R36-D38 PolarHBondContact NH2-OD2 3.18Å; D38-G40 PolarHBondContact O-N 3.44Å; D38-F41 PolarHBondContact N-O 3Å; D38-F41 WeakPolarHBondContact O-CA 3.32Å; D38-F41 VanDerWaalsContact O-CB 3.32Å; D38-F41 WeakPolarHBondContact O-CB 3.41Å; D38-F41 WeakPolarHBondContact O-CD2 3.38Å; D38-F41 PolarHBondContact O-N 3.49Å; D38-Y43 HydrophobicContact CB-CE2 4.07Å
39	V	87.9	Confident	92.8	Very high	112 Å²	112	64 Å²	64	68%	0.679	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	31.8	67.6	177	-165.5	0	0	0	0	114.9	F41	V39-F41 VanDerWaalsContact C-N 3.28Å; V39-F41 WeakPolarHBondContact O-CD2 3.38Å; V39-F41 PolarHBondContact O-N 3.35Å
40	G	90	Very high	94.4	Very high	6 Å²	6	62.7 Å²	62.7	6%	0.062	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	-14.9	178.2	0	0	0	0	0	115.5	D38 D59 A60 T61 T62	D38-G40 PolarHBondContact O-N 3.44Å; G40-D59 WeakPolarHBondContact CA-O 3.33Å; G40-A60 WeakPolarHBondContact O-CA 3.44Å; G40-T61 PolarHBondContact O-N 3.49Å; G40-T61 PolarHBondContact O-OG1 3.28Å; G40-T62 PolarHBondContact O-N 3.28Å; G40-T62 VanDerWaalsContact O-N 3.16Å
41	F	97.2	Very high	95.3	Very high	73 Å²	73	61.3 Å²	61.3	32%	0.32	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	126	172.5	-58.9	-89.7	0	0	0	110.5	D38 V39 Y43 T62 F64	D38-F41 PolarHBondContact N-O 3Å; D38-F41 WeakPolarHBondContact O-CA 3.32Å; D38-F41 VanDerWaalsContact O-CB 3.32Å; D38-F41 WeakPolarHBondContact O-CB 3.41Å; D38-F41 WeakPolarHBondContact O-CD2 3.38Å; D38-F41 PolarHBondContact O-N 3.49Å; V39-F41 VanDerWaalsContact C-N 3.28Å; V39-F41 WeakPolarHBondContact O-CD2 3.38Å; V39-F41 PolarHBondContact O-N 3.35Å; F41-Y43 HydrophobicContact CB-CE2 3.69Å; F41-T62 HydrophobicContact CD1-CG2 4.02Å; F41-T62 HydrophobicContact CE1-CG2 4.33Å; F41-F64 HydrophobicContact CB-CE2 4.22Å; F41-F64 AromaticContact CD1-CE2 3.87Å; F41-F64 HydrophobicContact CD1-CE2 3.87Å; F41-F64 HydrophobicContact CD1-CZ 4.31Å
42	I	97.3	Very high	95.5	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.01	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	109.3	-176.5	-47.1	-59.1	0	0	0	108.9	C37 I56 P57 A60 T62 L63 F64	C37-I42 HydrophobicContact CB-CD1 3.83Å; I42-I56 HydrophobicContact CG1-CG2 4.11Å; I42-I56 HydrophobicContact CG2-CG2 4.49Å; I42-P57 HydrophobicContact CD1-CG 3.74Å; I42-A60 HydrophobicContact CD1-CB 4.05Å; I42-A60 HydrophobicContact CG1-CB 3.68Å; I42-T62 PolarHBondContact N-O 3.38Å; I42-L63 HydrophobicContact CB-CD2 3.7Å; I42-L63 HydrophobicContact CG1-CD2 3.57Å; I42-L63 HydrophobicContact CG2-CD2 4.36Å; I42-F64 WeakPolarHBondContact O-CB 3.41Å; I42-F64 PolarHBondContact O-N 3.47Å
43	Y	97.8	Very high	95.6	Very high	78 Å²	78	60 Å²	60	31%	0.306	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	96.2	-178.1	-58.3	-86.6	0	0	0	110.3	C35 R36 D38 F41 R47 F64	C35-Y43 WeakPolarHBondContact CA-O 3.47Å; C35-Y43 WeakPolarHBondContact CB-O 3.43Å; R36-Y43 PolarHBondContact N-O 3.26Å; R36-Y43 WeakPolarHBondContact O-CA 3.24Å; R36-Y43 WeakPolarHBondContact O-CB 3.49Å; R36-Y43 WeakPolarHBondContact O-CD2 3.44Å; R36-Y43 PolarHBondContact O-N 2.91Å; D38-Y43 HydrophobicContact CB-CE2 4.07Å; F41-Y43 HydrophobicContact CB-CE2 3.69Å; Y43-R47 PolarHBondContact O-NH1 3.31Å; Y43-R47 PolarHBondContact O-NH2 3.08Å; Y43-R47 VanDerWaalsContact O-NH2 3.11Å; Y43-F64 HydrophobicContact CD1-CB 4.39Å; Y43-F64 AromaticContact CD1-CD2 3.49Å; Y43-F64 HydrophobicContact CD1-CD2 3.49Å; Y43-F64 VanDerWaalsContact CD1-CD2 3.49Å; Y43-F64 AromaticContact CD1-CE2 3.99Å; Y43-F64 HydrophobicContact CD1-CE2 3.99Å; Y43-F64 HydrophobicContact CD1-CG 4.13Å; Y43-F64 AromaticContact CE1-CD2 3.44Å; Y43-F64 HydrophobicContact CE1-CD2 3.44Å; Y43-F64 VanDerWaalsContact CE1-CD2 3.44Å; Y43-F64 AromaticContact CE1-CE2 3.41Å; Y43-F64 HydrophobicContact CE1-CE2 3.41Å; Y43-F64 VanDerWaalsContact CE1-CE2 3.41Å; Y43-F64 HydrophobicContact CE1-CG 4.31Å; Y43-F64 HydrophobicContact CE1-CZ 4.27Å; Y43-F64 HydrophobicContact CG-CD2 4.18Å; Y43-F64 AromaticContact CZ-CE2 3.8Å
44	C	97.6	Very high	95.5	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.313	C	S	.	.			trans	-116.4	7	174.1	-66.6	0	0	0	0	112.2	C35 L49 F64 L65 N68	C35-C44 HydrophobicContact CB-CB 4.17Å; C35-C44 WeakPolarHBondContact CB-SG 3.34Å; C35-C44 VanDerWaalsContact SG-CA 3.54Å; C35-C44 WeakPolarHBondContact SG-CB 3.49Å; C35-C44 CovalentContact SG-SG 2.03Å; C35-C44 PolarHBondContact SG-SG 3.35Å; C44-L49 HydrophobicContact CB-CD1 3.92Å; C44-L49 VanDerWaalsContact O-CD1 3.25Å; C44-L49 WeakPolarHBondContact O-CD1 3.44Å; C44-F64 CarbonylContact C-O 3.42Å; C44-F64 VanDerWaalsContact C-O 3.28Å; C44-F64 VanDerWaalsContact CA-O 3.29Å; C44-F64 WeakPolarHBondContact CA-O 3.35Å; C44-F64 WeakPolarHBondContact CB-O 3.26Å; C44-F64 PolarHBondContact N-O 3.35Å; C44-L65 HydrophobicContact CB-CD2 3.52Å; C44-L65 HydrophobicContact CB-CG 4.47Å; C44-N68 PolarHBondContact O-ND2 2.98Å
45	N	97.6	Very high	95.2	Very high	28 Å²	28	57.6 Å²	57.6	15%	0.15	31%	0.314	C	S	.	.			trans	-68.2	157.7	178.7	59.5	-70.6	0	0	0	113.8	R47 F64 Q66	N45-R47 WeakPolarHBondContact O-CG 3.28Å; N45-R47 PolarHBondContact O-N 3.2Å; N45-R47 PolarHBondContact O-NH1 3.48Å; N45-F64 HydrophobicContact CB-CB 4.3Å; N45-F64 PolarHBondContact N-O 3.49Å; N45-Q66 WeakPolarHBondContact CA-O 3.4Å; N45-Q66 VanDerWaalsContact CB-CD 3.42Å; N45-Q66 HydrophobicContact CB-CG 3.8Å; N45-Q66 WeakPolarHBondContact CB-O 3.35Å
46	D	97.7	Very high	95.2	Very high	94 Å²	94	58 Å²	58	50%	0.503	32%	0.315	S	S	.	.	S	Bend	trans	54.6	47.3	170.8	-54.8	-89	0	0	0	113.8	Q66 N67	D46-Q66 PolarHBondContact N-O 3.11Å; D46-Q66 VanDerWaalsContact N-O 3.1Å; D46-N67 VanDerWaalsContact CA-O 3.28Å; D46-N67 WeakPolarHBondContact CA-O 3.15Å; D46-N67 HydrophobicContact CB-CB 4.47Å; D46-N67 PolarHBondContact N-O 3.1Å; D46-N67 WeakPolarHBondContact OD1-CB 3.48Å; D46-N67 PolarHBondContact OD1-ND2 3.35Å
47	R	96.5	Very high	95.1	Very high	84 Å²	84	50.9 Å²	50.9	32%	0.317	29%	0.288	S	S	.	.	S	Bend	trans	-135.2	11.5	-169.8	-83.1	166.5	175.2	88.3	-7.1	114.8	V34 Y43 N45 L49 N68	V34-R47 VanDerWaalsContact O-CD 3.26Å; V34-R47 WeakPolarHBondContact O-CD 3.5Å; V34-R47 PolarHBondContact O-NE 3.19Å; Y43-R47 PolarHBondContact O-NH1 3.31Å; Y43-R47 PolarHBondContact O-NH2 3.08Å; Y43-R47 VanDerWaalsContact O-NH2 3.11Å; N45-R47 WeakPolarHBondContact O-CG 3.28Å; N45-R47 PolarHBondContact O-N 3.2Å; N45-R47 PolarHBondContact O-NH1 3.48Å; R47-L49 HydrophobicContact CB-CD1 4.22Å; R47-L49 HydrophobicContact CB-CD2 4.23Å; R47-L49 HydrophobicContact CB-CG 3.77Å; R47-L49 PolarHBondContact O-N 3.5Å; R47-L49 VanDerWaalsContact O-N 3.12Å; R47-N68 WeakPolarHBondContact CA-OD1 3.48Å; R47-N68 PolarHBondContact N-OD1 3.46Å
48	D	96.9	Very high	94.9	Very high	118 Å²	118	56.6 Å²	56.6	63%	0.631	31%	0.311	S	S	*	.			trans	52.3	30.5	-176.4	-65.7	-57.1	0	0	0	113.6	T50 N68 Q69	D48-T50 PolarHBondContact O-N 3Å; D48-N68 PolarHBondContact N-OD1 2.78Å; D48-N68 VanDerWaalsContact N-OD1 3.13Å; D48-Q69 PolarHBondContact OD1-NE2 3.29Å
49	L	97.4	Very high	94.9	Very high	22 Å²	22	56 Å²	56	12%	0.115	31%	0.308	C	S	.	.			trans	-70.1	127.7	-178.8	-61.5	177.5	0	0	0	110.3	V34 C44 R47 N68 Q69 I70	V34-L49 HydrophobicContact CG2-CD2 4.19Å; C44-L49 HydrophobicContact CB-CD1 3.92Å; C44-L49 VanDerWaalsContact O-CD1 3.25Å; C44-L49 WeakPolarHBondContact O-CD1 3.44Å; R47-L49 HydrophobicContact CB-CD1 4.22Å; R47-L49 HydrophobicContact CB-CD2 4.23Å; R47-L49 HydrophobicContact CB-CG 3.77Å; R47-L49 PolarHBondContact O-N 3.5Å; R47-L49 VanDerWaalsContact O-N 3.12Å; L49-N68 HydrophobicContact CB-CB 4.25Å; L49-N68 PolarHBondContact N-OD1 3.38Å; L49-Q69 CarbonylContact O-C 3.31Å; L49-Q69 WeakPolarHBondContact O-CA 3.23Å; L49-Q69 PolarHBondContact O-N 3.33Å; L49-I70 HydrophobicContact CB-CG1 4.32Å; L49-I70 WeakPolarHBondContact O-CG1 3.46Å; L49-I70 PolarHBondContact O-N 3.27Å; L49-I70 VanDerWaalsContact O-N 3.12Å
50	T	97.3	Very high	95.3	Very high	80 Å²	80	50.7 Å²	50.7	49%	0.491	28%	0.276	S	S	.	.	S	Bend	trans	-90.5	-12.4	171.2	55.1	0	0	0	0	113.1	D48 Q69	D48-T50 PolarHBondContact O-N 3Å; T50-Q69 WeakPolarHBondContact CA-O 3.28Å; T50-Q69 HydrophobicContact CG2-CB 4.22Å
51	S	97.5	Very high	95.6	Very high	58 Å²	58	52.6 Å²	52.6	41%	0.406	29%	0.287	S	S	.	.	S	Bend	trans	-148.3	153.9	176.4	59.3	0	0	0	0	111.3	G74	S51-G74 CarbonylContact C-O 3.48Å; S51-G74 VanDerWaalsContact CA-O 3.29Å; S51-G74 WeakPolarHBondContact CA-O 3.26Å; S51-G74 WeakPolarHBondContact CB-O 3.41Å
52	I	97.3	Very high	95.7	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.021	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-71.8	124.3	174.2	-56	175.6	0	0	0	107.7	I56 L65 I70 G74 I75 P76 L79	I52-I56 HydrophobicContact CG2-CD1 3.72Å; I52-L65 HydrophobicContact CD1-CD1 3.82Å; I52-L65 HydrophobicContact CG1-CD1 4.14Å; I52-L65 HydrophobicContact CG1-CD2 4.18Å; I52-L65 HydrophobicContact CG2-CD1 4.37Å; I52-L65 HydrophobicContact CG2-CD2 4.06Å; I52-I70 HydrophobicContact CG1-CD1 4.01Å; I52-I70 HydrophobicContact CG1-CG2 4.23Å; I52-G74 PolarHBondContact N-O 3.45Å; I52-I75 HydrophobicContact CD1-CB 4.36Å; I52-I75 HydrophobicContact CD1-CG1 3.97Å; I52-I75 HydrophobicContact CD1-CG2 4.1Å; I52-P76 HydrophobicContact CB-CG 4.32Å; I52-L79 HydrophobicContact CD1-CD2 3.81Å; I52-L79 HydrophobicContact CG2-CD1 4.3Å
53	P	94.9	Very high	95.7	Very high	22 Å²	22	49.2 Å²	49.2	14%	0.143	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-74.9	147.9	-173.5	30.3	-35.4	0	0	0	111.8	P32 V34 C35	P32-P53 HydrophobicContact CB-CB 3.8Å; P32-P53 HydrophobicContact CB-CG 3.76Å; P32-P53 HydrophobicContact CG-CB 4.26Å; P32-P53 HydrophobicContact CG-CG 3.95Å; V34-P53 HydrophobicContact CG2-CB 3.88Å; V34-P53 HydrophobicContact CG2-CG 3.87Å; C35-P53 VanDerWaalsContact SG-CG 3.52Å
54	T	90.3	Very high	95.8	Very high	109 Å²	109	47.2 Å²	47.2	67%	0.669	27%	0.265	S	S	*	.	S	Bend	trans	-75.4	158.4	179.7	56.4	0	0	0	0	112.1
55	G	89.8	Confident	95.8	Very high	46 Å²	46	47.3 Å²	47.3	47%	0.474	27%	0.266	S	S	.	.			trans	81.2	34.9	-179.9	0	0	0	0	0	114.3	P30 P32	P30-G55 CarbonylContact C-O 3.6Å; P30-G55 VanDerWaalsContact C-O 3.31Å; P32-G55 WeakPolarHBondContact CD-O 3.38Å
56	I	94.1	Very high	95.8	Very high	23 Å²	23	46.7 Å²	46.7	12%	0.118	26%	0.262	C	S	.	.			trans	-69.4	137.7	167.5	-63.3	176	0	0	0	109.2	P32 I42 I52 A60 L63 L79 L82	P32-I56 HydrophobicContact CG-CG1 4.14Å; I42-I56 HydrophobicContact CG1-CG2 4.11Å; I42-I56 HydrophobicContact CG2-CG2 4.49Å; I52-I56 HydrophobicContact CG2-CD1 3.72Å; I56-A60 HydrophobicContact CG2-CB 3.98Å; I56-L63 HydrophobicContact CG2-CD2 4.02Å; I56-L79 HydrophobicContact CD1-CD1 3.89Å; I56-L82 HydrophobicContact CB-CD1 4.03Å; I56-L82 HydrophobicContact CD1-CD1 4.43Å; I56-L82 HydrophobicContact CG2-CD1 3.57Å; I56-L82 HydrophobicContact CG2-CD2 4.36Å
57	P	93.3	Very high	95.9	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.019	25%	0.251	C	S	.	.			trans	-61.4	142.6	178.8	-16.4	23.1	0	0	0	114.5	P30 C37 I42 D59 A60	P30-P57 WeakPolarHBondContact O-CD 3.37Å; P30-P57 WeakPolarHBondContact O-CG 3.43Å; C37-P57 HydrophobicContact CB-CG 4.49Å; I42-P57 HydrophobicContact CD1-CG 3.74Å; P57-D59 WeakPolarHBondContact CB-OD1 3.02Å; P57-D59 PolarHBondContact O-N 3.03Å; P57-A60 WeakPolarHBondContact O-CB 3.49Å; P57-A60 PolarHBondContact O-N 3.29Å
58	E	92.2	Very high	96	Very high	156 Å²	156	41.1 Å²	41.1	73%	0.729	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-10.2	171.8	-62	-179.1	-176.8	0	0	114.1	R84	E58-R84 PolarHBondContact O-NH1 3.29Å
59	D	92.9	Very high	96	Very high	57 Å²	57	39.9 Å²	39.9	31%	0.305	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	7.1	170	71.5	-32.9	0	0	0	113.4	K29 G40 P57	K29-D59 IonicContact NZ-OD2 2.65Å; K29-D59 PolarHBondContact NZ-OD2 3.5Å; G40-D59 WeakPolarHBondContact CA-O 3.33Å; P57-D59 WeakPolarHBondContact CB-OD1 3.02Å; P57-D59 PolarHBondContact O-N 3.03Å
60	A	95.9	Very high	96.1	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.008	22%	0.223	C	C	.	.			trans	-62.2	133.1	172.3	0	0	0	0	0	112.1	G40 I42 I56 P57 L63 R84 V85	G40-A60 WeakPolarHBondContact O-CA 3.44Å; I42-A60 HydrophobicContact CD1-CB 4.05Å; I42-A60 HydrophobicContact CG1-CB 3.68Å; I56-A60 HydrophobicContact CG2-CB 3.98Å; P57-A60 WeakPolarHBondContact O-CB 3.49Å; P57-A60 PolarHBondContact O-N 3.29Å; A60-L63 HydrophobicContact CB-CD2 4.08Å; A60-R84 CarbonylContact O-C 3.56Å; A60-R84 VanDerWaalsContact O-C 3.26Å; A60-R84 WeakPolarHBondContact O-CB 3.31Å; A60-V85 HydrophobicContact CB-CG2 3.96Å; A60-V85 WeakPolarHBondContact O-CG2 3.37Å; A60-V85 PolarHBondContact O-N 3.44Å
61	T	97.1	Very high	96.1	Very high	47 Å²	47	38 Å²	38	29%	0.288	22%	0.216	S	C	.	.			trans	-118.4	-30.6	176.2	61.7	0	0	0	0	112.4	G40 R84 E86 R87	G40-T61 PolarHBondContact O-N 3.49Å; G40-T61 PolarHBondContact O-OG1 3.28Å; T61-R84 WeakPolarHBondContact CA-O 3.37Å; T61-E86 PolarHBondContact O-N 2.85Å; T61-R87 PolarHBondContact O-N 2.85Å
62	T	98.3	Very high	96.1	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	124.2	-176.9	-53.5	0	0	0	0	109.9	G40 F41 I42 F64 R87 Y89	G40-T62 PolarHBondContact O-N 3.28Å; G40-T62 VanDerWaalsContact O-N 3.16Å; F41-T62 HydrophobicContact CD1-CG2 4.02Å; F41-T62 HydrophobicContact CE1-CG2 4.33Å; I42-T62 PolarHBondContact N-O 3.38Å; T62-F64 HydrophobicContact CG2-CE1 4.26Å; T62-F64 HydrophobicContact CG2-CE2 3.94Å; T62-F64 HydrophobicContact CG2-CZ 3.8Å; T62-R87 WeakPolarHBondContact CA-O 3.46Å; T62-R87 HydrophobicContact CG2-CB 4.22Å; T62-R87 PolarHBondContact OG1-NE 3.49Å; T62-R87 PolarHBondContact OG1-NH2 3.28Å; T62-Y89 HydrophobicContact CG2-CD2 4.27Å; T62-Y89 HydrophobicContact CG2-CE2 3.8Å
63	L	98.3	Very high	96	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	120.2	178.6	-55.7	-177.5	0	0	0	110.6	I42 I56 A60 L65 L79 L82 V85 R87 I88 Y89	I42-L63 HydrophobicContact CB-CD2 3.7Å; I42-L63 HydrophobicContact CG1-CD2 3.57Å; I42-L63 HydrophobicContact CG2-CD2 4.36Å; I56-L63 HydrophobicContact CG2-CD2 4.02Å; A60-L63 HydrophobicContact CB-CD2 4.08Å; L63-L65 HydrophobicContact CB-CD1 4.06Å; L63-L65 HydrophobicContact CB-CG 4.42Å; L63-L65 HydrophobicContact CD1-CD1 4.36Å; L63-L79 HydrophobicContact CD1-CD1 4.05Å; L63-L82 HydrophobicContact CD1-CD1 4.39Å; L63-V85 HydrophobicContact CD1-CG1 4.01Å; L63-V85 HydrophobicContact CD1-CG2 4.2Å; L63-V85 HydrophobicContact CD2-CG2 4.26Å; L63-V85 HydrophobicContact CG-CG1 3.88Å; L63-V85 HydrophobicContact CG-CG2 4.09Å; L63-R87 PolarHBondContact N-O 3.35Å; L63-I88 HydrophobicContact CB-CG1 4.33Å; L63-I88 HydrophobicContact CB-CG2 4.5Å; L63-I88 HydrophobicContact CD1-CD1 4.17Å; L63-I88 HydrophobicContact CD1-CG1 4.23Å; L63-I88 HydrophobicContact CG-CG1 4.46Å; L63-Y89 PolarHBondContact O-N 3.03Å
64	F	98.5	Very high	96.1	Very high	37 Å²	37	40.6 Å²	40.6	16%	0.162	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	104.8	170.9	-60.5	-75.4	0	0	0	109.2	F41 I42 Y43 C44 N45 T62 Q66 Y89	F41-F64 HydrophobicContact CB-CE2 4.22Å; F41-F64 AromaticContact CD1-CE2 3.87Å; F41-F64 HydrophobicContact CD1-CE2 3.87Å; F41-F64 HydrophobicContact CD1-CZ 4.31Å; I42-F64 WeakPolarHBondContact O-CB 3.41Å; I42-F64 PolarHBondContact O-N 3.47Å; Y43-F64 HydrophobicContact CD1-CB 4.39Å; Y43-F64 AromaticContact CD1-CD2 3.49Å; Y43-F64 HydrophobicContact CD1-CD2 3.49Å; Y43-F64 VanDerWaalsContact CD1-CD2 3.49Å; Y43-F64 AromaticContact CD1-CE2 3.99Å; Y43-F64 HydrophobicContact CD1-CE2 3.99Å; Y43-F64 HydrophobicContact CD1-CG 4.13Å; Y43-F64 AromaticContact CE1-CD2 3.44Å; Y43-F64 HydrophobicContact CE1-CD2 3.44Å; Y43-F64 VanDerWaalsContact CE1-CD2 3.44Å; Y43-F64 AromaticContact CE1-CE2 3.41Å; Y43-F64 HydrophobicContact CE1-CE2 3.41Å; Y43-F64 VanDerWaalsContact CE1-CE2 3.41Å; Y43-F64 HydrophobicContact CE1-CG 4.31Å; Y43-F64 HydrophobicContact CE1-CZ 4.27Å; Y43-F64 HydrophobicContact CG-CD2 4.18Å; Y43-F64 AromaticContact CZ-CE2 3.8Å; C44-F64 CarbonylContact C-O 3.42Å; C44-F64 VanDerWaalsContact C-O 3.28Å; C44-F64 VanDerWaalsContact CA-O 3.29Å; C44-F64 WeakPolarHBondContact CA-O 3.35Å; C44-F64 WeakPolarHBondContact CB-O 3.26Å; C44-F64 PolarHBondContact N-O 3.35Å; N45-F64 HydrophobicContact CB-CB 4.3Å; N45-F64 PolarHBondContact N-O 3.49Å; T62-F64 HydrophobicContact CG2-CE1 4.26Å; T62-F64 HydrophobicContact CG2-CE2 3.94Å; T62-F64 HydrophobicContact CG2-CZ 3.8Å; F64-Q66 VanDerWaalsContact CA-OE1 3.28Å; F64-Y89 AromaticContact CD1-CD2 3.32Å; F64-Y89 HydrophobicContact CD1-CD2 3.32Å; F64-Y89 AromaticContact CD1-CE2 3.87Å; F64-Y89 HydrophobicContact CD1-CE2 3.87Å; F64-Y89 HydrophobicContact CD1-CG 4Å; F64-Y89 AromaticContact CE1-CD2 3.41Å; F64-Y89 HydrophobicContact CE1-CD2 3.41Å; F64-Y89 VanDerWaalsContact CE1-CD2 3.41Å; F64-Y89 AromaticContact CE1-CE2 3.41Å; F64-Y89 HydrophobicContact CE1-CE2 3.41Å; F64-Y89 VanDerWaalsContact CE1-CE2 3.41Å; F64-Y89 HydrophobicContact CE1-CG 4.31Å; F64-Y89 HydrophobicContact CG-CD2 4.28Å; F64-Y89 HydrophobicContact CZ-CD2 4.42Å; F64-Y89 HydrophobicContact CZ-CE2 4.19Å
65	L	98.3	Very high	96.4	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	21%	0.209	C	C	.	.			trans	-124.8	6.9	-176.3	-66.6	160.9	0	0	0	112	C44 I52 L63 N68 I70 I88 Y89 L90 N93	C44-L65 HydrophobicContact CB-CD2 3.52Å; C44-L65 HydrophobicContact CB-CG 4.47Å; I52-L65 HydrophobicContact CD1-CD1 3.82Å; I52-L65 HydrophobicContact CG1-CD1 4.14Å; I52-L65 HydrophobicContact CG1-CD2 4.18Å; I52-L65 HydrophobicContact CG2-CD1 4.37Å; I52-L65 HydrophobicContact CG2-CD2 4.06Å; L63-L65 HydrophobicContact CB-CD1 4.06Å; L63-L65 HydrophobicContact CB-CG 4.42Å; L63-L65 HydrophobicContact CD1-CD1 4.36Å; L65-N68 PolarHBondContact O-ND2 2.84Å; L65-I70 HydrophobicContact CB-CD1 4.14Å; L65-I70 HydrophobicContact CD2-CD1 4.28Å; L65-I88 HydrophobicContact CD1-CG2 4.39Å; L65-Y89 CarbonylContact C-O 3.18Å; L65-Y89 VanDerWaalsContact C-O 3.27Å; L65-Y89 VanDerWaalsContact CA-O 3.25Å; L65-Y89 WeakPolarHBondContact CA-O 3.36Å; L65-Y89 WeakPolarHBondContact CB-O 3.43Å; L65-Y89 PolarHBondContact N-O 3.48Å; L65-L90 HydrophobicContact CB-CD2 3.64Å; L65-L90 HydrophobicContact CB-CG 4.14Å; L65-L90 HydrophobicContact CD1-CD2 4.07Å; L65-L90 HydrophobicContact CD1-CG 4.28Å; L65-L90 HydrophobicContact CG-CD2 4.48Å; L65-N93 PolarHBondContact O-ND2 3.21Å
66	Q	98.3	Very high	96.7	Very high	15 Å²	15	35 Å²	35	7%	0.07	20%	0.195	C	C	.	.			trans	-65.6	167.1	-178.3	70.5	-90.7	19.9	0	0	113.9	N45 D46 F64 N68 Y89 Y91	N45-Q66 WeakPolarHBondContact CA-O 3.4Å; N45-Q66 VanDerWaalsContact CB-CD 3.42Å; N45-Q66 HydrophobicContact CB-CG 3.8Å; N45-Q66 WeakPolarHBondContact CB-O 3.35Å; D46-Q66 PolarHBondContact N-O 3.11Å; D46-Q66 VanDerWaalsContact N-O 3.1Å; F64-Q66 VanDerWaalsContact CA-OE1 3.28Å; Q66-N68 PolarHBondContact O-N 3.24Å; Q66-N68 PolarHBondContact O-ND2 2.71Å; Q66-N68 VanDerWaalsContact O-ND2 3.17Å; Q66-Y89 PolarHBondContact N-O 3.14Å; Q66-Y91 CarbonylContact C-O 3.58Å; Q66-Y91 WeakPolarHBondContact CA-O 3.02Å; Q66-Y91 HydrophobicContact CB-CD1 3.72Å; Q66-Y91 HydrophobicContact CB-CD2 3.69Å; Q66-Y91 HydrophobicContact CB-CE1 3.59Å; Q66-Y91 HydrophobicContact CB-CE2 3.55Å; Q66-Y91 HydrophobicContact CB-CG 3.77Å; Q66-Y91 VanDerWaalsContact CB-O 3.29Å; Q66-Y91 WeakPolarHBondContact CB-O 3.04Å; Q66-Y91 HydrophobicContact CG-CD1 4.46Å; Q66-Y91 HydrophobicContact CG-CD2 4.36Å; Q66-Y91 HydrophobicContact CG-CE1 3.82Å; Q66-Y91 HydrophobicContact CG-CE2 3.71Å; Q66-Y91 VanDerWaalsContact CG-CZ 3.4Å; Q66-Y91 WeakPolarHBondContact CG-OH 3.32Å
67	N	98.3	Very high	96.7	Very high	52 Å²	52	36.4 Å²	36.4	28%	0.278	21%	0.207	S	C	.	.	S	Bend	trans	54.6	53.1	174.8	-57.9	-6.1	0	0	0	111.4	D46 Y91 H92	D46-N67 VanDerWaalsContact CA-O 3.28Å; D46-N67 WeakPolarHBondContact CA-O 3.15Å; D46-N67 HydrophobicContact CB-CB 4.47Å; D46-N67 PolarHBondContact N-O 3.1Å; D46-N67 WeakPolarHBondContact OD1-CB 3.48Å; D46-N67 PolarHBondContact OD1-ND2 3.35Å; N67-Y91 PolarHBondContact N-O 3.22Å; N67-Y91 VanDerWaalsContact N-O 3.12Å; N67-H92 VanDerWaalsContact CA-O 3.28Å; N67-H92 WeakPolarHBondContact CA-O 3.41Å; N67-H92 PolarHBondContact N-O 2.84Å; N67-H92 VanDerWaalsContact N-O 3.16Å; N67-H92 WeakPolarHBondContact OD1-CB 3.14Å
68	N	98.3	Very high	96.7	Very high	8 Å²	8	41.5 Å²	41.5	4%	0.043	23%	0.231	C	C	.	.	S	Bend	trans	-137.7	-170.9	-178.6	-81.3	-55.8	0	0	0	109.2	C44 R47 D48 L49 L65 Q66 I70 H92 N93	C44-N68 PolarHBondContact O-ND2 2.98Å; R47-N68 WeakPolarHBondContact CA-OD1 3.48Å; R47-N68 PolarHBondContact N-OD1 3.46Å; D48-N68 PolarHBondContact N-OD1 2.78Å; D48-N68 VanDerWaalsContact N-OD1 3.13Å; L49-N68 HydrophobicContact CB-CB 4.25Å; L49-N68 PolarHBondContact N-OD1 3.38Å; L65-N68 PolarHBondContact O-ND2 2.84Å; Q66-N68 PolarHBondContact O-N 3.24Å; Q66-N68 PolarHBondContact O-ND2 2.71Å; Q66-N68 VanDerWaalsContact O-ND2 3.17Å; N68-I70 HydrophobicContact CB-CD1 4.09Å; N68-I70 HydrophobicContact CB-CG1 3.99Å; N68-H92 PolarHBondContact N-O 2.77Å; N68-H92 VanDerWaalsContact N-O 3.11Å; N68-N93 WeakPolarHBondContact CB-OD1 3.2Å; N68-N93 WeakPolarHBondContact O-CA 3.49Å; N68-N93 PolarHBondContact O-OD1 2.04Å
69	Q	98.1	Very high	96.8	Very high	93 Å²	93	34.3 Å²	34.3	44%	0.435	20%	0.198	S	C	.	.			trans	-118.5	29.5	-178.6	-56	179.2	32.8	0	0	110.3	D48 L49 T50 N71	D48-Q69 PolarHBondContact OD1-NE2 3.29Å; L49-Q69 CarbonylContact O-C 3.31Å; L49-Q69 WeakPolarHBondContact O-CA 3.23Å; L49-Q69 PolarHBondContact O-N 3.33Å; T50-Q69 WeakPolarHBondContact CA-O 3.28Å; T50-Q69 HydrophobicContact CG2-CB 4.22Å; Q69-N71 PolarHBondContact O-N 2.81Å
70	I	98.3	Very high	96.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.203	C	C	.	.			trans	-70.6	126.8	-174.8	-57.6	166.3	0	0	0	108.6	L49 I52 L65 N68 I75 L90 N93 S94 L95	L49-I70 HydrophobicContact CB-CG1 4.32Å; L49-I70 WeakPolarHBondContact O-CG1 3.46Å; L49-I70 PolarHBondContact O-N 3.27Å; L49-I70 VanDerWaalsContact O-N 3.12Å; I52-I70 HydrophobicContact CG1-CD1 4.01Å; I52-I70 HydrophobicContact CG1-CG2 4.23Å; L65-I70 HydrophobicContact CB-CD1 4.14Å; L65-I70 HydrophobicContact CD2-CD1 4.28Å; N68-I70 HydrophobicContact CB-CD1 4.09Å; N68-I70 HydrophobicContact CB-CG1 3.99Å; I70-I75 HydrophobicContact CG2-CG1 4.32Å; I70-L90 HydrophobicContact CD1-CD2 4.08Å; I70-N93 VanDerWaalsContact CB-OD1 3.24Å; I70-N93 WeakPolarHBondContact CB-OD1 3.14Å; I70-N93 WeakPolarHBondContact CG1-OD1 3.36Å; I70-N93 PolarHBondContact N-OD1 2.77Å; I70-S94 CarbonylContact O-C 3.56Å; I70-S94 WeakPolarHBondContact O-CA 3.28Å; I70-S94 PolarHBondContact O-N 2.76Å; I70-L95 PolarHBondContact O-N 3.04Å
71	N	97.6	Very high	96.8	Very high	63 Å²	63	40.8 Å²	40.8	34%	0.337	23%	0.228	S	C	.	.			trans	-107.2	173	171.2	63.4	60.1	0	0	0	110.7	Q69 A73 G74 S94	Q69-N71 PolarHBondContact O-N 2.81Å; N71-A73 VanDerWaalsContact C-N 3.3Å; N71-A73 PolarHBondContact O-N 2.72Å; N71-A73 WeakPolarHBondContact OD1-CB 3.25Å; N71-A73 PolarHBondContact OD1-N 3.22Å; N71-A73 VanDerWaalsContact OD1-N 3.07Å; N71-G74 WeakPolarHBondContact O-CA 3.18Å; N71-G74 PolarHBondContact O-N 3.16Å; N71-G74 PolarHBondContact OD1-N 2.75Å; N71-S94 WeakPolarHBondContact CA-O 3.29Å
72	N	97.4	Very high	96.7	Very high	31 Å²	31	39.2 Å²	39.2	17%	0.166	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-60.2	-34.3	-175.6	-73.1	56.5	0	0	0	113.9	G74 I75 L95 D96 E97	N72-G74 PolarHBondContact O-N 2.73Å; N72-I75 PolarHBondContact O-N 2.81Å; N72-L95 VanDerWaalsContact OD1-CA 3.23Å; N72-L95 WeakPolarHBondContact OD1-CA 3.13Å; N72-L95 WeakPolarHBondContact OD1-CB 3.33Å; N72-L95 WeakPolarHBondContact OD1-CD2 3.41Å; N72-D96 PolarHBondContact OD1-N 2.86Å; N72-D96 PolarHBondContact OD1-OD1 3.27Å; N72-D96 VanDerWaalsContact OD1-OD1 3.06Å; N72-E97 VanDerWaalsContact ND2-C 3.27Å; N72-E97 PolarHBondContact ND2-O 3.38Å
73	A	96.6	Very high	96.6	Very high	99 Å²	99	44.4 Å²	44.4	82%	0.818	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-74.3	-15.2	174.2	0	0	0	0	0	113.1	N71 I75	N71-A73 VanDerWaalsContact C-N 3.3Å; N71-A73 PolarHBondContact O-N 2.72Å; N71-A73 WeakPolarHBondContact OD1-CB 3.25Å; N71-A73 PolarHBondContact OD1-N 3.22Å; N71-A73 VanDerWaalsContact OD1-N 3.07Å; A73-I75 VanDerWaalsContact C-N 3.26Å; A73-I75 PolarHBondContact O-N 2.82Å
74	G	95.8	Very high	96.5	Very high	7 Å²	7	51.4 Å²	51.4	7%	0.072	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-78.5	0.5	175.2	0	0	0	0	0	114.8	S51 I52 N71 N72 P76	S51-G74 CarbonylContact C-O 3.48Å; S51-G74 VanDerWaalsContact CA-O 3.29Å; S51-G74 WeakPolarHBondContact CA-O 3.26Å; S51-G74 WeakPolarHBondContact CB-O 3.41Å; I52-G74 PolarHBondContact N-O 3.45Å; N71-G74 WeakPolarHBondContact O-CA 3.18Å; N71-G74 PolarHBondContact O-N 3.16Å; N71-G74 PolarHBondContact OD1-N 2.75Å; N72-G74 PolarHBondContact O-N 2.73Å; G74-P76 WeakPolarHBondContact O-CD 3.05Å
75	I	97.2	Very high	96.5	Very high	9 Å²	9	49.7 Å²	49.7	5%	0.046	26%	0.263	C	S	.	.	S	Bend	trans	-99.2	108.1	-179.5	-55.9	-177.8	0	0	0	109.9	I52 I70 N72 A73 L79 L95 P99 T100 N101	I52-I75 HydrophobicContact CD1-CB 4.36Å; I52-I75 HydrophobicContact CD1-CG1 3.97Å; I52-I75 HydrophobicContact CD1-CG2 4.1Å; I70-I75 HydrophobicContact CG2-CG1 4.32Å; N72-I75 PolarHBondContact O-N 2.81Å; A73-I75 VanDerWaalsContact C-N 3.26Å; A73-I75 PolarHBondContact O-N 2.82Å; I75-L79 HydrophobicContact CG2-CD2 3.83Å; I75-L95 HydrophobicContact CD1-CD2 4.14Å; I75-P99 HydrophobicContact CD1-CB 3.34Å; I75-T100 VanDerWaalsContact CG2-O 3.28Å; I75-T100 WeakPolarHBondContact CG2-O 3.39Å; I75-N101 HydrophobicContact CG2-CB 4.37Å
76	P	96.1	Very high	96.5	Very high	28 Å²	28	53.6 Å²	53.6	18%	0.182	28%	0.281	C	S	.	.			trans	-75.1	146.7	-172.5	30.6	-35.1	0	0	0	112.4	I52 G74 E78 L79	I52-P76 HydrophobicContact CB-CG 4.32Å; G74-P76 WeakPolarHBondContact O-CD 3.05Å; P76-E78 WeakPolarHBondContact CB-OE2 3.36Å; P76-E78 PolarHBondContact O-N 2.87Å; P76-E78 VanDerWaalsContact O-N 3.14Å; P76-L79 HydrophobicContact CG-CB 4.44Å; P76-L79 VanDerWaalsContact O-CB 3.26Å; P76-L79 WeakPolarHBondContact O-CB 3.49Å; P76-L79 PolarHBondContact O-N 3.11Å; P76-L79 VanDerWaalsContact O-N 3.1Å
77	S	94.6	Very high	96.5	Very high	53 Å²	53	56.2 Å²	56.2	37%	0.371	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-19	-174.5	83.1	0	0	0	0	114.2	L79 K80	S77-L79 VanDerWaalsContact C-N 3.31Å; S77-K80 WeakPolarHBondContact O-CD 3.19Å; S77-K80 WeakPolarHBondContact O-CE 3.33Å; S77-K80 VanDerWaalsContact O-CG 3.26Å; S77-K80 WeakPolarHBondContact O-CG 3.29Å
78	E	92.5	Very high	96.5	Very high	110 Å²	110	53.7 Å²	53.7	51%	0.514	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-23.1	177.7	-64.1	71.4	-161.1	0	0	112.1	P76 K80 N81	P76-E78 WeakPolarHBondContact CB-OE2 3.36Å; P76-E78 PolarHBondContact O-N 2.87Å; P76-E78 VanDerWaalsContact O-N 3.14Å; E78-K80 PolarHBondContact O-N 2.91Å; E78-N81 VanDerWaalsContact O-CB 3.3Å; E78-N81 WeakPolarHBondContact O-CB 3.33Å; E78-N81 PolarHBondContact O-N 3.12Å
79	L	95.4	Very high	96.5	Very high	6 Å²	6	55.2 Å²	55.2	3%	0.031	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-59.3	-35	-176.6	-169.1	74.7	0	0	0	112	I52 I56 L63 I75 P76 S77 N81 L82 L102 P103	I52-L79 HydrophobicContact CD1-CD2 3.81Å; I52-L79 HydrophobicContact CG2-CD1 4.3Å; I56-L79 HydrophobicContact CD1-CD1 3.89Å; L63-L79 HydrophobicContact CD1-CD1 4.05Å; I75-L79 HydrophobicContact CG2-CD2 3.83Å; P76-L79 HydrophobicContact CG-CB 4.44Å; P76-L79 VanDerWaalsContact O-CB 3.26Å; P76-L79 WeakPolarHBondContact O-CB 3.49Å; P76-L79 PolarHBondContact O-N 3.11Å; P76-L79 VanDerWaalsContact O-N 3.1Å; S77-L79 VanDerWaalsContact C-N 3.31Å; L79-N81 PolarHBondContact O-N 3.36Å; L79-L82 HydrophobicContact CD1-CD1 3.69Å; L79-L82 WeakPolarHBondContact O-CB 3.21Å; L79-L82 WeakPolarHBondContact O-CG 3.15Å; L79-L82 PolarHBondContact O-N 2.85Å; L79-L82 VanDerWaalsContact O-N 3.08Å; L79-L102 HydrophobicContact CD2-CD2 4.26Å; L79-P103 HydrophobicContact CG-CG 4.19Å; L79-P103 WeakPolarHBondContact O-CG 3.29Å
80	K	94.7	Very high	96.6	Very high	94 Å²	94	50.8 Å²	50.8	41%	0.409	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-56.6	-23	176.4	78.3	-162.7	171.4	-163.1	0	114.2	S77 E78 L82 N101	S77-K80 WeakPolarHBondContact O-CD 3.19Å; S77-K80 WeakPolarHBondContact O-CE 3.33Å; S77-K80 VanDerWaalsContact O-CG 3.26Å; S77-K80 WeakPolarHBondContact O-CG 3.29Å; E78-K80 PolarHBondContact O-N 2.91Å; K80-L82 VanDerWaalsContact C-N 3.3Å; K80-L82 PolarHBondContact O-N 3.27Å; K80-N101 PolarHBondContact N-O 3.42Å
81	N	93.7	Very high	96.6	Very high	100 Å²	100	53.7 Å²	53.7	54%	0.535	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-81	-7.2	-177.9	-58.9	-26	0	0	0	112.9	E78 L79 L83	E78-N81 VanDerWaalsContact O-CB 3.3Å; E78-N81 WeakPolarHBondContact O-CB 3.33Å; E78-N81 PolarHBondContact O-N 3.12Å; L79-N81 PolarHBondContact O-N 3.36Å; N81-L83 VanDerWaalsContact C-N 3.26Å; N81-L83 WeakPolarHBondContact O-CG 3.43Å; N81-L83 PolarHBondContact O-N 3.35Å
82	L	95.3	Very high	96.6	Very high	14 Å²	14	55 Å²	55	7%	0.073	28%	0.278	C	S	.	.			trans	-77.3	71.6	179.8	-61.4	-179	0	0	0	111.8	I56 L63 L79 K80 R84 V85 P103	I56-L82 HydrophobicContact CB-CD1 4.03Å; I56-L82 HydrophobicContact CD1-CD1 4.43Å; I56-L82 HydrophobicContact CG2-CD1 3.57Å; I56-L82 HydrophobicContact CG2-CD2 4.36Å; L63-L82 HydrophobicContact CD1-CD1 4.39Å; L79-L82 HydrophobicContact CD1-CD1 3.69Å; L79-L82 WeakPolarHBondContact O-CB 3.21Å; L79-L82 WeakPolarHBondContact O-CG 3.15Å; L79-L82 PolarHBondContact O-N 2.85Å; L79-L82 VanDerWaalsContact O-N 3.08Å; K80-L82 VanDerWaalsContact C-N 3.3Å; K80-L82 PolarHBondContact O-N 3.27Å; L82-R84 PolarHBondContact O-N 3.24Å; L82-V85 HydrophobicContact CB-CB 4.48Å; L82-V85 HydrophobicContact CB-CG2 3.73Å; L82-V85 HydrophobicContact CD1-CG2 4.11Å; L82-V85 PolarHBondContact O-N 2.96Å; L82-V85 VanDerWaalsContact O-N 3.09Å; L82-P103 HydrophobicContact CB-CB 4.3Å; L82-P103 HydrophobicContact CB-CG 4.25Å; L82-P103 WeakPolarHBondContact O-CB 3.32Å
83	L	95.4	Very high	96.7	Very high	110 Å²	110	54 Å²	54	58%	0.576	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-8.5	-168.7	-51.2	-174.2	0	0	0	115.9	N81 Y105	N81-L83 VanDerWaalsContact C-N 3.26Å; N81-L83 WeakPolarHBondContact O-CG 3.43Å; N81-L83 PolarHBondContact O-N 3.35Å; L83-Y105 HydrophobicContact CB-CD2 4.17Å; L83-Y105 HydrophobicContact CB-CE2 4.28Å; L83-Y105 HydrophobicContact CD2-CD2 4.4Å; L83-Y105 HydrophobicContact CD2-CE2 4.16Å; L83-Y105 WeakPolarHBondContact O-CD2 3.46Å
84	R	96.6	Very high	96.7	Very high	149 Å²	149	52 Å²	52	56%	0.562	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-7	179.5	-68.5	-170.1	-179	103.3	-2.2	114.6	E58 A60 T61 L82 E86	E58-R84 PolarHBondContact O-NH1 3.29Å; A60-R84 CarbonylContact O-C 3.56Å; A60-R84 VanDerWaalsContact O-C 3.26Å; A60-R84 WeakPolarHBondContact O-CB 3.31Å; T61-R84 WeakPolarHBondContact CA-O 3.37Å; L82-R84 PolarHBondContact O-N 3.24Å; R84-E86 PolarHBondContact O-N 3.12Å
85	V	98	Very high	96.8	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.248	C	C	.	.			trans	-73.4	114.7	-179.6	175.8	0	0	0	0	109.2	A60 L63 L82 I88 P103 Y105 V106	A60-V85 HydrophobicContact CB-CG2 3.96Å; A60-V85 WeakPolarHBondContact O-CG2 3.37Å; A60-V85 PolarHBondContact O-N 3.44Å; L63-V85 HydrophobicContact CD1-CG1 4.01Å; L63-V85 HydrophobicContact CD1-CG2 4.2Å; L63-V85 HydrophobicContact CD2-CG2 4.26Å; L63-V85 HydrophobicContact CG-CG1 3.88Å; L63-V85 HydrophobicContact CG-CG2 4.09Å; L82-V85 HydrophobicContact CB-CB 4.48Å; L82-V85 HydrophobicContact CB-CG2 3.73Å; L82-V85 HydrophobicContact CD1-CG2 4.11Å; L82-V85 PolarHBondContact O-N 2.96Å; L82-V85 VanDerWaalsContact O-N 3.09Å; V85-I88 HydrophobicContact CG1-CD1 3.94Å; V85-I88 HydrophobicContact CG1-CG1 3.62Å; V85-P103 HydrophobicContact CB-CB 4.01Å; V85-P103 HydrophobicContact CB-CG 3.95Å; V85-P103 HydrophobicContact CG1-CG 4.09Å; V85-P103 HydrophobicContact CG2-CG 4.42Å; V85-Y105 CarbonylContact O-C 3.58Å; V85-V106 HydrophobicContact CG1-CG2 4.16Å; V85-V106 PolarHBondContact O-N 3.46Å
86	E	98	Very high	96.8	Very high	84 Å²	84	54.8 Å²	54.8	39%	0.393	27%	0.265	S	S	.	.			trans	-99	-25.1	176.9	-62.7	-169.2	129.9	0	0	111.8	T61 R84 K107 E108	T61-E86 PolarHBondContact O-N 2.85Å; R84-E86 PolarHBondContact O-N 3.12Å; E86-K107 HydrophobicContact CB-CD 4.43Å; E86-K107 HydrophobicContact CG-CD 4.48Å; E86-K107 PolarHBondContact O-N 3.11Å; E86-K107 WeakPolarHBondContact OE1-CE 3.43Å; E86-K107 IonicContact OE1-NZ 3.84Å; E86-K107 PolarHBondContact OE1-NZ 3.41Å; E86-E108 PolarHBondContact O-N 3.33Å
87	R	98.7	Very high	96.9	Very high	70 Å²	70	58.3 Å²	58.3	26%	0.264	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	132.1	-170	-54.7	-173.8	-68.9	162.8	3.2	112.8	T61 T62 L63 E108	T61-R87 PolarHBondContact O-N 2.85Å; T62-R87 WeakPolarHBondContact CA-O 3.46Å; T62-R87 HydrophobicContact CG2-CB 4.22Å; T62-R87 PolarHBondContact OG1-NE 3.49Å; T62-R87 PolarHBondContact OG1-NH2 3.28Å; L63-R87 PolarHBondContact N-O 3.35Å; R87-E108 WeakPolarHBondContact CA-O 3.27Å; R87-E108 HydrophobicContact CB-CB 4.3Å; R87-E108 WeakPolarHBondContact CD-OE1 3.34Å; R87-E108 WeakPolarHBondContact CD-OE2 3.26Å; R87-E108 HydrophobicContact CG-CB 3.93Å; R87-E108 HydrophobicContact CG-CG 4.08Å
88	I	98.6	Very high	97.1	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	124.2	-178.8	-57.9	-175.8	0	0	0	110.9	L63 L65 V85 L90 L102 P103 V106 E108 L109 H110	L63-I88 HydrophobicContact CB-CG1 4.33Å; L63-I88 HydrophobicContact CB-CG2 4.5Å; L63-I88 HydrophobicContact CD1-CD1 4.17Å; L63-I88 HydrophobicContact CD1-CG1 4.23Å; L63-I88 HydrophobicContact CG-CG1 4.46Å; L65-I88 HydrophobicContact CD1-CG2 4.39Å; V85-I88 HydrophobicContact CG1-CD1 3.94Å; V85-I88 HydrophobicContact CG1-CG1 3.62Å; I88-L90 HydrophobicContact CG2-CB 4.44Å; I88-L90 HydrophobicContact CG2-CD1 3.68Å; I88-L90 HydrophobicContact CG2-CG 3.76Å; I88-L102 HydrophobicContact CD1-CD2 4.2Å; I88-P103 HydrophobicContact CD1-CG 3.91Å; I88-V106 HydrophobicContact CD1-CG2 3.55Å; I88-V106 HydrophobicContact CG1-CG2 3.96Å; I88-E108 PolarHBondContact N-O 3.47Å; I88-L109 HydrophobicContact CB-CD1 3.98Å; I88-L109 HydrophobicContact CG2-CD1 4.19Å; I88-H110 PolarHBondContact O-N 3.46Å
89	Y	98.8	Very high	97.3	Very high	40 Å²	40	50.8 Å²	50.8	16%	0.157	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	103.3	172.1	-59	-81.7	0	0	0	109.8	T62 L63 F64 L65 Q66 Y91 H110	T62-Y89 HydrophobicContact CG2-CD2 4.27Å; T62-Y89 HydrophobicContact CG2-CE2 3.8Å; L63-Y89 PolarHBondContact O-N 3.03Å; F64-Y89 AromaticContact CD1-CD2 3.32Å; F64-Y89 HydrophobicContact CD1-CD2 3.32Å; F64-Y89 AromaticContact CD1-CE2 3.87Å; F64-Y89 HydrophobicContact CD1-CE2 3.87Å; F64-Y89 HydrophobicContact CD1-CG 4Å; F64-Y89 AromaticContact CE1-CD2 3.41Å; F64-Y89 HydrophobicContact CE1-CD2 3.41Å; F64-Y89 VanDerWaalsContact CE1-CD2 3.41Å; F64-Y89 AromaticContact CE1-CE2 3.41Å; F64-Y89 HydrophobicContact CE1-CE2 3.41Å; F64-Y89 VanDerWaalsContact CE1-CE2 3.41Å; F64-Y89 HydrophobicContact CE1-CG 4.31Å; F64-Y89 HydrophobicContact CG-CD2 4.28Å; F64-Y89 HydrophobicContact CZ-CD2 4.42Å; F64-Y89 HydrophobicContact CZ-CE2 4.19Å; L65-Y89 CarbonylContact C-O 3.18Å; L65-Y89 VanDerWaalsContact C-O 3.27Å; L65-Y89 VanDerWaalsContact CA-O 3.25Å; L65-Y89 WeakPolarHBondContact CA-O 3.36Å; L65-Y89 WeakPolarHBondContact CB-O 3.43Å; L65-Y89 PolarHBondContact N-O 3.48Å; Q66-Y89 PolarHBondContact N-O 3.14Å; Y89-Y91 HydrophobicContact CD1-CD1 4.19Å; Y89-Y91 AromaticContact CD1-CE1 3.84Å; Y89-Y91 HydrophobicContact CD1-CE1 3.84Å; Y89-Y91 HydrophobicContact CG-CE1 4.24Å; Y89-H110 HydrophobicContact CD1-CB 4.05Å; Y89-H110 AromaticContact CD1-CD2 3.28Å; Y89-H110 WeakPolarHBondContact CD1-CD2 3.49Å; Y89-H110 AromaticContact CD1-CG 3.74Å; Y89-H110 AromaticContact CD1-NE2 3.89Å; Y89-H110 AromaticContact CE1-CD2 3.15Å; Y89-H110 WeakPolarHBondContact CE1-CD2 3.43Å; Y89-H110 AromaticContact CE1-CG 3.92Å; Y89-H110 AromaticContact CE1-NE2 3.25Å; Y89-H110 VanDerWaalsContact CE1-NE2 3.25Å; Y89-H110 WeakPolarHBondContact CE1-NE2 3.48Å; Y89-H110 AromaticContact CZ-CD2 4Å; Y89-H110 AromaticContact CZ-NE2 3.97Å
90	L	98.5	Very high	97.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.253	C	S	.	.			trans	-118.8	16.5	178.1	-89	167.5	0	0	0	112	L65 I70 I88 N93 L102 H110 L111 N114	L65-L90 HydrophobicContact CB-CD2 3.64Å; L65-L90 HydrophobicContact CB-CG 4.14Å; L65-L90 HydrophobicContact CD1-CD2 4.07Å; L65-L90 HydrophobicContact CD1-CG 4.28Å; L65-L90 HydrophobicContact CG-CD2 4.48Å; I70-L90 HydrophobicContact CD1-CD2 4.08Å; I88-L90 HydrophobicContact CG2-CB 4.44Å; I88-L90 HydrophobicContact CG2-CD1 3.68Å; I88-L90 HydrophobicContact CG2-CG 3.76Å; L90-N93 WeakPolarHBondContact O-CB 3.46Å; L90-N93 PolarHBondContact O-ND2 2.83Å; L90-N93 VanDerWaalsContact O-ND2 3.07Å; L90-L102 HydrophobicContact CD1-CD2 4.32Å; L90-H110 CarbonylContact C-O 3.55Å; L90-H110 WeakPolarHBondContact CA-O 3.02Å; L90-H110 PolarHBondContact N-O 2.86Å; L90-L111 HydrophobicContact CB-CD2 3.69Å; L90-L111 HydrophobicContact CD1-CD2 4.16Å; L90-N114 PolarHBondContact O-ND2 2.66Å
91	Y	98.5	Very high	97.4	Very high	60 Å²	60	50.6 Å²	50.6	24%	0.235	24%	0.244	C	C	.	.			trans	-67	157.7	178.9	65.9	-96.5	0	0	0	112.8	Q66 N67 Y89 N93 H110 Q112	Q66-Y91 CarbonylContact C-O 3.58Å; Q66-Y91 WeakPolarHBondContact CA-O 3.02Å; Q66-Y91 HydrophobicContact CB-CD1 3.72Å; Q66-Y91 HydrophobicContact CB-CD2 3.69Å; Q66-Y91 HydrophobicContact CB-CE1 3.59Å; Q66-Y91 HydrophobicContact CB-CE2 3.55Å; Q66-Y91 HydrophobicContact CB-CG 3.77Å; Q66-Y91 VanDerWaalsContact CB-O 3.29Å; Q66-Y91 WeakPolarHBondContact CB-O 3.04Å; Q66-Y91 HydrophobicContact CG-CD1 4.46Å; Q66-Y91 HydrophobicContact CG-CD2 4.36Å; Q66-Y91 HydrophobicContact CG-CE1 3.82Å; Q66-Y91 HydrophobicContact CG-CE2 3.71Å; Q66-Y91 VanDerWaalsContact CG-CZ 3.4Å; Q66-Y91 WeakPolarHBondContact CG-OH 3.32Å; N67-Y91 PolarHBondContact N-O 3.22Å; N67-Y91 VanDerWaalsContact N-O 3.12Å; Y89-Y91 HydrophobicContact CD1-CD1 4.19Å; Y89-Y91 AromaticContact CD1-CE1 3.84Å; Y89-Y91 HydrophobicContact CD1-CE1 3.84Å; Y89-Y91 HydrophobicContact CG-CE1 4.24Å; Y91-N93 PolarHBondContact O-ND2 2.92Å; Y91-H110 HydrophobicContact CD1-CB 4.23Å; Y91-H110 PolarHBondContact N-O 3.28Å; Y91-Q112 CarbonylContact C-O 3.6Å; Y91-Q112 WeakPolarHBondContact CA-O 3.45Å; Y91-Q112 VanDerWaalsContact CB-CD 3.46Å; Y91-Q112 WeakPolarHBondContact CB-O 3.38Å
92	H	98.4	Very high	97.6	Very high	92 Å²	92	46 Å²	46	43%	0.426	22%	0.219	S	C	.	.	S	Bend	trans	53.1	64.5	-177.5	-155.5	95.1	0	0	0	112	N67 N68 Q112 E113	N67-H92 VanDerWaalsContact CA-O 3.28Å; N67-H92 WeakPolarHBondContact CA-O 3.41Å; N67-H92 PolarHBondContact N-O 2.84Å; N67-H92 VanDerWaalsContact N-O 3.16Å; N67-H92 WeakPolarHBondContact OD1-CB 3.14Å; N68-H92 PolarHBondContact N-O 2.77Å; N68-H92 VanDerWaalsContact N-O 3.11Å; H92-Q112 PolarHBondContact N-O 2.85Å; H92-E113 WeakPolarHBondContact CA-O 3.44Å; H92-E113 HydrophobicContact CB-CB 4.25Å; H92-E113 IonicContact CE1-OE2 2.73Å; H92-E113 IonicContact CG-OE2 3.67Å; H92-E113 PolarHBondContact N-O 3.02Å; H92-E113 IonicContact ND1-OE2 2.65Å; H92-E113 PolarHBondContact ND1-OE2 2.8Å
93	N	98.5	Very high	97.7	Very high	9 Å²	9	45.4 Å²	45.4	5%	0.048	22%	0.216	C	C	.	.	S	Bend	trans	-138	-170.8	-178.2	-92.7	-76	0	0	0	111	L65 N68 I70 L90 Y91 L95 E113 N114	L65-N93 PolarHBondContact O-ND2 3.21Å; N68-N93 WeakPolarHBondContact CB-OD1 3.2Å; N68-N93 WeakPolarHBondContact O-CA 3.49Å; N68-N93 PolarHBondContact O-OD1 2.04Å; I70-N93 VanDerWaalsContact CB-OD1 3.24Å; I70-N93 WeakPolarHBondContact CB-OD1 3.14Å; I70-N93 WeakPolarHBondContact CG1-OD1 3.36Å; I70-N93 PolarHBondContact N-OD1 2.77Å; L90-N93 WeakPolarHBondContact O-CB 3.46Å; L90-N93 PolarHBondContact O-ND2 2.83Å; L90-N93 VanDerWaalsContact O-ND2 3.07Å; Y91-N93 PolarHBondContact O-ND2 2.92Å; N93-L95 HydrophobicContact CB-CG 4.5Å; N93-E113 PolarHBondContact N-O 3.11Å; N93-N114 VanDerWaalsContact CA-OD1 3.31Å; N93-N114 WeakPolarHBondContact CA-OD1 3.03Å; N93-N114 WeakPolarHBondContact CB-OD1 3.49Å; N93-N114 PolarHBondContact N-OD1 3.29Å; N93-N114 PolarHBondContact O-OD1 2.7Å
94	S	98.1	Very high	97.7	Very high	56 Å²	56	44.8 Å²	44.8	39%	0.392	21%	0.209	S	C	.	.			trans	-113.6	35.2	-177.2	-61.8	0	0	0	0	112.6	I70 N71 N114	I70-S94 CarbonylContact O-C 3.56Å; I70-S94 WeakPolarHBondContact O-CA 3.28Å; I70-S94 PolarHBondContact O-N 2.76Å; N71-S94 WeakPolarHBondContact CA-O 3.29Å; S94-N114 PolarHBondContact N-OD1 3.17Å
95	L	98.1	Very high	97.7	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.199	C	C	.	.			trans	-74.9	135.3	175.8	-56.5	174.5	0	0	0	110.7	I70 N72 I75 N93 P99 L111 N114 N115 I116	I70-L95 PolarHBondContact O-N 3.04Å; N72-L95 VanDerWaalsContact OD1-CA 3.23Å; N72-L95 WeakPolarHBondContact OD1-CA 3.13Å; N72-L95 WeakPolarHBondContact OD1-CB 3.33Å; N72-L95 WeakPolarHBondContact OD1-CD2 3.41Å; I75-L95 HydrophobicContact CD1-CD2 4.14Å; N93-L95 HydrophobicContact CB-CG 4.5Å; L95-P99 HydrophobicContact CD1-CG 4.48Å; L95-L111 HydrophobicContact CD1-CD2 3.67Å; L95-N114 HydrophobicContact CB-CB 4.22Å; L95-N114 WeakPolarHBondContact CB-OD1 3.47Å; L95-N114 WeakPolarHBondContact CG-OD1 3.4Å; L95-N114 PolarHBondContact N-OD1 3.06Å; L95-N114 VanDerWaalsContact N-OD1 3.08Å; L95-N115 CarbonylContact O-C 3.27Å; L95-N115 WeakPolarHBondContact O-CA 3.25Å; L95-N115 WeakPolarHBondContact O-CB 3.18Å; L95-N115 PolarHBondContact O-N 3.13Å; L95-I116 HydrophobicContact CB-CD1 4.33Å; L95-I116 HydrophobicContact CB-CG1 3.96Å; L95-I116 HydrophobicContact CD1-CD1 4.48Å; L95-I116 PolarHBondContact O-N 2.93Å
96	D	96.9	Very high	97.7	Very high	76 Å²	76	42 Å²	42	41%	0.406	20%	0.199	S	C	.	.			trans	-112.9	-21	-179.3	59.4	-18.6	0	0	0	113.8	N72 I116 R117	N72-D96 PolarHBondContact OD1-N 2.86Å; N72-D96 PolarHBondContact OD1-OD1 3.27Å; N72-D96 VanDerWaalsContact OD1-OD1 3.06Å; D96-I116 CarbonylContact O-C 3.18Å; D96-I116 WeakPolarHBondContact O-CA 3.48Å; D96-R117 PolarHBondContact O-N 3Å
97	E	97.6	Very high	97.7	Very high	101 Å²	101	41.3 Å²	41.3	47%	0.472	19%	0.194	S	C	.	.	B	Isolated β-bridge	trans	-128.4	169.7	172.7	-46.8	-154.7	115.6	0	0	110.7	N72 T118	N72-E97 VanDerWaalsContact ND2-C 3.27Å; N72-E97 PolarHBondContact ND2-O 3.38Å; E97-T118 VanDerWaalsContact CB-OG1 3.25Å; E97-T118 WeakPolarHBondContact CB-OG1 3.33Å; E97-T118 WeakPolarHBondContact CG-OG1 3.43Å; E97-T118 PolarHBondContact OE1-OG1 3.08Å
98	F	98.1	Very high	97.7	Very high	6 Å²	6	40.7 Å²	40.7	3%	0.026	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-62.8	130.3	172.7	-163.2	-80.7	0	0	0	110.7	L109 L111 T118 I119 S123 L124 I127 L133 L135	F98-L109 HydrophobicContact CE1-CD2 4.31Å; F98-L109 HydrophobicContact CZ-CD2 3.76Å; F98-L111 HydrophobicContact CD2-CD1 4.2Å; F98-L111 HydrophobicContact CE2-CD1 3.78Å; F98-L111 HydrophobicContact CZ-CD1 4.1Å; F98-T118 PolarHBondContact N-O 3.02Å; F98-I119 HydrophobicContact CB-CG1 4.39Å; F98-I119 HydrophobicContact CB-CG2 4.46Å; F98-I119 HydrophobicContact CD2-CD1 4.44Å; F98-I119 HydrophobicContact CD2-CG1 4.27Å; F98-I119 HydrophobicContact CD2-CG2 4.11Å; F98-I119 HydrophobicContact CG-CG2 4.4Å; F98-S123 WeakPolarHBondContact CD1-OG 3.35Å; F98-L124 HydrophobicContact CE1-CD2 3.92Å; F98-L124 HydrophobicContact CE1-CG 4.42Å; F98-L124 HydrophobicContact CE2-CD2 3.93Å; F98-L124 HydrophobicContact CZ-CD2 3.5Å; F98-L124 HydrophobicContact CZ-CG 4.35Å; F98-I127 HydrophobicContact CE1-CD1 3.95Å; F98-I127 HydrophobicContact CZ-CD1 4.01Å; F98-L133 HydrophobicContact CE2-CD1 4.05Å; F98-L133 HydrophobicContact CE2-CD2 4.1Å; F98-L133 HydrophobicContact CZ-CD1 4.31Å; F98-L135 HydrophobicContact CD2-CD2 4.38Å; F98-L135 HydrophobicContact CE2-CD1 4.36Å; F98-L135 HydrophobicContact CE2-CD2 4.43Å
99	P	97.5	Very high	97.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-66.2	136.3	-174.2	26.3	-36.9	0	0	0	113.2	I75 L95 L102 L111	I75-P99 HydrophobicContact CD1-CB 3.34Å; L95-P99 HydrophobicContact CD1-CG 4.48Å; P99-L102 HydrophobicContact CB-CD1 4.34Å; P99-L102 HydrophobicContact CB-CD2 4.37Å; P99-L102 HydrophobicContact CB-CG 4.33Å; P99-L102 HydrophobicContact CG-CD1 3.87Å; P99-L102 HydrophobicContact CG-CG 4.39Å; P99-L111 HydrophobicContact CG-CD1 3.9Å; P99-L111 HydrophobicContact CG-CD2 3.82Å
100	T	95.9	Very high	97.7	Very high	54 Å²	54	39.5 Å²	39.5	33%	0.331	19%	0.191	S	C	.	.	P	Polyproline II helix	trans	-103.1	172	173	59	0	0	0	0	111.3	I75 L102	I75-T100 VanDerWaalsContact CG2-O 3.28Å; I75-T100 WeakPolarHBondContact CG2-O 3.39Å; T100-L102 PolarHBondContact O-N 3.1Å
101	N	96.2	Very high	97.7	Very high	42 Å²	42	39.5 Å²	39.5	23%	0.225	19%	0.191	C	C	.	.	S	Bend	trans	63.2	19.4	-176.7	-54.5	-72.8	0	0	0	115.1	I75 K80	I75-N101 HydrophobicContact CG2-CB 4.37Å; K80-N101 PolarHBondContact N-O 3.42Å
102	L	97.3	Very high	97.7	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.021	19%	0.186	C	C	.	.			trans	-66.3	153.9	174.2	-67.4	-177.1	0	0	0	112	L79 I88 L90 P99 T100 K104 L109 I127	L79-L102 HydrophobicContact CD2-CD2 4.26Å; I88-L102 HydrophobicContact CD1-CD2 4.2Å; L90-L102 HydrophobicContact CD1-CD2 4.32Å; P99-L102 HydrophobicContact CB-CD1 4.34Å; P99-L102 HydrophobicContact CB-CD2 4.37Å; P99-L102 HydrophobicContact CB-CG 4.33Å; P99-L102 HydrophobicContact CG-CD1 3.87Å; P99-L102 HydrophobicContact CG-CG 4.39Å; T100-L102 PolarHBondContact O-N 3.1Å; L102-K104 PolarHBondContact O-N 2.85Å; L102-L109 HydrophobicContact CD1-CD1 4.04Å; L102-L109 HydrophobicContact CD1-CD2 3.55Å; L102-L109 HydrophobicContact CD1-CG 4.48Å; L102-I127 HydrophobicContact CB-CG2 3.83Å; L102-I127 HydrophobicContact CD1-CD1 4.13Å
103	P	97	Very high	97.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.186	C	C	.	.			trans	-61	130.3	175.4	-15.6	27.8	0	0	0	112.1	L79 L82 V85 I88 Y105 V106	L79-P103 HydrophobicContact CG-CG 4.19Å; L79-P103 WeakPolarHBondContact O-CG 3.29Å; L82-P103 HydrophobicContact CB-CB 4.3Å; L82-P103 HydrophobicContact CB-CG 4.25Å; L82-P103 WeakPolarHBondContact O-CB 3.32Å; V85-P103 HydrophobicContact CB-CB 4.01Å; V85-P103 HydrophobicContact CB-CG 3.95Å; V85-P103 HydrophobicContact CG1-CG 4.09Å; V85-P103 HydrophobicContact CG2-CG 4.42Å; I88-P103 HydrophobicContact CD1-CG 3.91Å; P103-Y105 PolarHBondContact O-N 3.02Å; P103-V106 HydrophobicContact CB-CG2 4Å; P103-V106 HydrophobicContact CG-CG2 4.16Å; P103-V106 VanDerWaalsContact O-CG2 3.25Å; P103-V106 WeakPolarHBondContact O-CG2 3.48Å; P103-V106 PolarHBondContact O-N 2.03Å
104	K	95.7	Very high	97.7	Very high	97 Å²	97	38 Å²	38	42%	0.422	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-29.1	-169.1	-176.1	174.1	-177.5	178	0	115.6	L102	L102-K104 PolarHBondContact O-N 2.85Å
105	Y	97.5	Very high	97.7	Very high	91 Å²	91	39.3 Å²	39.3	36%	0.357	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	17.9	-172.4	-61.3	-73.7	0	0	0	113.8	L83 V85 P103 Y129	L83-Y105 HydrophobicContact CB-CD2 4.17Å; L83-Y105 HydrophobicContact CB-CE2 4.28Å; L83-Y105 HydrophobicContact CD2-CD2 4.4Å; L83-Y105 HydrophobicContact CD2-CE2 4.16Å; L83-Y105 WeakPolarHBondContact O-CD2 3.46Å; V85-Y105 CarbonylContact O-C 3.58Å; P103-Y105 PolarHBondContact O-N 3.02Å; Y105-Y129 AromaticContact CD1-CD2 3.47Å; Y105-Y129 HydrophobicContact CD1-CD2 3.47Å; Y105-Y129 VanDerWaalsContact CD1-CD2 3.47Å; Y105-Y129 AromaticContact CD1-CE2 3.5Å; Y105-Y129 HydrophobicContact CD1-CE2 3.5Å; Y105-Y129 HydrophobicContact CD1-CG 4.2Å; Y105-Y129 AromaticContact CE1-CD2 3.87Å; Y105-Y129 HydrophobicContact CE1-CD2 3.87Å; Y105-Y129 AromaticContact CE1-CE2 3.36Å; Y105-Y129 HydrophobicContact CE1-CE2 3.36Å; Y105-Y129 AromaticContact CE1-CZ 3.91Å; Y105-Y129 HydrophobicContact CG-CD2 4.45Å
106	V	98.3	Very high	97.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.188	C	C	.	.			trans	-60.5	135.5	172.1	171.3	0	0	0	0	110.5	V85 I88 P103 E108 L109 Y129 L130	V85-V106 HydrophobicContact CG1-CG2 4.16Å; V85-V106 PolarHBondContact O-N 3.46Å; I88-V106 HydrophobicContact CD1-CG2 3.55Å; I88-V106 HydrophobicContact CG1-CG2 3.96Å; P103-V106 HydrophobicContact CB-CG2 4Å; P103-V106 HydrophobicContact CG-CG2 4.16Å; P103-V106 VanDerWaalsContact O-CG2 3.25Å; P103-V106 WeakPolarHBondContact O-CG2 3.48Å; P103-V106 PolarHBondContact O-N 2.03Å; V106-E108 WeakPolarHBondContact CG1-O 3.44Å; V106-L109 HydrophobicContact CG1-CB 4.16Å; V106-Y129 CarbonylContact O-C 3.26Å; V106-L130 HydrophobicContact CG1-CD1 4Å; V106-L130 WeakPolarHBondContact O-CA 3.24Å; V106-L130 PolarHBondContact O-N 2.99Å
107	K	98.4	Very high	97.7	Very high	69 Å²	69	42.1 Å²	42.1	30%	0.3	19%	0.193	S	C	.	.			trans	-110.8	-41.5	177.3	-67.5	172.6	175.2	166.5	0	112.1	E86 L130 E131 E132	E86-K107 HydrophobicContact CB-CD 4.43Å; E86-K107 HydrophobicContact CG-CD 4.48Å; E86-K107 PolarHBondContact O-N 3.11Å; E86-K107 WeakPolarHBondContact OE1-CE 3.43Å; E86-K107 IonicContact OE1-NZ 3.84Å; E86-K107 PolarHBondContact OE1-NZ 3.41Å; K107-L130 WeakPolarHBondContact O-CD1 3.11Å; K107-E131 HydrophobicContact CB-CB 4.44Å; K107-E131 HydrophobicContact CB-CG 4.31Å; K107-E131 WeakPolarHBondContact CD-OE1 3.5Å; K107-E131 HydrophobicContact CG-CG 4.37Å; K107-E131 PolarHBondContact O-N 3.13Å; K107-E132 PolarHBondContact O-N 3.12Å
108	E	98.7	Very high	97.6	Very high	57 Å²	57	39.3 Å²	39.3	27%	0.266	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122	178.9	-56.5	168.3	-151.2	0	0	109.7	E86 R87 I88 V106 E132	E86-E108 PolarHBondContact O-N 3.33Å; R87-E108 WeakPolarHBondContact CA-O 3.27Å; R87-E108 HydrophobicContact CB-CB 4.3Å; R87-E108 WeakPolarHBondContact CD-OE1 3.34Å; R87-E108 WeakPolarHBondContact CD-OE2 3.26Å; R87-E108 HydrophobicContact CG-CB 3.93Å; R87-E108 HydrophobicContact CG-CG 4.08Å; I88-E108 PolarHBondContact N-O 3.47Å; V106-E108 WeakPolarHBondContact CG1-O 3.44Å; E108-E132 WeakPolarHBondContact CA-O 3.31Å; E108-E132 HydrophobicContact CG-CB 4.29Å
109	L	98.8	Very high	97.6	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	116.3	-179.5	-178.7	57.1	0	0	0	110.6	I88 F98 L102 V106 L111 I127 L130 E132 L133 H134	I88-L109 HydrophobicContact CB-CD1 3.98Å; I88-L109 HydrophobicContact CG2-CD1 4.19Å; F98-L109 HydrophobicContact CE1-CD2 4.31Å; F98-L109 HydrophobicContact CZ-CD2 3.76Å; L102-L109 HydrophobicContact CD1-CD1 4.04Å; L102-L109 HydrophobicContact CD1-CD2 3.55Å; L102-L109 HydrophobicContact CD1-CG 4.48Å; V106-L109 HydrophobicContact CG1-CB 4.16Å; L109-L111 HydrophobicContact CD1-CD1 4.44Å; L109-L111 HydrophobicContact CD1-CD2 4.18Å; L109-L111 HydrophobicContact CD1-CG 4.13Å; L109-L111 HydrophobicContact CD2-CD1 3.9Å; L109-L111 HydrophobicContact CD2-CG 4.44Å; L109-L111 HydrophobicContact CG-CD1 3.94Å; L109-L111 HydrophobicContact CG-CG 3.94Å; L109-I127 HydrophobicContact CD2-CD1 3.72Å; L109-L130 HydrophobicContact CB-CD1 3.62Å; L109-E132 PolarHBondContact N-O 3.07Å; L109-L133 HydrophobicContact CB-CD1 4.18Å; L109-L133 HydrophobicContact CD2-CD1 4.09Å; L109-L133 HydrophobicContact CG-CD1 4.13Å; L109-H134 PolarHBondContact O-N 3.46Å
110	H	98.8	Very high	97.5	Very high	16 Å²	16	41.7 Å²	41.7	7%	0.074	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	112.3	179.3	-62.2	-85.9	0	0	0	110.9	I88 Y89 L90 Y91 Q112 H134	I88-H110 PolarHBondContact O-N 3.46Å; Y89-H110 HydrophobicContact CD1-CB 4.05Å; Y89-H110 AromaticContact CD1-CD2 3.28Å; Y89-H110 WeakPolarHBondContact CD1-CD2 3.49Å; Y89-H110 AromaticContact CD1-CG 3.74Å; Y89-H110 AromaticContact CD1-NE2 3.89Å; Y89-H110 AromaticContact CE1-CD2 3.15Å; Y89-H110 WeakPolarHBondContact CE1-CD2 3.43Å; Y89-H110 AromaticContact CE1-CG 3.92Å; Y89-H110 AromaticContact CE1-NE2 3.25Å; Y89-H110 VanDerWaalsContact CE1-NE2 3.25Å; Y89-H110 WeakPolarHBondContact CE1-NE2 3.48Å; Y89-H110 AromaticContact CZ-CD2 4Å; Y89-H110 AromaticContact CZ-NE2 3.97Å; L90-H110 CarbonylContact C-O 3.55Å; L90-H110 WeakPolarHBondContact CA-O 3.02Å; L90-H110 PolarHBondContact N-O 2.86Å; Y91-H110 HydrophobicContact CD1-CB 4.23Å; Y91-H110 PolarHBondContact N-O 3.28Å; H110-Q112 VanDerWaalsContact CB-OE1 3.29Å; H110-H134 AromaticContact CE1-CD2 3.52Å; H110-H134 AromaticContact CE1-CE1 3.45Å; H110-H134 PolarHBondContact CE1-CE1 2.9Å; H110-H134 VanDerWaalsContact CE1-CE1 3.45Å; H110-H134 AromaticContact CE1-CG 3.91Å; H110-H134 AromaticContact CE1-ND1 3.83Å; H110-H134 AromaticContact CE1-NE2 3.23Å; H110-H134 PolarHBondContact CE1-NE2 2.87Å; H110-H134 AromaticContact ND1-CD2 3.32Å; H110-H134 PolarHBondContact ND1-CD2 3.28Å; H110-H134 VanDerWaalsContact ND1-CD2 3.32Å; H110-H134 AromaticContact ND1-CE1 3.52Å; H110-H134 AromaticContact ND1-CG 3.32Å; H110-H134 VanDerWaalsContact ND1-CG 3.32Å; H110-H134 AromaticContact ND1-ND1 3.4Å; H110-H134 PolarHBondContact ND1-ND1 3.21Å; H110-H134 AromaticContact ND1-NE2 3.47Å; H110-H134 PolarHBondContact ND1-NE2 3.34Å
111	L	98.6	Very high	97.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	19%	0.194	C	C	.	.			trans	-123.8	12.5	-178.3	-63.4	170.1	0	0	0	112.6	L90 L95 F98 P99 L109 N114 I116 L133 H134 L135 N138	L90-L111 HydrophobicContact CB-CD2 3.69Å; L90-L111 HydrophobicContact CD1-CD2 4.16Å; L95-L111 HydrophobicContact CD1-CD2 3.67Å; F98-L111 HydrophobicContact CD2-CD1 4.2Å; F98-L111 HydrophobicContact CE2-CD1 3.78Å; F98-L111 HydrophobicContact CZ-CD1 4.1Å; P99-L111 HydrophobicContact CG-CD1 3.9Å; P99-L111 HydrophobicContact CG-CD2 3.82Å; L109-L111 HydrophobicContact CD1-CD1 4.44Å; L109-L111 HydrophobicContact CD1-CD2 4.18Å; L109-L111 HydrophobicContact CD1-CG 4.13Å; L109-L111 HydrophobicContact CD2-CD1 3.9Å; L109-L111 HydrophobicContact CD2-CG 4.44Å; L109-L111 HydrophobicContact CG-CD1 3.94Å; L109-L111 HydrophobicContact CG-CG 3.94Å; L111-N114 PolarHBondContact O-ND2 3.07Å; L111-I116 HydrophobicContact CB-CD1 3.88Å; L111-I116 HydrophobicContact CD1-CD1 4.06Å; L111-I116 HydrophobicContact CG-CD1 4.37Å; L111-L133 HydrophobicContact CD1-CD1 4.25Å; L111-H134 WeakPolarHBondContact CA-O 3.38Å; L111-H134 WeakPolarHBondContact CB-O 3.33Å; L111-H134 PolarHBondContact N-O 2.93Å; L111-L135 HydrophobicContact CB-CD2 3.91Å; L111-L135 HydrophobicContact CD1-CD2 3.92Å; L111-N138 PolarHBondContact O-ND2 2.86Å
112	Q	98.1	Very high	97.5	Very high	30 Å²	30	45.5 Å²	45.5	14%	0.14	21%	0.212	C	C	.	.			trans	-62.3	158.2	-178.8	66.7	-79.2	5	0	0	113.4	Y91 H92 H110 N114 D136	Y91-Q112 CarbonylContact C-O 3.6Å; Y91-Q112 WeakPolarHBondContact CA-O 3.45Å; Y91-Q112 VanDerWaalsContact CB-CD 3.46Å; Y91-Q112 WeakPolarHBondContact CB-O 3.38Å; H92-Q112 PolarHBondContact N-O 2.85Å; H110-Q112 VanDerWaalsContact CB-OE1 3.29Å; Q112-N114 PolarHBondContact O-ND2 2.9Å; Q112-D136 CarbonylContact C-O 3.53Å; Q112-D136 WeakPolarHBondContact CA-O 3.46Å; Q112-D136 HydrophobicContact CB-CB 3.86Å; Q112-D136 VanDerWaalsContact CB-O 3.24Å; Q112-D136 WeakPolarHBondContact CB-O 3.49Å
113	E	98.1	Very high	97.4	Very high	93 Å²	93	45.5 Å²	45.5	44%	0.435	21%	0.212	S	C	.	.	S	Bend	trans	55.8	51.8	-175.8	-58.5	177.1	-124.4	0	0	112.5	H92 N93 D136 D137	H92-E113 WeakPolarHBondContact CA-O 3.44Å; H92-E113 HydrophobicContact CB-CB 4.25Å; H92-E113 IonicContact CE1-OE2 2.73Å; H92-E113 IonicContact CG-OE2 3.67Å; H92-E113 PolarHBondContact N-O 3.02Å; H92-E113 IonicContact ND1-OE2 2.65Å; H92-E113 PolarHBondContact ND1-OE2 2.8Å; N93-E113 PolarHBondContact N-O 3.11Å; E113-D136 PolarHBondContact N-O 2.96Å; E113-D136 VanDerWaalsContact N-O 3.09Å; E113-D137 WeakPolarHBondContact CA-O 3.5Å; E113-D137 HydrophobicContact CG-CB 4.1Å; E113-D137 PolarHBondContact N-O 3.05Å
114	N	98.3	Very high	97.4	Very high	7 Å²	7	45.5 Å²	45.5	4%	0.037	21%	0.212	C	C	.	.	S	Bend	trans	-127	-174	172.6	-84.8	-87	0	0	0	109.5	L90 N93 S94 L95 L111 Q112 I116 D137 N138	L90-N114 PolarHBondContact O-ND2 2.66Å; N93-N114 VanDerWaalsContact CA-OD1 3.31Å; N93-N114 WeakPolarHBondContact CA-OD1 3.03Å; N93-N114 WeakPolarHBondContact CB-OD1 3.49Å; N93-N114 PolarHBondContact N-OD1 3.29Å; N93-N114 PolarHBondContact O-OD1 2.7Å; S94-N114 PolarHBondContact N-OD1 3.17Å; L95-N114 HydrophobicContact CB-CB 4.22Å; L95-N114 WeakPolarHBondContact CB-OD1 3.47Å; L95-N114 WeakPolarHBondContact CG-OD1 3.4Å; L95-N114 PolarHBondContact N-OD1 3.06Å; L95-N114 VanDerWaalsContact N-OD1 3.08Å; L111-N114 PolarHBondContact O-ND2 3.07Å; Q112-N114 PolarHBondContact O-ND2 2.9Å; N114-I116 HydrophobicContact CB-CD1 4.3Å; N114-I116 HydrophobicContact CB-CG1 4.05Å; N114-D137 PolarHBondContact N-O 3.08Å; N114-N138 WeakPolarHBondContact CA-OD1 3.34Å; N114-N138 WeakPolarHBondContact CB-OD1 3.35Å; N114-N138 PolarHBondContact O-OD1 3.37Å
115	N	97.5	Very high	97.4	Very high	82 Å²	82	42.4 Å²	42.4	44%	0.439	20%	0.203	S	C	.	.			trans	-108	23.3	177.4	-67.4	-84	0	0	0	112.3	L95 R117	L95-N115 CarbonylContact O-C 3.27Å; L95-N115 WeakPolarHBondContact O-CA 3.25Å; L95-N115 WeakPolarHBondContact O-CB 3.18Å; L95-N115 PolarHBondContact O-N 3.13Å; N115-R117 PolarHBondContact O-N 2.65Å
116	I	98.3	Very high	97.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.201	C	C	.	.			trans	-60.7	127.3	-172.9	-61	172.4	0	0	0	109.8	L95 D96 L111 N114 I119 L135 N138 S139 V140	L95-I116 HydrophobicContact CB-CD1 4.33Å; L95-I116 HydrophobicContact CB-CG1 3.96Å; L95-I116 HydrophobicContact CD1-CD1 4.48Å; L95-I116 PolarHBondContact O-N 2.93Å; D96-I116 CarbonylContact O-C 3.18Å; D96-I116 WeakPolarHBondContact O-CA 3.48Å; L111-I116 HydrophobicContact CB-CD1 3.88Å; L111-I116 HydrophobicContact CD1-CD1 4.06Å; L111-I116 HydrophobicContact CG-CD1 4.37Å; N114-I116 HydrophobicContact CB-CD1 4.3Å; N114-I116 HydrophobicContact CB-CG1 4.05Å; I116-I119 HydrophobicContact CG2-CG1 4.47Å; I116-L135 HydrophobicContact CD1-CD2 3.83Å; I116-N138 HydrophobicContact CB-CB 4.43Å; I116-N138 WeakPolarHBondContact CB-OD1 3.28Å; I116-N138 WeakPolarHBondContact CG1-OD1 3.26Å; I116-N138 PolarHBondContact N-OD1 2.78Å; I116-S139 CarbonylContact O-C 3.57Å; I116-S139 VanDerWaalsContact O-CA 3.3Å; I116-S139 WeakPolarHBondContact O-CA 3.12Å; I116-S139 PolarHBondContact O-N 2.93Å; I116-V140 HydrophobicContact CG2-CG2 4.2Å; I116-V140 WeakPolarHBondContact O-CG2 3.17Å; I116-V140 PolarHBondContact O-N 2.73Å; I116-V140 VanDerWaalsContact O-N 3.14Å
117	R	96.4	Very high	97.3	Very high	136 Å²	136	41.3 Å²	41.3	51%	0.513	20%	0.201	S	C	.	.			trans	-111.1	-53.8	175.1	-65.4	171.7	-169.4	135.4	6.6	111.1	D96 N115 S144	D96-R117 PolarHBondContact O-N 3Å; N115-R117 PolarHBondContact O-N 2.65Å; R117-S144 WeakPolarHBondContact O-CB 3.2Å; R117-S144 PolarHBondContact O-OG 2.95Å
118	T	96.4	Very high	97.2	Very high	42 Å²	42	39.2 Å²	39.2	26%	0.258	20%	0.195	S	C	.	.	B	Isolated β-bridge	trans	-95.5	135	-170.1	40.2	0	0	0	0	111.8	E97 F98 S144	E97-T118 VanDerWaalsContact CB-OG1 3.25Å; E97-T118 WeakPolarHBondContact CB-OG1 3.33Å; E97-T118 WeakPolarHBondContact CG-OG1 3.43Å; E97-T118 PolarHBondContact OE1-OG1 3.08Å; F98-T118 PolarHBondContact N-O 3.02Å; T118-S144 CarbonylContact C-O 3.54Å; T118-S144 VanDerWaalsContact CA-O 3.32Å; T118-S144 WeakPolarHBondContact CA-O 3.16Å
119	I	97.2	Very high	97.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-130.3	117.1	174.1	-54.1	-174.8	0	0	0	107.8	F98 I116 L124 L135 V140 S144 I145 E146 A149	F98-I119 HydrophobicContact CB-CG1 4.39Å; F98-I119 HydrophobicContact CB-CG2 4.46Å; F98-I119 HydrophobicContact CD2-CD1 4.44Å; F98-I119 HydrophobicContact CD2-CG1 4.27Å; F98-I119 HydrophobicContact CD2-CG2 4.11Å; F98-I119 HydrophobicContact CG-CG2 4.4Å; I116-I119 HydrophobicContact CG2-CG1 4.47Å; I119-L124 HydrophobicContact CG2-CD1 3.53Å; I119-L124 HydrophobicContact CG2-CG 4.11Å; I119-L135 HydrophobicContact CD1-CD1 3.61Å; I119-V140 HydrophobicContact CD1-CG1 3.94Å; I119-V140 HydrophobicContact CD1-CG2 4.11Å; I119-V140 HydrophobicContact CG1-CG1 4.41Å; I119-S144 PolarHBondContact N-O 3.16Å; I119-I145 HydrophobicContact CB-CG1 4.26Å; I119-I145 HydrophobicContact CD1-CG1 4.17Å; I119-I145 HydrophobicContact CG1-CG1 4.39Å; I119-E146 PolarHBondContact O-N 2.84Å; I119-A149 HydrophobicContact CG2-CB 4.41Å
120	T	96.5	Very high	97.2	Very high	55 Å²	55	40.6 Å²	40.6	34%	0.337	20%	0.198	S	C	.	.			trans	-111.8	155.3	-175.5	62.3	0	0	0	0	112	D122 S123 L124 E146	T120-D122 VanDerWaalsContact C-N 3.28Å; T120-D122 PolarHBondContact O-N 2.55Å; T120-S123 PolarHBondContact N-OG 2.85Å; T120-S123 PolarHBondContact O-N 2.65Å; T120-S123 PolarHBondContact O-OG 2.97Å; T120-S123 PolarHBondContact OG1-N 2.83Å; T120-S123 PolarHBondContact OG1-OG 3.06Å; T120-L124 PolarHBondContact O-N 3.12Å; T120-E146 VanDerWaalsContact CA-OE2 3.24Å; T120-E146 WeakPolarHBondContact CA-OE2 3.44Å; T120-E146 VanDerWaalsContact CB-OE2 3.26Å; T120-E146 WeakPolarHBondContact CB-OE2 3.3Å
121	Y	96.4	Very high	97.1	Very high	66 Å²	66	42.9 Å²	42.9	26%	0.259	21%	0.209	S	C	.	.	H	α-helix	trans	-58.9	-41.9	171.2	170.2	-94	0	0	0	111.1	S123 L124 S125 E146 R151 D152	Y121-S123 VanDerWaalsContact C-N 3.26Å; Y121-S123 PolarHBondContact O-N 3.19Å; Y121-L124 PolarHBondContact O-N 3.16Å; Y121-S125 VanDerWaalsContact O-CB 3.24Å; Y121-S125 WeakPolarHBondContact O-CB 3.43Å; Y121-S125 PolarHBondContact O-N 3.47Å; Y121-S125 PolarHBondContact O-OG 3.05Å; Y121-E146 PolarHBondContact N-OE2 2.82Å; Y121-R151 HydrophobicContact CD2-CB 4.38Å; Y121-R151 HydrophobicContact CE2-CB 4.18Å; Y121-D152 PolarHBondContact OH-OD2 2.96Å
122	D	95.6	Very high	97.1	Very high	111 Å²	111	45 Å²	45	59%	0.594	22%	0.218	S	C	*	.	H	α-helix	trans	-63.4	-28.7	179.8	-77.3	-12.1	0	0	0	113.1	T120 Q126	T120-D122 VanDerWaalsContact C-N 3.28Å; T120-D122 PolarHBondContact O-N 2.55Å; D122-Q126 WeakPolarHBondContact O-CG 3.36Å; D122-Q126 PolarHBondContact O-NE2 3.35Å
123	S	95.8	Very high	97.2	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-80.4	-41.8	175.4	66.9	0	0	0	0	112.4	F98 T120 Y121	F98-S123 WeakPolarHBondContact CD1-OG 3.35Å; T120-S123 PolarHBondContact N-OG 2.85Å; T120-S123 PolarHBondContact O-N 2.65Å; T120-S123 PolarHBondContact O-OG 2.97Å; T120-S123 PolarHBondContact OG1-N 2.83Å; T120-S123 PolarHBondContact OG1-OG 3.06Å; Y121-S123 VanDerWaalsContact C-N 3.26Å; Y121-S123 PolarHBondContact O-N 3.19Å
124	L	96.6	Very high	97.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-77.6	-32.2	-176.2	-82.7	173.9	0	0	0	113.9	F98 I119 T120 Y121 Q126 I127 L133 A149 F150 N153	F98-L124 HydrophobicContact CE1-CD2 3.92Å; F98-L124 HydrophobicContact CE1-CG 4.42Å; F98-L124 HydrophobicContact CE2-CD2 3.93Å; F98-L124 HydrophobicContact CZ-CD2 3.5Å; F98-L124 HydrophobicContact CZ-CG 4.35Å; I119-L124 HydrophobicContact CG2-CD1 3.53Å; I119-L124 HydrophobicContact CG2-CG 4.11Å; T120-L124 PolarHBondContact O-N 3.12Å; Y121-L124 PolarHBondContact O-N 3.16Å; L124-Q126 PolarHBondContact O-N 3.02Å; L124-I127 CarbonylContact O-C 3.21Å; L124-I127 WeakPolarHBondContact O-CG1 3.36Å; L124-I127 PolarHBondContact O-N 2.82Å; L124-I127 VanDerWaalsContact O-N 3.1Å; L124-L133 HydrophobicContact CD2-CD2 4.42Å; L124-A149 WeakPolarHBondContact CB-O 3.21Å; L124-A149 HydrophobicContact CD1-CB 3.98Å; L124-F150 HydrophobicContact CD1-CD1 3.51Å; L124-F150 HydrophobicContact CD1-CE1 3.59Å; L124-F150 HydrophobicContact CD1-CG 4.04Å; L124-F150 HydrophobicContact CD1-CZ 4.17Å; L124-F150 HydrophobicContact CD2-CE1 4.48Å; L124-N153 WeakPolarHBondContact CB-OD1 3.44Å; L124-N153 PolarHBondContact O-ND2 2.95Å
125	S	95.9	Very high	97.2	Very high	33 Å²	33	40.1 Å²	40.1	23%	0.231	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-15.6	175.7	57.3	0	0	0	0	113.7	Y121 I127	Y121-S125 VanDerWaalsContact O-CB 3.24Å; Y121-S125 WeakPolarHBondContact O-CB 3.43Å; Y121-S125 PolarHBondContact O-N 3.47Å; Y121-S125 PolarHBondContact O-OG 3.05Å; S125-I127 VanDerWaalsContact C-N 3.29Å
126	Q	95.4	Very high	97.2	Very high	66 Å²	66	36.8 Å²	36.8	31%	0.308	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-24.5	172.3	-65.6	173.1	42.8	0	0	112.6	D122 L124 P128	D122-Q126 WeakPolarHBondContact O-CG 3.36Å; D122-Q126 PolarHBondContact O-NE2 3.35Å; L124-Q126 PolarHBondContact O-N 3.02Å; Q126-P128 VanDerWaalsContact C-CD 3.4Å; Q126-P128 WeakPolarHBondContact O-CD 3.46Å
127	I	97.4	Very high	97.2	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	19%	0.192	C	C	.	.			trans	-123.8	60.6	-176.7	53.2	173.4	0	0	0	111.6	F98 L102 L109 L124 S125 Y129 L130 N153	F98-I127 HydrophobicContact CE1-CD1 3.95Å; F98-I127 HydrophobicContact CZ-CD1 4.01Å; L102-I127 HydrophobicContact CB-CG2 3.83Å; L102-I127 HydrophobicContact CD1-CD1 4.13Å; L109-I127 HydrophobicContact CD2-CD1 3.72Å; L124-I127 CarbonylContact O-C 3.21Å; L124-I127 WeakPolarHBondContact O-CG1 3.36Å; L124-I127 PolarHBondContact O-N 2.82Å; L124-I127 VanDerWaalsContact O-N 3.1Å; S125-I127 VanDerWaalsContact C-N 3.29Å; I127-Y129 PolarHBondContact O-N 2.77Å; I127-L130 HydrophobicContact CD1-CD1 4.46Å; I127-L130 HydrophobicContact CD1-CD2 3.96Å; I127-L130 WeakPolarHBondContact O-CB 3.25Å; I127-L130 PolarHBondContact O-N 3.35Å; I127-N153 PolarHBondContact O-ND2 2.89Å; I127-N153 VanDerWaalsContact O-ND2 3.09Å
128	P	96.9	Very high	97.3	Very high	26 Å²	26	33.5 Å²	33.5	17%	0.169	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-19.4	-172.7	29.7	-36.1	0	0	0	113.4	Q126 L130 Y155	Q126-P128 VanDerWaalsContact C-CD 3.4Å; Q126-P128 WeakPolarHBondContact O-CD 3.46Å; P128-L130 VanDerWaalsContact C-N 3.31Å; P128-L130 PolarHBondContact O-N 3.49Å; P128-Y155 WeakPolarHBondContact O-CD2 3.49Å
129	Y	97.9	Very high	97.4	Very high	85 Å²	85	32.8 Å²	32.8	33%	0.333	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	7.4	-179.8	-60.7	-76.6	0	0	0	114.3	Y105 V106 I127 E131 Y155	Y105-Y129 AromaticContact CD1-CD2 3.47Å; Y105-Y129 HydrophobicContact CD1-CD2 3.47Å; Y105-Y129 VanDerWaalsContact CD1-CD2 3.47Å; Y105-Y129 AromaticContact CD1-CE2 3.5Å; Y105-Y129 HydrophobicContact CD1-CE2 3.5Å; Y105-Y129 HydrophobicContact CD1-CG 4.2Å; Y105-Y129 AromaticContact CE1-CD2 3.87Å; Y105-Y129 HydrophobicContact CE1-CD2 3.87Å; Y105-Y129 AromaticContact CE1-CE2 3.36Å; Y105-Y129 HydrophobicContact CE1-CE2 3.36Å; Y105-Y129 AromaticContact CE1-CZ 3.91Å; Y105-Y129 HydrophobicContact CG-CD2 4.45Å; V106-Y129 CarbonylContact O-C 3.26Å; I127-Y129 PolarHBondContact O-N 2.77Å; Y129-E131 PolarHBondContact O-N 3.36Å; Y129-Y155 HydrophobicContact CD1-CD2 4.16Å; Y129-Y155 AromaticContact CD1-CE2 3.91Å; Y129-Y155 HydrophobicContact CD1-CE2 3.91Å; Y129-Y155 HydrophobicContact CE1-CE2 4.16Å
130	L	98.4	Very high	97.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.167	C	C	.	.			trans	-61.9	126.9	-179.8	-169.1	70.1	0	0	0	111.2	V106 K107 L109 I127 P128 L133 Y155 L156	V106-L130 HydrophobicContact CG1-CD1 4Å; V106-L130 WeakPolarHBondContact O-CA 3.24Å; V106-L130 PolarHBondContact O-N 2.99Å; K107-L130 WeakPolarHBondContact O-CD1 3.11Å; L109-L130 HydrophobicContact CB-CD1 3.62Å; I127-L130 HydrophobicContact CD1-CD1 4.46Å; I127-L130 HydrophobicContact CD1-CD2 3.96Å; I127-L130 WeakPolarHBondContact O-CB 3.25Å; I127-L130 PolarHBondContact O-N 3.35Å; P128-L130 VanDerWaalsContact C-N 3.31Å; P128-L130 PolarHBondContact O-N 3.49Å; L130-L133 HydrophobicContact CD2-CB 3.92Å; L130-L133 HydrophobicContact CD2-CD1 4.25Å; L130-L133 HydrophobicContact CD2-CD2 4Å; L130-L133 HydrophobicContact CD2-CG 4.28Å; L130-Y155 CarbonylContact O-C 3.16Å; L130-L156 HydrophobicContact CD2-CD1 4.2Å; L130-L156 HydrophobicContact CG-CD1 4.15Å; L130-L156 WeakPolarHBondContact O-CA 3.15Å; L130-L156 PolarHBondContact O-N 3.11Å
131	E	98.5	Very high	97.3	Very high	65 Å²	65	31.9 Å²	31.9	30%	0.304	16%	0.163	S	C	.	.			trans	-105.6	-33.8	179.8	-64.3	-171.4	-136.9	0	0	112.1	K107 Y129 Y155 R157 L158	K107-E131 HydrophobicContact CB-CB 4.44Å; K107-E131 HydrophobicContact CB-CG 4.31Å; K107-E131 WeakPolarHBondContact CD-OE1 3.5Å; K107-E131 HydrophobicContact CG-CG 4.37Å; K107-E131 PolarHBondContact O-N 3.13Å; Y129-E131 PolarHBondContact O-N 3.36Å; E131-Y155 WeakPolarHBondContact CA-O 3.28Å; E131-R157 PolarHBondContact O-N 2.96Å; E131-R157 IonicContact OE2-NH1 2.79Å; E131-L158 PolarHBondContact O-N 3.18Å
132	E	98.7	Very high	97.1	Very high	44 Å²	44	29.7 Å²	29.7	21%	0.206	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	123.8	-174	176.5	165.1	-180	0	0	111.3	K107 E108 L109 H134 L158	K107-E132 PolarHBondContact O-N 3.12Å; E108-E132 WeakPolarHBondContact CA-O 3.31Å; E108-E132 HydrophobicContact CG-CB 4.29Å; L109-E132 PolarHBondContact N-O 3.07Å; E132-H134 WeakPolarHBondContact CG-NE2 3.17Å; E132-H134 IonicContact OE1-CD2 2.84Å; E132-H134 IonicContact OE1-CE1 2.91Å; E132-H134 PolarHBondContact OE1-CE1 3.47Å; E132-H134 IonicContact OE1-NE2 3.89Å; E132-H134 PolarHBondContact OE1-NE2 3.27Å; E132-L158 HydrophobicContact CB-CB 4.14Å; E132-L158 HydrophobicContact CB-CD1 4.24Å; E132-L158 HydrophobicContact CG-CB 3.97Å; E132-L158 HydrophobicContact CG-CD1 3.98Å; E132-L158 WeakPolarHBondContact OE2-CD1 3.4Å
133	L	98.7	Very high	96.9	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	118.4	-177	179.8	54.3	0	0	0	111.3	F98 L109 L111 L124 L130 L135 F150 L156 L158 L159 F160	F98-L133 HydrophobicContact CE2-CD1 4.05Å; F98-L133 HydrophobicContact CE2-CD2 4.1Å; F98-L133 HydrophobicContact CZ-CD1 4.31Å; L109-L133 HydrophobicContact CB-CD1 4.18Å; L109-L133 HydrophobicContact CD2-CD1 4.09Å; L109-L133 HydrophobicContact CG-CD1 4.13Å; L111-L133 HydrophobicContact CD1-CD1 4.25Å; L124-L133 HydrophobicContact CD2-CD2 4.42Å; L130-L133 HydrophobicContact CD2-CB 3.92Å; L130-L133 HydrophobicContact CD2-CD1 4.25Å; L130-L133 HydrophobicContact CD2-CD2 4Å; L130-L133 HydrophobicContact CD2-CG 4.28Å; L133-L135 HydrophobicContact CD1-CD1 4.22Å; L133-L135 HydrophobicContact CD1-CG 4.05Å; L133-L135 HydrophobicContact CD2-CD1 3.78Å; L133-L135 HydrophobicContact CD2-CG 4.48Å; L133-L135 HydrophobicContact CG-CD1 3.91Å; L133-L135 HydrophobicContact CG-CG 4.09Å; L133-F150 HydrophobicContact CD2-CE1 4.13Å; L133-L156 HydrophobicContact CB-CD1 3.91Å; L133-L158 PolarHBondContact N-O 2.82Å; L133-L159 HydrophobicContact CB-CD1 4.2Å; L133-L159 HydrophobicContact CD2-CD1 3.96Å; L133-L159 HydrophobicContact CG-CD1 4.14Å; L133-F160 PolarHBondContact O-N 3.22Å
134	H	98.7	Very high	96.7	Very high	27 Å²	27	32 Å²	32	13%	0.125	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	117.3	174.7	-58.4	-133	0	0	0	108.9	L109 H110 L111 E132 F160	L109-H134 PolarHBondContact O-N 3.46Å; H110-H134 AromaticContact CE1-CD2 3.52Å; H110-H134 AromaticContact CE1-CE1 3.45Å; H110-H134 PolarHBondContact CE1-CE1 2.9Å; H110-H134 VanDerWaalsContact CE1-CE1 3.45Å; H110-H134 AromaticContact CE1-CG 3.91Å; H110-H134 AromaticContact CE1-ND1 3.83Å; H110-H134 AromaticContact CE1-NE2 3.23Å; H110-H134 PolarHBondContact CE1-NE2 2.87Å; H110-H134 AromaticContact ND1-CD2 3.32Å; H110-H134 PolarHBondContact ND1-CD2 3.28Å; H110-H134 VanDerWaalsContact ND1-CD2 3.32Å; H110-H134 AromaticContact ND1-CE1 3.52Å; H110-H134 AromaticContact ND1-CG 3.32Å; H110-H134 VanDerWaalsContact ND1-CG 3.32Å; H110-H134 AromaticContact ND1-ND1 3.4Å; H110-H134 PolarHBondContact ND1-ND1 3.21Å; H110-H134 AromaticContact ND1-NE2 3.47Å; H110-H134 PolarHBondContact ND1-NE2 3.34Å; L111-H134 WeakPolarHBondContact CA-O 3.38Å; L111-H134 WeakPolarHBondContact CB-O 3.33Å; L111-H134 PolarHBondContact N-O 2.93Å; E132-H134 WeakPolarHBondContact CG-NE2 3.17Å; E132-H134 IonicContact OE1-CD2 2.84Å; E132-H134 IonicContact OE1-CE1 2.91Å; E132-H134 PolarHBondContact OE1-CE1 3.47Å; E132-H134 IonicContact OE1-NE2 3.89Å; E132-H134 PolarHBondContact OE1-NE2 3.27Å; H134-F160 AromaticContact CE1-CD2 3.57Å; H134-F160 AromaticContact CE1-CE2 3.54Å; H134-F160 AromaticContact CG-CD2 3.88Å; H134-F160 AromaticContact ND1-CD2 3.63Å; H134-F160 AromaticContact NE2-CD2 3.84Å; H134-F160 AromaticContact NE2-CE2 3.7Å
135	L	98.2	Very high	96.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.18	C	C	.	.			trans	-125.3	22.5	176.1	-77.3	164.2	0	0	0	110.6	F98 L111 I116 I119 L133 N138 F160 L161 N164	F98-L135 HydrophobicContact CD2-CD2 4.38Å; F98-L135 HydrophobicContact CE2-CD1 4.36Å; F98-L135 HydrophobicContact CE2-CD2 4.43Å; L111-L135 HydrophobicContact CB-CD2 3.91Å; L111-L135 HydrophobicContact CD1-CD2 3.92Å; I116-L135 HydrophobicContact CD1-CD2 3.83Å; I119-L135 HydrophobicContact CD1-CD1 3.61Å; L133-L135 HydrophobicContact CD1-CD1 4.22Å; L133-L135 HydrophobicContact CD1-CG 4.05Å; L133-L135 HydrophobicContact CD2-CD1 3.78Å; L133-L135 HydrophobicContact CD2-CG 4.48Å; L133-L135 HydrophobicContact CG-CD1 3.91Å; L133-L135 HydrophobicContact CG-CG 4.09Å; L135-N138 WeakPolarHBondContact O-CB 3.36Å; L135-N138 PolarHBondContact O-ND2 2.87Å; L135-F160 WeakPolarHBondContact CA-O 3.44Å; L135-F160 PolarHBondContact N-O 3.09Å; L135-L161 HydrophobicContact CB-CD2 3.76Å; L135-L161 HydrophobicContact CD1-CD2 3.91Å; L135-N164 PolarHBondContact O-ND2 3.5Å
136	D	97.9	Very high	96.7	Very high	13 Å²	13	35.3 Å²	35.3	7%	0.07	19%	0.189	C	C	.	.			trans	-60	153.1	179.7	-48.5	-97.2	0	0	0	111.9	Q112 E113 N138 F160 S162	Q112-D136 CarbonylContact C-O 3.53Å; Q112-D136 WeakPolarHBondContact CA-O 3.46Å; Q112-D136 HydrophobicContact CB-CB 3.86Å; Q112-D136 VanDerWaalsContact CB-O 3.24Å; Q112-D136 WeakPolarHBondContact CB-O 3.49Å; E113-D136 PolarHBondContact N-O 2.96Å; E113-D136 VanDerWaalsContact N-O 3.09Å; D136-N138 PolarHBondContact O-N 3.44Å; D136-N138 PolarHBondContact O-ND2 3.43Å; D136-F160 WeakPolarHBondContact OD1-CB 3.41Å; D136-F160 WeakPolarHBondContact OD2-CB 3.12Å; D136-S162 CarbonylContact C-O 3.49Å; D136-S162 VanDerWaalsContact CA-O 3.24Å; D136-S162 WeakPolarHBondContact CA-O 3.47Å; D136-S162 WeakPolarHBondContact OD1-CB 3.3Å; D136-S162 PolarHBondContact OD1-N 3.06Å; D136-S162 PolarHBondContact OD1-OG 3.07Å
137	D	98.3	Very high	96.5	Very high	58 Å²	58	36.9 Å²	36.9	31%	0.31	20%	0.2	S	C	.	.	S	Bend	trans	52.3	54.7	176.4	-65	-76.7	0	0	0	112.6	E113 N114 S162 R163	E113-D137 WeakPolarHBondContact CA-O 3.5Å; E113-D137 HydrophobicContact CG-CB 4.1Å; E113-D137 PolarHBondContact N-O 3.05Å; N114-D137 PolarHBondContact N-O 3.08Å; D137-S162 PolarHBondContact N-O 3.37Å; D137-R163 WeakPolarHBondContact CA-O 3.33Å; D137-R163 WeakPolarHBondContact OD1-CB 3.05Å; D137-R163 VanDerWaalsContact OD1-CD 3.22Å; D137-R163 WeakPolarHBondContact OD1-CD 3.28Å; D137-R163 IonicContact OD1-CZ 3.63Å; D137-R163 IonicContact OD1-NE 3.13Å; D137-R163 PolarHBondContact OD1-NE 3.05Å; D137-R163 IonicContact OD2-CZ 3.8Å; D137-R163 VanDerWaalsContact OD2-CZ 3.22Å; D137-R163 IonicContact OD2-NE 3.9Å; D137-R163 PolarHBondContact OD2-NE 3.1Å; D137-R163 IonicContact OD2-NH2 2.77Å; D137-R163 PolarHBondContact OD2-NH2 3.14Å
138	N	98.3	Very high	96.1	Very high	8 Å²	8	37.3 Å²	37.3	4%	0.043	20%	0.204	C	C	.	.	S	Bend	trans	-130.8	-173.5	178	-87.4	-86.8	0	0	0	110.5	L111 N114 I116 L135 D136 V140 R163 N164	L111-N138 PolarHBondContact O-ND2 2.86Å; N114-N138 WeakPolarHBondContact CA-OD1 3.34Å; N114-N138 WeakPolarHBondContact CB-OD1 3.35Å; N114-N138 PolarHBondContact O-OD1 3.37Å; I116-N138 HydrophobicContact CB-CB 4.43Å; I116-N138 WeakPolarHBondContact CB-OD1 3.28Å; I116-N138 WeakPolarHBondContact CG1-OD1 3.26Å; I116-N138 PolarHBondContact N-OD1 2.78Å; L135-N138 WeakPolarHBondContact O-CB 3.36Å; L135-N138 PolarHBondContact O-ND2 2.87Å; D136-N138 PolarHBondContact O-N 3.44Å; D136-N138 PolarHBondContact O-ND2 3.43Å; N138-V140 HydrophobicContact CB-CG2 4.26Å; N138-R163 PolarHBondContact N-O 3.24Å; N138-N164 VanDerWaalsContact CB-OD1 3.27Å; N138-N164 WeakPolarHBondContact CB-OD1 3.06Å; N138-N164 PolarHBondContact O-OD1 3.37Å
139	S	97.4	Very high	96	Very high	28 Å²	28	36.1 Å²	36.1	20%	0.196	20%	0.196	C	C	.	.			trans	-110.5	23.8	-178.2	-73.3	0	0	0	0	113.7	I116	I116-S139 CarbonylContact O-C 3.57Å; I116-S139 VanDerWaalsContact O-CA 3.3Å; I116-S139 WeakPolarHBondContact O-CA 3.12Å; I116-S139 PolarHBondContact O-N 2.93Å
140	V	97.3	Very high	95.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.181	C	C	.	.			trans	-69.2	138.1	-175.6	-173.8	0	0	0	0	110.7	I116 I119 N138 I145 N164 H165 L166	I116-V140 HydrophobicContact CG2-CG2 4.2Å; I116-V140 WeakPolarHBondContact O-CG2 3.17Å; I116-V140 PolarHBondContact O-N 2.73Å; I116-V140 VanDerWaalsContact O-N 3.14Å; I119-V140 HydrophobicContact CD1-CG1 3.94Å; I119-V140 HydrophobicContact CD1-CG2 4.11Å; I119-V140 HydrophobicContact CG1-CG1 4.41Å; N138-V140 HydrophobicContact CB-CG2 4.26Å; V140-I145 HydrophobicContact CG1-CD1 3.7Å; V140-I145 HydrophobicContact CG1-CG1 3.65Å; V140-N164 VanDerWaalsContact CB-OD1 3.24Å; V140-N164 WeakPolarHBondContact CB-OD1 3.27Å; V140-N164 WeakPolarHBondContact CG2-OD1 3.33Å; V140-N164 PolarHBondContact N-OD1 3.33Å; V140-H165 CarbonylContact O-C 3.17Å; V140-H165 VanDerWaalsContact O-C 3.27Å; V140-H165 VanDerWaalsContact O-CA 3.28Å; V140-H165 WeakPolarHBondContact O-CA 3.47Å; V140-H165 WeakPolarHBondContact O-CB 3.2Å; V140-H165 PolarHBondContact O-N 3.08Å; V140-L166 HydrophobicContact CG1-CD2 4.36Å; V140-L166 PolarHBondContact O-N 2.75Å
141	S	95.5	Very high	95.7	Very high	35 Å²	35	40.1 Å²	40.1	25%	0.245	21%	0.211	C	C	.	.			trans	-125.8	159.6	177	77	0	0	0	0	110.4	V143 S144 I145	S141-V143 PolarHBondContact O-N 2.9Å; S141-V143 VanDerWaalsContact O-N 3.15Å; S141-S144 PolarHBondContact N-OG 2.87Å; S141-S144 PolarHBondContact O-N 2.81Å; S141-S144 VanDerWaalsContact O-N 3.1Å; S141-S144 PolarHBondContact O-OG 2.83Å; S141-S144 VanDerWaalsContact O-OG 3.07Å; S141-S144 WeakPolarHBondContact OG-CB 3.26Å; S141-S144 PolarHBondContact OG-N 3.15Å; S141-S144 PolarHBondContact OG-OG 2.81Å; S141-I145 PolarHBondContact O-N 2.87Å
142	A	91.1	Very high	95.5	Very high	21 Å²	21	39.8 Å²	39.8	17%	0.174	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-21.3	-179.1	0	0	0	0	0	113.5	L166 T168	A142-L166 HydrophobicContact CB-CD2 4.5Å; A142-T168 HydrophobicContact CB-CG2 3.88Å
143	V	91.9	Very high	95.3	Very high	138 Å²	138	37.8 Å²	37.8	84%	0.836	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-18.6	178.4	-177.9	0	0	0	0	112	S141	S141-V143 PolarHBondContact O-N 2.9Å; S141-V143 VanDerWaalsContact O-N 3.15Å
144	S	92.8	Very high	95.1	Very high	24 Å²	24	44.3 Å²	44.3	17%	0.168	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	0.5	-179.6	61.9	0	0	0	0	113.5	R117 T118 I119 S141	R117-S144 WeakPolarHBondContact O-CB 3.2Å; R117-S144 PolarHBondContact O-OG 2.95Å; T118-S144 CarbonylContact C-O 3.54Å; T118-S144 VanDerWaalsContact CA-O 3.32Å; T118-S144 WeakPolarHBondContact CA-O 3.16Å; I119-S144 PolarHBondContact N-O 3.16Å; S141-S144 PolarHBondContact N-OG 2.87Å; S141-S144 PolarHBondContact O-N 2.81Å; S141-S144 VanDerWaalsContact O-N 3.1Å; S141-S144 PolarHBondContact O-OG 2.83Å; S141-S144 VanDerWaalsContact O-OG 3.07Å; S141-S144 WeakPolarHBondContact OG-CB 3.26Å; S141-S144 PolarHBondContact OG-N 3.15Å; S141-S144 PolarHBondContact OG-OG 2.81Å
145	I	96.1	Very high	95.1	Very high	11 Å²	11	49.2 Å²	49.2	6%	0.056	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-93	124	164.1	-62.4	167.4	0	0	0	107.2	I119 V140 S141 A149 F150 L166 P170	I119-I145 HydrophobicContact CB-CG1 4.26Å; I119-I145 HydrophobicContact CD1-CG1 4.17Å; I119-I145 HydrophobicContact CG1-CG1 4.39Å; V140-I145 HydrophobicContact CG1-CD1 3.7Å; V140-I145 HydrophobicContact CG1-CG1 3.65Å; S141-I145 PolarHBondContact O-N 2.87Å; I145-A149 HydrophobicContact CG2-CB 4.12Å; I145-F150 HydrophobicContact CG2-CE2 3.98Å; I145-L166 HydrophobicContact CD1-CD2 4.22Å; I145-P170 HydrophobicContact CD1-CB 4.11Å; I145-P170 HydrophobicContact CD1-CG 3.5Å
146	E	95.1	Very high	95.1	Very high	91 Å²	91	49.2 Å²	49.2	43%	0.425	25%	0.253	S	S	.	.			trans	-66.4	148.3	178.1	-173	-179.1	175.7	0	0	112.3	I119 T120 Y121 G148 A149	I119-E146 PolarHBondContact O-N 2.84Å; T120-E146 VanDerWaalsContact CA-OE2 3.24Å; T120-E146 WeakPolarHBondContact CA-OE2 3.44Å; T120-E146 VanDerWaalsContact CB-OE2 3.26Å; T120-E146 WeakPolarHBondContact CB-OE2 3.3Å; Y121-E146 PolarHBondContact N-OE2 2.82Å; E146-G148 PolarHBondContact O-N 3.36Å; E146-A149 HydrophobicContact CB-CB 4.15Å; E146-A149 WeakPolarHBondContact O-CB 3.38Å; E146-A149 PolarHBondContact O-N 3Å
147	D	90.9	Very high	95.1	Very high	100 Å²	100	53.1 Å²	53.1	54%	0.535	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	98.6	-177.6	-70.3	-9.5	0	0	0	112.7	W171	D147-W171 HydrophobicContact CB-CH2 3.61Å; D147-W171 HydrophobicContact CB-CZ2 3.58Å; D147-W171 HydrophobicContact CB-CZ3 4.43Å; D147-W171 WeakPolarHBondContact OD1-CZ2 3.42Å; D147-W171 WeakPolarHBondContact OD2-CZ2 3.37Å
148	G	89.4	Confident	95.1	Very high	9 Å²	9	52.1 Å²	52.1	9%	0.093	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	30	-174.2	0	0	0	0	0	113.9	E146 F150 R151	E146-G148 PolarHBondContact O-N 3.36Å; G148-F150 PolarHBondContact O-N 3.34Å; G148-R151 WeakPolarHBondContact O-CB 3.34Å; G148-R151 PolarHBondContact O-N 3.25Å
149	A	95.8	Very high	95.1	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.008	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.9	-34.9	173.6	0	0	0	0	0	113.3	I119 L124 I145 E146 R151	I119-A149 HydrophobicContact CG2-CB 4.41Å; L124-A149 WeakPolarHBondContact CB-O 3.21Å; L124-A149 HydrophobicContact CD1-CB 3.98Å; I145-A149 HydrophobicContact CG2-CB 4.12Å; E146-A149 HydrophobicContact CB-CB 4.15Å; E146-A149 WeakPolarHBondContact O-CB 3.38Å; E146-A149 PolarHBondContact O-N 3Å; A149-R151 PolarHBondContact O-N 3.41Å
150	F	95.3	Very high	95.2	Very high	3 Å²	3	50.9 Å²	50.9	1%	0.013	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	6.4	-178.9	-60.1	-80.6	0	0	0	115.5	L124 L133 I145 G148 D152 N153 L156 L159 L173 P174	L124-F150 HydrophobicContact CD1-CD1 3.51Å; L124-F150 HydrophobicContact CD1-CE1 3.59Å; L124-F150 HydrophobicContact CD1-CG 4.04Å; L124-F150 HydrophobicContact CD1-CZ 4.17Å; L124-F150 HydrophobicContact CD2-CE1 4.48Å; L133-F150 HydrophobicContact CD2-CE1 4.13Å; I145-F150 HydrophobicContact CG2-CE2 3.98Å; G148-F150 PolarHBondContact O-N 3.34Å; F150-D152 PolarHBondContact O-N 2.82Å; F150-D152 VanDerWaalsContact O-N 3.13Å; F150-N153 WeakPolarHBondContact CA-OD1 3.23Å; F150-N153 PolarHBondContact O-N 3.16Å; F150-N153 VanDerWaalsContact O-N 3.11Å; F150-L156 HydrophobicContact CD1-CD2 3.96Å; F150-L156 HydrophobicContact CE1-CD2 4.25Å; F150-L159 HydrophobicContact CE1-CD1 4.38Å; F150-L159 HydrophobicContact CE1-CD2 4.46Å; F150-L159 HydrophobicContact CZ-CD1 4.47Å; F150-L159 HydrophobicContact CZ-CD2 4.28Å; F150-L173 HydrophobicContact CD2-CD2 4.19Å; F150-L173 HydrophobicContact CE2-CD2 4.22Å; F150-P174 HydrophobicContact CB-CG 3.62Å; F150-P174 HydrophobicContact CG-CG 4.45Å
151	R	93.2	Very high	95.2	Very high	167 Å²	167	50.9 Å²	50.9	63%	0.63	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-38.6	-171	-179.3	-176.9	-57.1	172.8	7.7	114.1	Y121 G148 A149	Y121-R151 HydrophobicContact CD2-CB 4.38Å; Y121-R151 HydrophobicContact CE2-CB 4.18Å; G148-R151 WeakPolarHBondContact O-CB 3.34Å; G148-R151 PolarHBondContact O-N 3.25Å; A149-R151 PolarHBondContact O-N 3.41Å
152	D	94.2	Very high	95.4	Very high	58 Å²	58	49.4 Å²	49.4	31%	0.31	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-8.5	-174.6	-74.8	11	0	0	0	113.3	Y121 F150 M154	Y121-D152 PolarHBondContact OH-OD2 2.96Å; F150-D152 PolarHBondContact O-N 2.82Å; F150-D152 VanDerWaalsContact O-N 3.13Å; D152-M154 PolarHBondContact O-N 3.33Å
153	N	96.1	Very high	95.7	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.005	25%	0.252	C	S	.	.			trans	-82.9	58.2	179.1	-50.5	101.8	0	0	0	110.9	L124 I127 F150 Y155 L156	L124-N153 WeakPolarHBondContact CB-OD1 3.44Å; L124-N153 PolarHBondContact O-ND2 2.95Å; I127-N153 PolarHBondContact O-ND2 2.89Å; I127-N153 VanDerWaalsContact O-ND2 3.09Å; F150-N153 WeakPolarHBondContact CA-OD1 3.23Å; F150-N153 PolarHBondContact O-N 3.16Å; F150-N153 VanDerWaalsContact O-N 3.11Å; N153-Y155 PolarHBondContact O-N 3.24Å; N153-L156 HydrophobicContact CB-CB 4.16Å; N153-L156 WeakPolarHBondContact O-CB 3.49Å; N153-L156 PolarHBondContact O-N 3.08Å; N153-L156 VanDerWaalsContact O-N 3.08Å
154	M	94.5	Very high	96	Very high	138 Å²	138	47 Å²	47	68%	0.68	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	2.5	-175.2	-49.7	-169.2	93.3	0	0	114.3	D152 T176	D152-M154 PolarHBondContact O-N 3.33Å; M154-T176 VanDerWaalsContact O-CG2 3.32Å; M154-T176 WeakPolarHBondContact O-CG2 3.4Å
155	Y	97.4	Very high	96.2	Very high	129 Å²	129	49.9 Å²	49.9	51%	0.506	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.7	-3.5	176	-63.5	-86.3	0	0	0	112.8	P128 Y129 L130 E131 N153 R157	P128-Y155 WeakPolarHBondContact O-CD2 3.49Å; Y129-Y155 HydrophobicContact CD1-CD2 4.16Å; Y129-Y155 AromaticContact CD1-CE2 3.91Å; Y129-Y155 HydrophobicContact CD1-CE2 3.91Å; Y129-Y155 HydrophobicContact CE1-CE2 4.16Å; L130-Y155 CarbonylContact O-C 3.16Å; E131-Y155 WeakPolarHBondContact CA-O 3.28Å; N153-Y155 PolarHBondContact O-N 3.24Å; Y155-R157 WeakPolarHBondContact O-CG 3.23Å; Y155-R157 PolarHBondContact O-N 2.85Å
156	L	98.3	Very high	96.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	22%	0.221	C	C	.	.			trans	-68.9	120.3	-174.6	-171.6	67.8	0	0	0	110.6	L130 L133 F150 N153 L159 P174 T176 I177	L130-L156 HydrophobicContact CD2-CD1 4.2Å; L130-L156 HydrophobicContact CG-CD1 4.15Å; L130-L156 WeakPolarHBondContact O-CA 3.15Å; L130-L156 PolarHBondContact O-N 3.11Å; L133-L156 HydrophobicContact CB-CD1 3.91Å; F150-L156 HydrophobicContact CD1-CD2 3.96Å; F150-L156 HydrophobicContact CE1-CD2 4.25Å; N153-L156 HydrophobicContact CB-CB 4.16Å; N153-L156 WeakPolarHBondContact O-CB 3.49Å; N153-L156 PolarHBondContact O-N 3.08Å; N153-L156 VanDerWaalsContact O-N 3.08Å; L156-L159 HydrophobicContact CD2-CB 4.38Å; L156-P174 HydrophobicContact CB-CG 4.35Å; L156-P174 HydrophobicContact CD2-CG 4.26Å; L156-T176 CarbonylContact O-C 3.17Å; L156-T176 VanDerWaalsContact O-CB 3.29Å; L156-T176 WeakPolarHBondContact O-CB 3.44Å; L156-T176 PolarHBondContact O-OG1 3.5Å; L156-I177 PolarHBondContact O-N 3.08Å
157	R	98.3	Very high	96.3	Very high	95 Å²	95	47.8 Å²	47.8	36%	0.358	22%	0.22	S	C	.	.			trans	-116	-34.3	-175.6	-70.9	167	71	-130	-10.7	112.1	E131 Y155 E178 E179	E131-R157 PolarHBondContact O-N 2.96Å; E131-R157 IonicContact OE2-NH1 2.79Å; Y155-R157 WeakPolarHBondContact O-CG 3.23Å; Y155-R157 PolarHBondContact O-N 2.85Å; R157-E178 HydrophobicContact CB-CG 4.42Å; R157-E178 IonicContact CZ-OE1 2.74Å; R157-E178 VanDerWaalsContact CZ-OE1 3.25Å; R157-E178 IonicContact NE-OE1 3.93Å; R157-E178 PolarHBondContact NE-OE1 2.89Å; R157-E178 VanDerWaalsContact NH2-CD 3.29Å; R157-E178 IonicContact NH2-OE1 3.98Å; R157-E178 PolarHBondContact NH2-OE1 3.04Å; R157-E178 IonicContact NH2-OE2 2.77Å; R157-E178 PolarHBondContact NH2-OE2 2.84Å; R157-E178 PolarHBondContact O-N 2.87Å; R157-E179 PolarHBondContact O-N 2.04Å; R157-E179 VanDerWaalsContact O-N 3.1Å
158	L	98.8	Very high	96.6	Very high	37 Å²	37	44.8 Å²	44.8	19%	0.194	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	119.3	-178.9	-55	175.6	0	0	0	108.9	E131 E132 L133 F160 E179	E131-L158 PolarHBondContact O-N 3.18Å; E132-L158 HydrophobicContact CB-CB 4.14Å; E132-L158 HydrophobicContact CB-CD1 4.24Å; E132-L158 HydrophobicContact CG-CB 3.97Å; E132-L158 HydrophobicContact CG-CD1 3.98Å; E132-L158 WeakPolarHBondContact OE2-CD1 3.4Å; L133-L158 PolarHBondContact N-O 2.82Å; L158-F160 HydrophobicContact CB-CE1 4.18Å; L158-F160 HydrophobicContact CB-CZ 4.02Å; L158-E179 HydrophobicContact CD2-CB 3.52Å
159	L	98.5	Very high	96.9	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	111.3	177.3	177.3	60	0	0	0	109.6	L133 F150 L156 L161 L173 I177 E179 L180 R181	L133-L159 HydrophobicContact CB-CD1 4.2Å; L133-L159 HydrophobicContact CD2-CD1 3.96Å; L133-L159 HydrophobicContact CG-CD1 4.14Å; F150-L159 HydrophobicContact CE1-CD1 4.38Å; F150-L159 HydrophobicContact CE1-CD2 4.46Å; F150-L159 HydrophobicContact CZ-CD1 4.47Å; F150-L159 HydrophobicContact CZ-CD2 4.28Å; L156-L159 HydrophobicContact CD2-CB 4.38Å; L159-L161 HydrophobicContact CD1-CD1 4.11Å; L159-L161 HydrophobicContact CD1-CG 4.13Å; L159-L161 HydrophobicContact CD2-CD1 3.92Å; L159-L161 HydrophobicContact CG-CD1 3.92Å; L159-L161 HydrophobicContact CG-CG 4.26Å; L159-L173 HydrophobicContact CD2-CD2 3.73Å; L159-I177 HydrophobicContact CB-CD1 4.11Å; L159-I177 HydrophobicContact CD2-CD1 3.93Å; L159-E179 PolarHBondContact N-O 3.28Å; L159-L180 HydrophobicContact CB-CD1 4.2Å; L159-L180 HydrophobicContact CD2-CD1 4.02Å; L159-L180 HydrophobicContact CG-CD1 4.13Å; L159-R181 PolarHBondContact O-N 2.91Å
160	F	98.7	Very high	96.7	Very high	10 Å²	10	44.8 Å²	44.8	4%	0.044	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	119.4	178.6	-49.5	-30.7	0	0	0	110	L133 H134 L135 D136 L158 E179 R181	L133-F160 PolarHBondContact O-N 3.22Å; H134-F160 AromaticContact CE1-CD2 3.57Å; H134-F160 AromaticContact CE1-CE2 3.54Å; H134-F160 AromaticContact CG-CD2 3.88Å; H134-F160 AromaticContact ND1-CD2 3.63Å; H134-F160 AromaticContact NE2-CD2 3.84Å; H134-F160 AromaticContact NE2-CE2 3.7Å; L135-F160 WeakPolarHBondContact CA-O 3.44Å; L135-F160 PolarHBondContact N-O 3.09Å; D136-F160 WeakPolarHBondContact OD1-CB 3.41Å; D136-F160 WeakPolarHBondContact OD2-CB 3.12Å; L158-F160 HydrophobicContact CB-CE1 4.18Å; L158-F160 HydrophobicContact CB-CZ 4.02Å; F160-E179 HydrophobicContact CE1-CB 4.27Å; F160-E179 HydrophobicContact CE1-CG 3.86Å; F160-R181 HydrophobicContact CB-CB 4.28Å; F160-R181 HydrophobicContact CD1-CB 3.82Å; F160-R181 HydrophobicContact CD1-CG 3.6Å; F160-R181 HydrophobicContact CE1-CG 4.03Å; F160-R181 HydrophobicContact CG-CB 4.37Å; F160-R181 HydrophobicContact CG-CG 4.41Å
161	L	98.1	Very high	96.5	Very high	1 Å²	1	52 Å²	52	1%	0.005	23%	0.23	C	C	.	.			trans	-128.1	28.8	-177.6	-77.3	163.2	0	0	0	109.9	L135 L159 N164 L166 R181 L182 N185	L135-L161 HydrophobicContact CB-CD2 3.76Å; L135-L161 HydrophobicContact CD1-CD2 3.91Å; L159-L161 HydrophobicContact CD1-CD1 4.11Å; L159-L161 HydrophobicContact CD1-CG 4.13Å; L159-L161 HydrophobicContact CD2-CD1 3.92Å; L159-L161 HydrophobicContact CG-CD1 3.92Å; L159-L161 HydrophobicContact CG-CG 4.26Å; L161-N164 PolarHBondContact O-ND2 2.98Å; L161-L166 HydrophobicContact CB-CD1 4.05Å; L161-L166 HydrophobicContact CD1-CD1 4.29Å; L161-R181 PolarHBondContact N-O 3.32Å; L161-L182 HydrophobicContact CB-CD2 3.9Å; L161-L182 HydrophobicContact CD1-CD2 4.18Å; L161-N185 PolarHBondContact O-ND2 3.28Å
162	S	98.2	Very high	96.3	Very high	3 Å²	3	46 Å²	46	2%	0.021	22%	0.221	C	C	.	.			trans	-64.6	152.6	-177.7	-27.3	0	0	0	0	110.9	D136 D137 N164 D183	D136-S162 CarbonylContact C-O 3.49Å; D136-S162 VanDerWaalsContact CA-O 3.24Å; D136-S162 WeakPolarHBondContact CA-O 3.47Å; D136-S162 WeakPolarHBondContact OD1-CB 3.3Å; D136-S162 PolarHBondContact OD1-N 3.06Å; D136-S162 PolarHBondContact OD1-OG 3.07Å; D137-S162 PolarHBondContact N-O 3.37Å; S162-N164 PolarHBondContact O-N 3.05Å; S162-N164 PolarHBondContact O-ND2 2.96Å; S162-D183 CarbonylContact C-O 3.49Å; S162-D183 VanDerWaalsContact CA-O 3.26Å; S162-D183 WeakPolarHBondContact CA-O 3.48Å; S162-D183 WeakPolarHBondContact CB-OD2 3.25Å; S162-D183 PolarHBondContact OG-OD1 3.07Å
163	R	98.3	Very high	96.3	Very high	105 Å²	105	43.8 Å²	43.8	40%	0.396	21%	0.209	S	C	.	.	S	Bend	trans	49.4	54.1	178.6	-68.6	-177.2	-65.4	-71.4	-8.6	113.4	D137 N138 D183 D184	D137-R163 WeakPolarHBondContact CA-O 3.33Å; D137-R163 WeakPolarHBondContact OD1-CB 3.05Å; D137-R163 VanDerWaalsContact OD1-CD 3.22Å; D137-R163 WeakPolarHBondContact OD1-CD 3.28Å; D137-R163 IonicContact OD1-CZ 3.63Å; D137-R163 IonicContact OD1-NE 3.13Å; D137-R163 PolarHBondContact OD1-NE 3.05Å; D137-R163 IonicContact OD2-CZ 3.8Å; D137-R163 VanDerWaalsContact OD2-CZ 3.22Å; D137-R163 IonicContact OD2-NE 3.9Å; D137-R163 PolarHBondContact OD2-NE 3.1Å; D137-R163 IonicContact OD2-NH2 2.77Å; D137-R163 PolarHBondContact OD2-NH2 3.14Å; N138-R163 PolarHBondContact N-O 3.24Å; R163-D183 PolarHBondContact N-O 2.85Å; R163-D184 WeakPolarHBondContact CA-O 3.22Å; R163-D184 HydrophobicContact CG-CB 3.46Å; R163-D184 VanDerWaalsContact CG-CB 3.46Å; R163-D184 IonicContact NH1-OD2 2.69Å
164	N	98.1	Very high	96.2	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.021	21%	0.213	C	C	.	.	S	Bend	trans	-122.2	-171.7	175.4	-88.2	-90.3	0	0	0	111.2	L135 N138 V140 L161 S162 L166 N185	L135-N164 PolarHBondContact O-ND2 3.5Å; N138-N164 VanDerWaalsContact CB-OD1 3.27Å; N138-N164 WeakPolarHBondContact CB-OD1 3.06Å; N138-N164 PolarHBondContact O-OD1 3.37Å; V140-N164 VanDerWaalsContact CB-OD1 3.24Å; V140-N164 WeakPolarHBondContact CB-OD1 3.27Å; V140-N164 WeakPolarHBondContact CG2-OD1 3.33Å; V140-N164 PolarHBondContact N-OD1 3.33Å; L161-N164 PolarHBondContact O-ND2 2.98Å; S162-N164 PolarHBondContact O-N 3.05Å; S162-N164 PolarHBondContact O-ND2 2.96Å; N164-L166 HydrophobicContact CB-CG 4.43Å; N164-N185 WeakPolarHBondContact CA-OD1 3.08Å; N164-N185 WeakPolarHBondContact CB-OD1 3.09Å; N164-N185 PolarHBondContact N-OD1 2.84Å; N164-N185 PolarHBondContact O-OD1 3.23Å
165	H	97.3	Very high	96.2	Very high	85 Å²	85	43 Å²	43	39%	0.394	20%	0.203	S	C	.	.			trans	-104.8	29.3	-179.1	-60.2	142.7	0	0	0	113.2	V140 S167	V140-H165 CarbonylContact O-C 3.17Å; V140-H165 VanDerWaalsContact O-C 3.27Å; V140-H165 VanDerWaalsContact O-CA 3.28Å; V140-H165 WeakPolarHBondContact O-CA 3.47Å; V140-H165 WeakPolarHBondContact O-CB 3.2Å; V140-H165 PolarHBondContact O-N 3.08Å; H165-S167 PolarHBondContact O-N 3.25Å
166	L	97.6	Very high	96.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.191	C	C	.	.			trans	-69.9	129.8	178.3	-58.4	175.1	0	0	0	111.1	V140 A142 I145 L161 N164 P170 L182 N185 R186 I187	V140-L166 HydrophobicContact CG1-CD2 4.36Å; V140-L166 PolarHBondContact O-N 2.75Å; A142-L166 HydrophobicContact CB-CD2 4.5Å; I145-L166 HydrophobicContact CD1-CD2 4.22Å; L161-L166 HydrophobicContact CB-CD1 4.05Å; L161-L166 HydrophobicContact CD1-CD1 4.29Å; N164-L166 HydrophobicContact CB-CG 4.43Å; L166-P170 HydrophobicContact CD2-CG 4.33Å; L166-L182 HydrophobicContact CD1-CD2 3.42Å; L166-L182 VanDerWaalsContact CD1-CD2 3.42Å; L166-N185 HydrophobicContact CB-CB 4.3Å; L166-N185 VanDerWaalsContact CB-OD1 3.24Å; L166-N185 WeakPolarHBondContact CB-OD1 3.41Å; L166-N185 WeakPolarHBondContact CG-OD1 3.41Å; L166-N185 PolarHBondContact N-OD1 2.69Å; L166-N185 VanDerWaalsContact N-OD1 3.08Å; L166-R186 CarbonylContact O-C 3.58Å; L166-R186 VanDerWaalsContact O-CA 3.27Å; L166-R186 WeakPolarHBondContact O-CA 3.24Å; L166-R186 PolarHBondContact O-N 3.26Å; L166-I187 HydrophobicContact CB-CD1 4.47Å; L166-I187 HydrophobicContact CB-CG1 4.13Å; L166-I187 PolarHBondContact O-N 2.72Å; L166-I187 VanDerWaalsContact O-N 3.11Å
167	S	96.5	Very high	96.2	Very high	58 Å²	58	38.9 Å²	38.9	41%	0.406	19%	0.191	S	C	.	.	S	Bend	trans	-100	-19.6	176.2	54.5	0	0	0	0	113.6	H165 I187 S188	H165-S167 PolarHBondContact O-N 3.25Å; S167-I187 WeakPolarHBondContact O-CA 3.06Å; S167-S188 PolarHBondContact O-N 3.23Å
168	T	96.5	Very high	96.2	Very high	36 Å²	36	36.3 Å²	36.3	22%	0.221	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-149.6	168	173.6	-165	0	0	0	0	109.2	A142 T189	A142-T168 HydrophobicContact CB-CG2 3.88Å; T168-T189 WeakPolarHBondContact CA-O 3.26Å; T168-T189 WeakPolarHBondContact CB-O 3.4Å; T168-T189 PolarHBondContact OG1-O 3.06Å
169	I	95.6	Very high	96.2	Very high	5 Å²	5	36 Å²	36	3%	0.026	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-75.1	129.1	174.6	-55.7	-167.2	0	0	0	109.1	L173 L182 I187 I190 L195 L206	I169-L173 HydrophobicContact CG2-CD1 3.84Å; I169-L182 HydrophobicContact CD1-CD1 3.73Å; I169-L182 HydrophobicContact CG1-CD1 3.88Å; I169-L182 HydrophobicContact CG2-CD1 4.18Å; I169-I187 HydrophobicContact CG1-CD1 4.32Å; I169-I190 HydrophobicContact CB-CG2 4.49Å; I169-I190 HydrophobicContact CD1-CD1 4.04Å; I169-I190 HydrophobicContact CD1-CG1 4.19Å; I169-I190 HydrophobicContact CD1-CG2 3.63Å; I169-I190 HydrophobicContact CG1-CG1 4.27Å; I169-I190 HydrophobicContact CG1-CG2 3.99Å; I169-L195 HydrophobicContact CD1-CD1 4.18Å; I169-L195 HydrophobicContact CD1-CD2 3.93Å; I169-L195 HydrophobicContact CD1-CG 4.24Å; I169-L195 HydrophobicContact CG2-CD2 4.21Å; I169-L206 HydrophobicContact CD1-CD2 4.04Å
170	P	92.4	Very high	96.2	Very high	6 Å²	6	36.1 Å²	36.1	4%	0.039	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-57.3	147.6	175.3	-24.4	34.8	0	0	0	112.4	I145 L166	I145-P170 HydrophobicContact CD1-CB 4.11Å; I145-P170 HydrophobicContact CD1-CG 3.5Å; L166-P170 HydrophobicContact CD2-CG 4.33Å
171	W	89.4	Confident	96.2	Very high	153 Å²	153	39.1 Å²	39.1	58%	0.58	19%	0.193	S	C	*	.	S	Bend	trans	-93.6	159.5	175.8	59	-77.4	0	0	0	111	D147	D147-W171 HydrophobicContact CB-CH2 3.61Å; D147-W171 HydrophobicContact CB-CZ2 3.58Å; D147-W171 HydrophobicContact CB-CZ3 4.43Å; D147-W171 WeakPolarHBondContact OD1-CZ2 3.42Å; D147-W171 WeakPolarHBondContact OD2-CZ2 3.37Å
172	G	89.2	Confident	96.2	Very high	42 Å²	42	39.1 Å²	39.1	43%	0.433	19%	0.193	S	C	.	.	S	Bend	trans	73.6	23	-178	0	0	0	0	0	114.8
173	L	94.3	Very high	96.2	Very high	12 Å²	12	40.1 Å²	40.1	6%	0.063	20%	0.198	C	C	.	.			trans	-62.4	142	172.4	-70.3	175.7	0	0	0	111.6	F150 L159 I169 K175 I177 L180 L198	F150-L173 HydrophobicContact CD2-CD2 4.19Å; F150-L173 HydrophobicContact CE2-CD2 4.22Å; L159-L173 HydrophobicContact CD2-CD2 3.73Å; I169-L173 HydrophobicContact CG2-CD1 3.84Å; L173-K175 PolarHBondContact O-N 3.05Å; L173-I177 HydrophobicContact CB-CD1 4.21Å; L173-I177 HydrophobicContact CD2-CD1 4.37Å; L173-L180 HydrophobicContact CD1-CD2 3.9Å; L173-L198 HydrophobicContact CB-CD1 4.39Å; L173-L198 HydrophobicContact CB-CD2 4.07Å; L173-L198 HydrophobicContact CD1-CD1 4.21Å
174	P	94.8	Very high	96.2	Very high	14 Å²	14	37.6 Å²	37.6	9%	0.091	19%	0.192	C	C	.	.			trans	-61.2	134.5	-179.4	-27.5	36.7	0	0	0	113.6	F150 L156 T176 I177 L198	F150-P174 HydrophobicContact CB-CG 3.62Å; F150-P174 HydrophobicContact CG-CG 4.45Å; L156-P174 HydrophobicContact CB-CG 4.35Å; L156-P174 HydrophobicContact CD2-CG 4.26Å; P174-T176 PolarHBondContact O-N 3.13Å; P174-I177 HydrophobicContact CB-CG1 4.41Å; P174-I177 WeakPolarHBondContact O-CG1 3.38Å; P174-I177 PolarHBondContact O-N 2.69Å; P174-L198 VanDerWaalsContact O-CD2 3.26Å; P174-L198 WeakPolarHBondContact O-CD2 3.4Å
175	K	95	Very high	96.2	Very high	107 Å²	107	37.7 Å²	37.7	47%	0.465	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-9	178.1	-46.8	-162.4	-175.3	-162.1	0	113.8	L173 D197 N200	L173-K175 PolarHBondContact O-N 3.05Å; K175-D197 HydrophobicContact CD-CB 3.96Å; K175-D197 WeakPolarHBondContact CE-OD1 3.21Å; K175-D197 WeakPolarHBondContact CE-OD2 3.27Å; K175-D197 HydrophobicContact CG-CB 4.14Å; K175-D197 IonicContact NZ-OD1 2.69Å; K175-D197 PolarHBondContact NZ-OD1 3.09Å; K175-D197 IonicContact NZ-OD2 2.74Å; K175-D197 PolarHBondContact NZ-OD2 2.9Å; K175-N200 WeakPolarHBondContact O-CB 3.3Å; K175-N200 PolarHBondContact O-ND2 3.32Å
176	T	96.8	Very high	96.2	Very high	43 Å²	43	41 Å²	41	26%	0.264	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-9.6	178.9	47.1	0	0	0	0	114.3	M154 L156 P174 E178	M154-T176 VanDerWaalsContact O-CG2 3.32Å; M154-T176 WeakPolarHBondContact O-CG2 3.4Å; L156-T176 CarbonylContact O-C 3.17Å; L156-T176 VanDerWaalsContact O-CB 3.29Å; L156-T176 WeakPolarHBondContact O-CB 3.44Å; L156-T176 PolarHBondContact O-OG1 3.5Å; P174-T176 PolarHBondContact O-N 3.13Å; T176-E178 PolarHBondContact O-N 2.84Å
177	I	97.8	Very high	96.2	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.			trans	-59.9	127.5	178.9	-65.9	176.6	0	0	0	110.4	L156 L159 L173 P174 E179 L180 N200 L201	L156-I177 PolarHBondContact O-N 3.08Å; L159-I177 HydrophobicContact CB-CD1 4.11Å; L159-I177 HydrophobicContact CD2-CD1 3.93Å; L173-I177 HydrophobicContact CB-CD1 4.21Å; L173-I177 HydrophobicContact CD2-CD1 4.37Å; P174-I177 HydrophobicContact CB-CG1 4.41Å; P174-I177 WeakPolarHBondContact O-CG1 3.38Å; P174-I177 PolarHBondContact O-N 2.69Å; I177-E179 WeakPolarHBondContact CG2-O 3.46Å; I177-L180 HydrophobicContact CG2-CB 4.1Å; I177-N200 CarbonylContact O-C 3.1Å; I177-N200 VanDerWaalsContact O-C 3.31Å; I177-L201 HydrophobicContact CG2-CD1 3.78Å; I177-L201 VanDerWaalsContact O-CA 3.31Å; I177-L201 WeakPolarHBondContact O-CA 3.13Å; I177-L201 PolarHBondContact O-N 3.4Å
178	E	98.3	Very high	96.3	Very high	41 Å²	41	40.4 Å²	40.4	19%	0.192	20%	0.198	C	C	.	.	S	Bend	trans	-102.7	-32.9	173.4	-64.3	-173.9	-156.1	0	0	111.9	R157 T176 K202 R203	R157-E178 HydrophobicContact CB-CG 4.42Å; R157-E178 IonicContact CZ-OE1 2.74Å; R157-E178 VanDerWaalsContact CZ-OE1 3.25Å; R157-E178 IonicContact NE-OE1 3.93Å; R157-E178 PolarHBondContact NE-OE1 2.89Å; R157-E178 VanDerWaalsContact NH2-CD 3.29Å; R157-E178 IonicContact NH2-OE1 3.98Å; R157-E178 PolarHBondContact NH2-OE1 3.04Å; R157-E178 IonicContact NH2-OE2 2.77Å; R157-E178 PolarHBondContact NH2-OE2 2.84Å; R157-E178 PolarHBondContact O-N 2.87Å; T176-E178 PolarHBondContact O-N 2.84Å; E178-K202 HydrophobicContact CB-CD 4.3Å; E178-K202 HydrophobicContact CG-CD 4.47Å; E178-K202 WeakPolarHBondContact O-CA 2.99Å; E178-K202 WeakPolarHBondContact O-CB 3.38Å; E178-K202 PolarHBondContact O-N 3.29Å; E178-K202 IonicContact OE1-NZ 3.25Å; E178-K202 WeakPolarHBondContact OE2-CE 3.4Å; E178-K202 IonicContact OE2-NZ 3.23Å; E178-K202 PolarHBondContact OE2-NZ 2.94Å; E178-R203 PolarHBondContact O-N 3.06Å; E178-R203 VanDerWaalsContact O-N 3.07Å
179	E	98.6	Very high	96.3	Very high	32 Å²	32	42.1 Å²	42.1	15%	0.15	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	125.6	175.7	-170.9	168.6	165.7	0	0	111.2	R157 L158 L159 F160 I177 R181 R203	R157-E179 PolarHBondContact O-N 2.04Å; R157-E179 VanDerWaalsContact O-N 3.1Å; L158-E179 HydrophobicContact CD2-CB 3.52Å; L159-E179 PolarHBondContact N-O 3.28Å; F160-E179 HydrophobicContact CE1-CB 4.27Å; F160-E179 HydrophobicContact CE1-CG 3.86Å; I177-E179 WeakPolarHBondContact CG2-O 3.46Å; E179-R181 HydrophobicContact CG-CG 4.43Å; E179-R181 IonicContact OE1-CZ 3.8Å; E179-R181 IonicContact OE1-NE 2.73Å; E179-R181 PolarHBondContact OE1-NE 2.84Å; E179-R181 IonicContact OE1-NH2 3.19Å; E179-R181 PolarHBondContact OE1-NH2 2.93Å; E179-R203 WeakPolarHBondContact CA-O 3.23Å; E179-R203 HydrophobicContact CB-CB 4.4Å; E179-R203 HydrophobicContact CG-CB 3.93Å; E179-R203 HydrophobicContact CG-CG 4.01Å; E179-R203 IonicContact OE1-CZ 2.69Å; E179-R203 IonicContact OE1-NE 3.9Å; E179-R203 IonicContact OE1-NH1 3.49Å; E179-R203 PolarHBondContact OE1-NH1 3.03Å
180	L	98.6	Very high	96.3	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	116.4	176.9	-177.3	57.2	0	0	0	108.9	L159 L173 I177 L182 L195 L198 L201 R203 L204 V205	L159-L180 HydrophobicContact CB-CD1 4.2Å; L159-L180 HydrophobicContact CD2-CD1 4.02Å; L159-L180 HydrophobicContact CG-CD1 4.13Å; L173-L180 HydrophobicContact CD1-CD2 3.9Å; I177-L180 HydrophobicContact CG2-CB 4.1Å; L180-L182 HydrophobicContact CD1-CD1 4.24Å; L180-L182 HydrophobicContact CD1-CD2 4.44Å; L180-L182 HydrophobicContact CD1-CG 4.14Å; L180-L182 HydrophobicContact CD2-CD1 3.82Å; L180-L182 HydrophobicContact CG-CD1 3.79Å; L180-L182 HydrophobicContact CG-CG 4.01Å; L180-L195 HydrophobicContact CD2-CD2 4.36Å; L180-L198 HydrophobicContact CD2-CD1 4.32Å; L180-L201 HydrophobicContact CB-CD1 3.75Å; L180-R203 PolarHBondContact N-O 3.42Å; L180-L204 HydrophobicContact CB-CD1 4.1Å; L180-L204 HydrophobicContact CD2-CD1 4.03Å; L180-L204 HydrophobicContact CG-CD1 4.13Å; L180-V205 PolarHBondContact O-N 2.78Å
181	R	98.7	Very high	96.2	Very high	74 Å²	74	44.8 Å²	44.8	28%	0.279	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	125.3	174.1	-64.9	-171	-166.7	163.4	12.5	110.7	L159 F160 L161 E179 V205	L159-R181 PolarHBondContact O-N 2.91Å; F160-R181 HydrophobicContact CB-CB 4.28Å; F160-R181 HydrophobicContact CD1-CB 3.82Å; F160-R181 HydrophobicContact CD1-CG 3.6Å; F160-R181 HydrophobicContact CE1-CG 4.03Å; F160-R181 HydrophobicContact CG-CB 4.37Å; F160-R181 HydrophobicContact CG-CG 4.41Å; L161-R181 PolarHBondContact N-O 3.32Å; E179-R181 HydrophobicContact CG-CG 4.43Å; E179-R181 IonicContact OE1-CZ 3.8Å; E179-R181 IonicContact OE1-NE 2.73Å; E179-R181 PolarHBondContact OE1-NE 2.84Å; E179-R181 IonicContact OE1-NH2 3.19Å; E179-R181 PolarHBondContact OE1-NH2 2.93Å; R181-V205 HydrophobicContact CG-CB 4.23Å; R181-V205 HydrophobicContact CG-CG2 4.11Å
182	L	98.3	Very high	96.2	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	22%	0.218	C	C	.	.			trans	-136.8	21.4	-176	-68.1	167.2	0	0	0	110	L161 L166 I169 L180 N185 I187 V205 L206 N209	L161-L182 HydrophobicContact CB-CD2 3.9Å; L161-L182 HydrophobicContact CD1-CD2 4.18Å; L166-L182 HydrophobicContact CD1-CD2 3.42Å; L166-L182 VanDerWaalsContact CD1-CD2 3.42Å; I169-L182 HydrophobicContact CD1-CD1 3.73Å; I169-L182 HydrophobicContact CG1-CD1 3.88Å; I169-L182 HydrophobicContact CG2-CD1 4.18Å; L180-L182 HydrophobicContact CD1-CD1 4.24Å; L180-L182 HydrophobicContact CD1-CD2 4.44Å; L180-L182 HydrophobicContact CD1-CG 4.14Å; L180-L182 HydrophobicContact CD2-CD1 3.82Å; L180-L182 HydrophobicContact CG-CD1 3.79Å; L180-L182 HydrophobicContact CG-CG 4.01Å; L182-N185 PolarHBondContact O-ND2 2.9Å; L182-I187 HydrophobicContact CB-CD1 3.86Å; L182-I187 HydrophobicContact CD1-CD1 4.27Å; L182-I187 HydrophobicContact CD2-CD1 4.41Å; L182-I187 HydrophobicContact CG-CD1 4.43Å; L182-V205 PolarHBondContact N-O 3.35Å; L182-L206 HydrophobicContact CB-CD2 3.82Å; L182-L206 HydrophobicContact CD1-CD2 3.88Å; L182-N209 PolarHBondContact O-ND2 3.09Å
183	D	98.3	Very high	96.2	Very high	24 Å²	24	45.5 Å²	45.5	13%	0.128	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	156.2	-179	43.7	-72.3	0	0	0	113.4	S162 R163 N185 V205 D207	S162-D183 CarbonylContact C-O 3.49Å; S162-D183 VanDerWaalsContact CA-O 3.26Å; S162-D183 WeakPolarHBondContact CA-O 3.48Å; S162-D183 WeakPolarHBondContact CB-OD2 3.25Å; S162-D183 PolarHBondContact OG-OD1 3.07Å; R163-D183 PolarHBondContact N-O 2.85Å; D183-N185 PolarHBondContact O-N 2.83Å; D183-N185 VanDerWaalsContact O-N 3.16Å; D183-N185 PolarHBondContact O-ND2 3.26Å; D183-V205 HydrophobicContact CB-CG1 3.99Å; D183-D207 CarbonylContact C-O 3.59Å; D183-D207 WeakPolarHBondContact CA-O 3.5Å; D183-D207 HydrophobicContact CB-CB 4.02Å; D183-D207 WeakPolarHBondContact CB-O 3.43Å
184	D	98.3	Very high	96.1	Very high	51 Å²	51	45.3 Å²	45.3	27%	0.273	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	36.6	-179.7	-64.7	-35.9	0	0	0	113.9	R163 D207 R234	R163-D184 WeakPolarHBondContact CA-O 3.22Å; R163-D184 HydrophobicContact CG-CB 3.46Å; R163-D184 VanDerWaalsContact CG-CB 3.46Å; R163-D184 IonicContact NH1-OD2 2.69Å; D184-D207 PolarHBondContact N-O 2.91Å; D184-R234 IonicContact OD1-CZ 2.78Å; D184-R234 IonicContact OD1-NH1 3.21Å; D184-R234 PolarHBondContact OD1-NH1 3.27Å; D184-R234 IonicContact OD1-NH2 2.78Å; D184-R234 PolarHBondContact OD1-NH2 2.8Å; D184-R234 IonicContact OD2-NH1 2.75Å
185	N	98.4	Very high	96	Very high	7 Å²	7	44.6 Å²	44.6	4%	0.037	22%	0.224	C	C	.	.	S	Bend	trans	-99.8	-166.9	173.2	-87	-96.1	0	0	0	111	L161 N164 L166 L182 D183 I187 N209	L161-N185 PolarHBondContact O-ND2 3.28Å; N164-N185 WeakPolarHBondContact CA-OD1 3.08Å; N164-N185 WeakPolarHBondContact CB-OD1 3.09Å; N164-N185 PolarHBondContact N-OD1 2.84Å; N164-N185 PolarHBondContact O-OD1 3.23Å; L166-N185 HydrophobicContact CB-CB 4.3Å; L166-N185 VanDerWaalsContact CB-OD1 3.24Å; L166-N185 WeakPolarHBondContact CB-OD1 3.41Å; L166-N185 WeakPolarHBondContact CG-OD1 3.41Å; L166-N185 PolarHBondContact N-OD1 2.69Å; L166-N185 VanDerWaalsContact N-OD1 3.08Å; L182-N185 PolarHBondContact O-ND2 2.9Å; D183-N185 PolarHBondContact O-N 2.83Å; D183-N185 VanDerWaalsContact O-N 3.16Å; D183-N185 PolarHBondContact O-ND2 3.26Å; N185-I187 HydrophobicContact CB-CD1 4.28Å; N185-I187 HydrophobicContact CB-CG1 4.02Å; N185-N209 WeakPolarHBondContact CA-OD1 3.46Å; N185-N209 WeakPolarHBondContact CB-OD1 3.09Å; N185-N209 PolarHBondContact O-OD1 3.44Å
186	R	97.5	Very high	95.7	Very high	153 Å²	153	44 Å²	44	58%	0.577	22%	0.223	S	C	*	.			trans	-113.8	27.8	178	-56	-173.9	-173	-171.2	4.8	111.8	L166 S188 N209 L210	L166-R186 CarbonylContact O-C 3.58Å; L166-R186 VanDerWaalsContact O-CA 3.27Å; L166-R186 WeakPolarHBondContact O-CA 3.24Å; L166-R186 PolarHBondContact O-N 3.26Å; R186-S188 PolarHBondContact O-N 3.13Å; R186-N209 PolarHBondContact N-OD1 3.29Å; R186-L210 HydrophobicContact CB-CD1 4.14Å
187	I	98.1	Very high	95.5	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.23	C	C	.	.			trans	-66.4	120.5	-174.2	-58.8	173.6	0	0	0	108.7	L166 S167 I169 L182 N185 I190 L206 N209 L210 L211	L166-I187 HydrophobicContact CB-CD1 4.47Å; L166-I187 HydrophobicContact CB-CG1 4.13Å; L166-I187 PolarHBondContact O-N 2.72Å; L166-I187 VanDerWaalsContact O-N 3.11Å; S167-I187 WeakPolarHBondContact O-CA 3.06Å; I169-I187 HydrophobicContact CG1-CD1 4.32Å; L182-I187 HydrophobicContact CB-CD1 3.86Å; L182-I187 HydrophobicContact CD1-CD1 4.27Å; L182-I187 HydrophobicContact CD2-CD1 4.41Å; L182-I187 HydrophobicContact CG-CD1 4.43Å; N185-I187 HydrophobicContact CB-CD1 4.28Å; N185-I187 HydrophobicContact CB-CG1 4.02Å; I187-I190 HydrophobicContact CG2-CG1 4.11Å; I187-L206 HydrophobicContact CD1-CD2 3.92Å; I187-N209 HydrophobicContact CB-CB 4.26Å; I187-N209 WeakPolarHBondContact CB-OD1 3.45Å; I187-N209 VanDerWaalsContact CG1-OD1 3.32Å; I187-N209 WeakPolarHBondContact CG1-OD1 3.35Å; I187-N209 PolarHBondContact N-OD1 2.92Å; I187-L210 CarbonylContact O-C 3.55Å; I187-L210 VanDerWaalsContact O-CA 3.31Å; I187-L210 WeakPolarHBondContact O-CA 3.24Å; I187-L210 PolarHBondContact O-N 2.93Å; I187-L211 HydrophobicContact CB-CD2 4.5Å; I187-L211 HydrophobicContact CG2-CD2 3.74Å; I187-L211 HydrophobicContact CG2-CG 4.47Å; I187-L211 PolarHBondContact O-N 2.91Å
188	S	97.1	Very high	95.3	Very high	47 Å²	47	45.8 Å²	45.8	33%	0.329	23%	0.231	S	C	.	.			trans	-115.5	-21.8	179.3	56	0	0	0	0	112.9	S167 R186 G215	S167-S188 PolarHBondContact O-N 3.23Å; R186-S188 PolarHBondContact O-N 3.13Å; S188-G215 WeakPolarHBondContact O-CA 3.47Å
189	T	96.1	Very high	95.2	Very high	72 Å²	72	46.8 Å²	46.8	44%	0.442	24%	0.24	S	C	.	.	B	Isolated β-bridge	trans	-136.2	145.7	177.8	61.3	0	0	0	0	111.6	T168 G215	T168-T189 WeakPolarHBondContact CA-O 3.26Å; T168-T189 WeakPolarHBondContact CB-O 3.4Å; T168-T189 PolarHBondContact OG1-O 3.06Å; T189-G215 CarbonylContact C-O 3.57Å; T189-G215 WeakPolarHBondContact CA-O 3.46Å
190	I	96.1	Very high	95.1	Very high	4 Å²	4	48.5 Å²	48.5	2%	0.021	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-130.1	112.6	173.2	-47.1	179	0	0	0	108.4	I169 I187 S194 L195 L206 L211 G215 L216 G217 V220 F221	I169-I190 HydrophobicContact CB-CG2 4.49Å; I169-I190 HydrophobicContact CD1-CD1 4.04Å; I169-I190 HydrophobicContact CD1-CG1 4.19Å; I169-I190 HydrophobicContact CD1-CG2 3.63Å; I169-I190 HydrophobicContact CG1-CG1 4.27Å; I169-I190 HydrophobicContact CG1-CG2 3.99Å; I187-I190 HydrophobicContact CG2-CG1 4.11Å; I190-S194 WeakPolarHBondContact CG2-OG 3.42Å; I190-L195 HydrophobicContact CG2-CD1 4.13Å; I190-L195 HydrophobicContact CG2-CG 4.32Å; I190-L206 HydrophobicContact CD1-CD1 3.72Å; I190-L206 HydrophobicContact CD1-CD2 4.39Å; I190-L211 HydrophobicContact CD1-CD1 3.99Å; I190-L211 HydrophobicContact CD1-CD2 3.83Å; I190-L211 HydrophobicContact CG1-CD2 3.71Å; I190-G215 PolarHBondContact N-O 3.23Å; I190-L216 HydrophobicContact CD1-CD2 3.78Å; I190-L216 HydrophobicContact CG1-CD2 4.31Å; I190-G217 PolarHBondContact O-N 3.2Å; I190-V220 HydrophobicContact CB-CG2 4.05Å; I190-V220 HydrophobicContact CG2-CG2 3.46Å; I190-V220 VanDerWaalsContact CG2-CG2 3.46Å; I190-F221 HydrophobicContact CD1-CZ 4.46Å
191	S	91.5	Very high	95.1	Very high	63 Å²	63	48.5 Å²	48.5	44%	0.441	25%	0.25	S	S	.	.			trans	-73.9	140.9	174.8	178.5	0	0	0	0	110.9	L193 S194	S191-L193 PolarHBondContact O-N 3.45Å; S191-S194 WeakPolarHBondContact O-CB 3.44Å; S191-S194 PolarHBondContact O-N 3Å; S191-S194 PolarHBondContact O-OG 3.02Å
192	E	89.5	Confident	95	Very high	82 Å²	82	49.1 Å²	49.1	38%	0.383	26%	0.255	S	S	.	.	H	α-helix	trans	-54.7	-37.9	176.8	-58	-166.2	151.8	0	0	112.1	S194 L195 Q196 D218 K219	E192-S194 PolarHBondContact O-N 3.33Å; E192-L195 PolarHBondContact O-N 2.78Å; E192-Q196 WeakPolarHBondContact O-CB 3.37Å; E192-Q196 PolarHBondContact O-N 3.41Å; E192-Q196 VanDerWaalsContact O-N 3.09Å; E192-D218 PolarHBondContact OE1-N 3.32Å; E192-D218 VanDerWaalsContact OE1-N 3.12Å; E192-K219 PolarHBondContact OE1-N 2.79Å
193	L	88.3	Confident	95.1	Very high	128 Å²	128	52.5 Å²	52.5	67%	0.67	27%	0.268	S	S	*	.	H	α-helix	trans	-65.4	-23.3	179.7	-57.9	179	0	0	0	113.5	S191 Q196	S191-L193 PolarHBondContact O-N 3.45Å; L193-Q196 VanDerWaalsContact CD2-OE1 3.31Å
194	S	91.8	Very high	95.1	Very high	7 Å²	7	51.4 Å²	51.4	5%	0.049	26%	0.262	C	S	.	.	H	α-helix	trans	-72	-29.3	-177.4	66.8	0	0	0	0	113.3	I190 S191 E192	I190-S194 WeakPolarHBondContact CG2-OG 3.42Å; S191-S194 WeakPolarHBondContact O-CB 3.44Å; S191-S194 PolarHBondContact O-N 3Å; S191-S194 PolarHBondContact O-OG 3.02Å; E192-S194 PolarHBondContact O-N 3.33Å
195	L	93.8	Very high	95.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-114	-9.7	-178.9	-60.5	-174.5	0	0	0	113.4	I169 L180 I190 E192 D197 L198 L204 V220 F221 L224	I169-L195 HydrophobicContact CD1-CD1 4.18Å; I169-L195 HydrophobicContact CD1-CD2 3.93Å; I169-L195 HydrophobicContact CD1-CG 4.24Å; I169-L195 HydrophobicContact CG2-CD2 4.21Å; L180-L195 HydrophobicContact CD2-CD2 4.36Å; I190-L195 HydrophobicContact CG2-CD1 4.13Å; I190-L195 HydrophobicContact CG2-CG 4.32Å; E192-L195 PolarHBondContact O-N 2.78Å; L195-D197 PolarHBondContact O-N 2.94Å; L195-L198 HydrophobicContact CD2-CD1 3.71Å; L195-L198 PolarHBondContact O-N 3.24Å; L195-L198 VanDerWaalsContact O-N 3.11Å; L195-L204 HydrophobicContact CD1-CD2 3.89Å; L195-V220 HydrophobicContact CD1-CG2 4.15Å; L195-F221 HydrophobicContact CD1-CD1 4.09Å; L195-F221 HydrophobicContact CD1-CE1 4.02Å; L195-L224 HydrophobicContact CB-CD2 4.33Å; L195-L224 HydrophobicContact CD1-CD1 4.31Å; L195-L224 WeakPolarHBondContact O-CD2 3.35Å
196	Q	88.9	Confident	95.1	Very high	93 Å²	93	49 Å²	49	44%	0.435	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-39	-171.8	-172.1	177.8	15.2	0	0	114.5	E192 L193	E192-Q196 WeakPolarHBondContact O-CB 3.37Å; E192-Q196 PolarHBondContact O-N 3.41Å; E192-Q196 VanDerWaalsContact O-N 3.09Å; L193-Q196 VanDerWaalsContact CD2-OE1 3.31Å
197	D	90.6	Very high	95.1	Very high	79 Å²	79	43 Å²	43	42%	0.422	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-7.6	-171.6	-99.2	-33.5	0	0	0	114.3	K175 L195 T199	K175-D197 HydrophobicContact CD-CB 3.96Å; K175-D197 WeakPolarHBondContact CE-OD1 3.21Å; K175-D197 WeakPolarHBondContact CE-OD2 3.27Å; K175-D197 HydrophobicContact CG-CB 4.14Å; K175-D197 IonicContact NZ-OD1 2.69Å; K175-D197 PolarHBondContact NZ-OD1 3.09Å; K175-D197 IonicContact NZ-OD2 2.74Å; K175-D197 PolarHBondContact NZ-OD2 2.9Å; L195-D197 PolarHBondContact O-N 2.94Å; D197-T199 PolarHBondContact O-N 2.7Å
198	L	95.1	Very high	95.1	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.01	24%	0.236	C	C	.	.			trans	-81.4	51.9	-173	-58.1	-174.3	0	0	0	112.6	L173 P174 L180 L195 N200 L201 L224	L173-L198 HydrophobicContact CB-CD1 4.39Å; L173-L198 HydrophobicContact CB-CD2 4.07Å; L173-L198 HydrophobicContact CD1-CD1 4.21Å; P174-L198 VanDerWaalsContact O-CD2 3.26Å; P174-L198 WeakPolarHBondContact O-CD2 3.4Å; L180-L198 HydrophobicContact CD2-CD1 4.32Å; L195-L198 HydrophobicContact CD2-CD1 3.71Å; L195-L198 PolarHBondContact O-N 3.24Å; L195-L198 VanDerWaalsContact O-N 3.11Å; L198-N200 PolarHBondContact O-N 2.88Å; L198-L201 HydrophobicContact CB-CB 4.15Å; L198-L201 HydrophobicContact CB-CD2 4.46Å; L198-L201 HydrophobicContact CD1-CD2 4.42Å; L198-L201 WeakPolarHBondContact O-CB 3.25Å; L198-L201 PolarHBondContact O-N 2.96Å; L198-L224 HydrophobicContact CB-CD2 3.93Å; L198-L224 WeakPolarHBondContact O-CD2 3.39Å
199	T	95	Very high	95.2	Very high	63 Å²	63	41.8 Å²	41.8	39%	0.387	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-20.1	-175.3	54.9	0	0	0	0	114.2	D197 N226	D197-T199 PolarHBondContact O-N 2.7Å; T199-N226 WeakPolarHBondContact O-CB 3.24Å; T199-N226 PolarHBondContact O-ND2 2.88Å
200	N	96.8	Very high	95.3	Very high	68 Å²	68	43.1 Å²	43.1	36%	0.364	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-6.8	175.5	-67.8	-52.7	0	0	0	114.4	K175 I177 L198 K202	K175-N200 WeakPolarHBondContact O-CB 3.3Å; K175-N200 PolarHBondContact O-ND2 3.32Å; I177-N200 CarbonylContact O-C 3.1Å; I177-N200 VanDerWaalsContact O-C 3.31Å; L198-N200 PolarHBondContact O-N 2.88Å; N200-K202 PolarHBondContact O-N 3.24Å
201	L	98.3	Very high	95.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.225	C	C	.	.			trans	-64.6	120.7	-175.9	-172	66.9	0	0	0	110.7	I177 L180 L198 R203 L204 L224 N226 L227	I177-L201 HydrophobicContact CG2-CD1 3.78Å; I177-L201 VanDerWaalsContact O-CA 3.31Å; I177-L201 WeakPolarHBondContact O-CA 3.13Å; I177-L201 PolarHBondContact O-N 3.4Å; L180-L201 HydrophobicContact CB-CD1 3.75Å; L198-L201 HydrophobicContact CB-CB 4.15Å; L198-L201 HydrophobicContact CB-CD2 4.46Å; L198-L201 HydrophobicContact CD1-CD2 4.42Å; L198-L201 WeakPolarHBondContact O-CB 3.25Å; L198-L201 PolarHBondContact O-N 2.96Å; L201-R203 WeakPolarHBondContact CD1-O 3.48Å; L201-L204 HydrophobicContact CD2-CB 4.07Å; L201-L204 HydrophobicContact CD2-CD1 4.38Å; L201-L204 HydrophobicContact CD2-CD2 4.29Å; L201-L204 HydrophobicContact CD2-CG 4.49Å; L201-L224 HydrophobicContact CB-CD2 4.34Å; L201-L224 HydrophobicContact CD2-CD1 4.19Å; L201-L224 HydrophobicContact CD2-CD2 4.04Å; L201-N226 CarbonylContact O-C 3.37Å; L201-L227 HydrophobicContact CD2-CD1 4.37Å; L201-L227 HydrophobicContact CG-CD1 4.16Å; L201-L227 WeakPolarHBondContact O-CA 3.46Å; L201-L227 PolarHBondContact O-N 2.98Å
202	K	98.3	Very high	95.6	Very high	87 Å²	87	42.6 Å²	42.6	38%	0.378	22%	0.218	S	C	.	.			trans	-101.8	-30.1	-179.8	-63.3	171	-168.9	168.3	0	112	E178 N200 T228 E229	E178-K202 HydrophobicContact CB-CD 4.3Å; E178-K202 HydrophobicContact CG-CD 4.47Å; E178-K202 WeakPolarHBondContact O-CA 2.99Å; E178-K202 WeakPolarHBondContact O-CB 3.38Å; E178-K202 PolarHBondContact O-N 3.29Å; E178-K202 IonicContact OE1-NZ 3.25Å; E178-K202 WeakPolarHBondContact OE2-CE 3.4Å; E178-K202 IonicContact OE2-NZ 3.23Å; E178-K202 PolarHBondContact OE2-NZ 2.94Å; N200-K202 PolarHBondContact O-N 3.24Å; K202-T228 WeakPolarHBondContact O-CA 3.43Å; K202-T228 PolarHBondContact O-N 2.53Å; K202-T228 PolarHBondContact O-OG1 2.97Å; K202-E229 PolarHBondContact O-N 2.94Å; K202-E229 VanDerWaalsContact O-N 3.1Å
203	R	98.7	Very high	95.9	Very high	73 Å²	73	40.4 Å²	40.4	28%	0.275	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	123.8	-176.3	-179.9	169.4	-163.9	-124.1	1.5	110.8	E178 E179 L180 L201 V205 E229	E178-R203 PolarHBondContact O-N 3.06Å; E178-R203 VanDerWaalsContact O-N 3.07Å; E179-R203 WeakPolarHBondContact CA-O 3.23Å; E179-R203 HydrophobicContact CB-CB 4.4Å; E179-R203 HydrophobicContact CG-CB 3.93Å; E179-R203 HydrophobicContact CG-CG 4.01Å; E179-R203 IonicContact OE1-CZ 2.69Å; E179-R203 IonicContact OE1-NE 3.9Å; E179-R203 IonicContact OE1-NH1 3.49Å; E179-R203 PolarHBondContact OE1-NH1 3.03Å; L180-R203 PolarHBondContact N-O 3.42Å; L201-R203 WeakPolarHBondContact CD1-O 3.48Å; R203-V205 HydrophobicContact CG-CG2 4.15Å; R203-E229 WeakPolarHBondContact CA-O 3.25Å; R203-E229 HydrophobicContact CB-CB 4.46Å; R203-E229 HydrophobicContact CG-CB 4.17Å; R203-E229 HydrophobicContact CG-CG 4.4Å; R203-E229 IonicContact CZ-OE1 2.7Å; R203-E229 VanDerWaalsContact CZ-OE1 3.25Å; R203-E229 IonicContact NE-OE1 3.99Å; R203-E229 PolarHBondContact NE-OE1 3.35Å; R203-E229 IonicContact NE-OE2 2.75Å; R203-E229 IonicContact NH2-OE1 2.67Å; R203-E229 PolarHBondContact NH2-OE1 2.91Å
204	L	98.6	Very high	96.1	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	118.5	177.2	179.9	55.9	0	0	0	109.2	L180 L195 L201 L206 F221 L224 L227 E229 L230 S231	L180-L204 HydrophobicContact CB-CD1 4.1Å; L180-L204 HydrophobicContact CD2-CD1 4.03Å; L180-L204 HydrophobicContact CG-CD1 4.13Å; L195-L204 HydrophobicContact CD1-CD2 3.89Å; L201-L204 HydrophobicContact CD2-CB 4.07Å; L201-L204 HydrophobicContact CD2-CD1 4.38Å; L201-L204 HydrophobicContact CD2-CD2 4.29Å; L201-L204 HydrophobicContact CD2-CG 4.49Å; L204-L206 HydrophobicContact CD1-CD1 4.15Å; L204-L206 HydrophobicContact CD1-CG 4.1Å; L204-L206 HydrophobicContact CD2-CD1 3.88Å; L204-L206 HydrophobicContact CG-CD1 3.89Å; L204-L206 HydrophobicContact CG-CG 4.18Å; L204-F221 HydrophobicContact CD2-CD1 4.15Å; L204-F221 HydrophobicContact CD2-CE1 3.87Å; L204-L224 HydrophobicContact CD2-CD1 4.24Å; L204-L227 HydrophobicContact CB-CD1 3.92Å; L204-E229 PolarHBondContact N-O 2.94Å; L204-L230 HydrophobicContact CB-CD1 4.1Å; L204-L230 HydrophobicContact CD2-CD1 3.98Å; L204-L230 HydrophobicContact CG-CD1 4.08Å; L204-S231 PolarHBondContact O-N 2.7Å
205	V	98.7	Very high	96.2	Very high	8 Å²	8	43 Å²	43	5%	0.048	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	117.1	178.8	-169.3	0	0	0	0	108.7	L180 R181 L182 D183 R203 D207	L180-V205 PolarHBondContact O-N 2.78Å; R181-V205 HydrophobicContact CG-CB 4.23Å; R181-V205 HydrophobicContact CG-CG2 4.11Å; L182-V205 PolarHBondContact N-O 3.35Å; D183-V205 HydrophobicContact CB-CG1 3.99Å; R203-V205 HydrophobicContact CG-CG2 4.15Å; V205-D207 HydrophobicContact CG1-CB 4.25Å
206	L	98.4	Very high	96.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.223	C	C	.	.			trans	-125.6	26.4	-178.6	-76.3	163.1	0	0	0	110.9	I169 L182 I187 I190 L204 N209 L211 F221 S231 L232 N235	I169-L206 HydrophobicContact CD1-CD2 4.04Å; L182-L206 HydrophobicContact CB-CD2 3.82Å; L182-L206 HydrophobicContact CD1-CD2 3.88Å; I187-L206 HydrophobicContact CD1-CD2 3.92Å; I190-L206 HydrophobicContact CD1-CD1 3.72Å; I190-L206 HydrophobicContact CD1-CD2 4.39Å; L204-L206 HydrophobicContact CD1-CD1 4.15Å; L204-L206 HydrophobicContact CD1-CG 4.1Å; L204-L206 HydrophobicContact CD2-CD1 3.88Å; L204-L206 HydrophobicContact CG-CD1 3.89Å; L204-L206 HydrophobicContact CG-CG 4.18Å; L206-N209 PolarHBondContact O-ND2 3.04Å; L206-L211 HydrophobicContact CB-CD1 4.09Å; L206-L211 HydrophobicContact CD1-CD1 4.38Å; L206-F221 HydrophobicContact CD1-CE1 4.35Å; L206-S231 PolarHBondContact N-O 2.74Å; L206-L232 HydrophobicContact CB-CD2 3.81Å; L206-L232 HydrophobicContact CD1-CD2 3.95Å; L206-N235 PolarHBondContact O-ND2 3.1Å
207	D	98.4	Very high	96.3	Very high	28 Å²	28	40.6 Å²	40.6	15%	0.15	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	152.3	-172.1	-62.6	-15.3	0	0	0	111.7	D183 D184 V205 N209 S231 L232 V233	D183-D207 CarbonylContact C-O 3.59Å; D183-D207 WeakPolarHBondContact CA-O 3.5Å; D183-D207 HydrophobicContact CB-CB 4.02Å; D183-D207 WeakPolarHBondContact CB-O 3.43Å; D184-D207 PolarHBondContact N-O 2.91Å; V205-D207 HydrophobicContact CG1-CB 4.25Å; D207-N209 VanDerWaalsContact C-N 3.3Å; D207-N209 PolarHBondContact O-N 3.37Å; D207-N209 PolarHBondContact O-ND2 2.97Å; D207-N209 VanDerWaalsContact O-ND2 3.08Å; D207-S231 WeakPolarHBondContact OD1-CB 3.39Å; D207-S231 PolarHBondContact OD1-OG 3.16Å; D207-S231 WeakPolarHBondContact OD2-CB 3.49Å; D207-S231 PolarHBondContact OD2-OG 2.89Å; D207-L232 PolarHBondContact OD1-N 2.96Å; D207-L232 VanDerWaalsContact OD1-N 3.13Å; D207-V233 CarbonylContact C-O 3.58Å; D207-V233 WeakPolarHBondContact CA-O 3.32Å; D207-V233 HydrophobicContact CB-CB 3.99Å; D207-V233 VanDerWaalsContact CG-CB 3.48Å; D207-V233 WeakPolarHBondContact OD1-CB 3.28Å; D207-V233 PolarHBondContact OD1-N 2.85Å
208	G	98.1	Very high	96	Very high	15 Å²	15	42.9 Å²	42.9	16%	0.155	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.7	25.4	174.3	0	0	0	0	0	115.4	V233 R234	G208-V233 PolarHBondContact N-O 2.93Å; G208-R234 CarbonylContact C-O 3.52Å; G208-R234 VanDerWaalsContact CA-O 3.24Å; G208-R234 WeakPolarHBondContact CA-O 3.26Å; G208-R234 PolarHBondContact N-O 2.88Å
209	N	98.6	Very high	95.7	Very high	5 Å²	5	48.5 Å²	48.5	3%	0.027	25%	0.251	C	S	.	.	S	Bend	trans	-103.6	-178.5	-178.8	-84	-80.6	0	0	0	112.5	L182 N185 R186 I187 L206 D207 L211 R234 N235	L182-N209 PolarHBondContact O-ND2 3.09Å; N185-N209 WeakPolarHBondContact CA-OD1 3.46Å; N185-N209 WeakPolarHBondContact CB-OD1 3.09Å; N185-N209 PolarHBondContact O-OD1 3.44Å; R186-N209 PolarHBondContact N-OD1 3.29Å; I187-N209 HydrophobicContact CB-CB 4.26Å; I187-N209 WeakPolarHBondContact CB-OD1 3.45Å; I187-N209 VanDerWaalsContact CG1-OD1 3.32Å; I187-N209 WeakPolarHBondContact CG1-OD1 3.35Å; I187-N209 PolarHBondContact N-OD1 2.92Å; L206-N209 PolarHBondContact O-ND2 3.04Å; D207-N209 VanDerWaalsContact C-N 3.3Å; D207-N209 PolarHBondContact O-N 3.37Å; D207-N209 PolarHBondContact O-ND2 2.97Å; D207-N209 VanDerWaalsContact O-ND2 3.08Å; N209-L211 HydrophobicContact CB-CD1 4.47Å; N209-L211 HydrophobicContact CB-CG 4.23Å; N209-R234 PolarHBondContact N-O 2.85Å; N209-N235 WeakPolarHBondContact CA-OD1 3.43Å; N209-N235 WeakPolarHBondContact CB-OD1 3.46Å; N209-N235 PolarHBondContact O-OD1 3.29Å; N209-N235 VanDerWaalsContact O-OD1 3.12Å
210	L	97.8	Very high	95.7	Very high	100 Å²	100	45.9 Å²	45.9	52%	0.524	23%	0.234	S	C	.	.			trans	-99.1	23.5	-178.9	-57.3	178	0	0	0	112.4	R186 I187	R186-L210 HydrophobicContact CB-CD1 4.14Å; I187-L210 CarbonylContact O-C 3.55Å; I187-L210 VanDerWaalsContact O-CA 3.31Å; I187-L210 WeakPolarHBondContact O-CA 3.24Å; I187-L210 PolarHBondContact O-N 2.93Å
211	L	97.7	Very high	95.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.218	C	C	.	.			trans	-70.2	135.9	-175.1	-62.1	168.7	0	0	0	111.4	I187 I190 L206 N209 L216 L232 N235 S236 L237	I187-L211 HydrophobicContact CB-CD2 4.5Å; I187-L211 HydrophobicContact CG2-CD2 3.74Å; I187-L211 HydrophobicContact CG2-CG 4.47Å; I187-L211 PolarHBondContact O-N 2.91Å; I190-L211 HydrophobicContact CD1-CD1 3.99Å; I190-L211 HydrophobicContact CD1-CD2 3.83Å; I190-L211 HydrophobicContact CG1-CD2 3.71Å; L206-L211 HydrophobicContact CB-CD1 4.09Å; L206-L211 HydrophobicContact CD1-CD1 4.38Å; N209-L211 HydrophobicContact CB-CD1 4.47Å; N209-L211 HydrophobicContact CB-CG 4.23Å; L211-L216 HydrophobicContact CD2-CD2 4.36Å; L211-L232 HydrophobicContact CD1-CD2 3.7Å; L211-N235 HydrophobicContact CB-CB 4.4Å; L211-N235 WeakPolarHBondContact CB-OD1 3.24Å; L211-N235 WeakPolarHBondContact CG-OD1 3.4Å; L211-N235 PolarHBondContact N-OD1 3.15Å; L211-N235 VanDerWaalsContact N-OD1 3.11Å; L211-S236 CarbonylContact O-C 3.31Å; L211-S236 WeakPolarHBondContact O-CA 3.2Å; L211-S236 WeakPolarHBondContact O-CB 3.33Å; L211-S236 PolarHBondContact O-N 3.44Å; L211-L237 PolarHBondContact O-N 2.79Å
212	N	96.4	Very high	95.3	Very high	56 Å²	56	47.6 Å²	47.6	30%	0.299	24%	0.241	S	C	.	.			trans	-128	170.7	167.9	67.9	60.8	0	0	0	109.2	H214 G215	N212-H214 PolarHBondContact O-N 3.14Å; N212-H214 WeakPolarHBondContact OD1-CA 3.41Å; N212-H214 WeakPolarHBondContact OD1-CB 3.26Å; N212-H214 PolarHBondContact OD1-N 2.72Å; N212-G215 PolarHBondContact O-N 3.31Å; N212-G215 PolarHBondContact OD1-N 2.9Å; N212-G215 VanDerWaalsContact OD1-N 3.07Å
213	N	94.8	Very high	95	Very high	37 Å²	37	46.8 Å²	46.8	20%	0.198	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.9	-176.5	-63.6	99.9	0	0	0	114.8	T238 A239	N213-T238 WeakPolarHBondContact OD1-CA 3.48Å; N213-T238 PolarHBondContact OD1-N 2.93Å; N213-T238 PolarHBondContact OD1-OG1 2.92Å; N213-A239 PolarHBondContact ND2-O 3.48Å; N213-A239 PolarHBondContact OD1-N 3.27Å
214	H	93.7	Very high	94.8	Very high	181 Å²	181	43.3 Å²	43.3	84%	0.838	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-20.4	176.1	-56.7	-74.3	0	0	0	112.5	N212 L216	N212-H214 PolarHBondContact O-N 3.14Å; N212-H214 WeakPolarHBondContact OD1-CA 3.41Å; N212-H214 WeakPolarHBondContact OD1-CB 3.26Å; N212-H214 PolarHBondContact OD1-N 2.72Å; H214-L216 VanDerWaalsContact C-N 3.34Å
215	G	93.4	Very high	94.6	Very high	7 Å²	7	46.3 Å²	46.3	7%	0.072	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-13.2	173.6	0	0	0	0	0	113.9	S188 T189 I190 N212	S188-G215 WeakPolarHBondContact O-CA 3.47Å; T189-G215 CarbonylContact C-O 3.57Å; T189-G215 WeakPolarHBondContact CA-O 3.46Å; I190-G215 PolarHBondContact N-O 3.23Å; N212-G215 PolarHBondContact O-N 3.31Å; N212-G215 PolarHBondContact OD1-N 2.9Å; N212-G215 VanDerWaalsContact OD1-N 3.07Å
216	L	94.8	Very high	94.6	Very high	20 Å²	20	48.9 Å²	48.9	11%	0.105	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-92.5	123.1	175.8	-60.4	178	0	0	0	109.8	I190 L211 H214 V220 F221 L237 P241	I190-L216 HydrophobicContact CD1-CD2 3.78Å; I190-L216 HydrophobicContact CG1-CD2 4.31Å; L211-L216 HydrophobicContact CD2-CD2 4.36Å; H214-L216 VanDerWaalsContact C-N 3.34Å; L216-V220 HydrophobicContact CB-CG1 4.5Å; L216-F221 HydrophobicContact CD1-CE2 4.36Å; L216-F221 HydrophobicContact CD2-CE2 4.19Å; L216-F221 HydrophobicContact CD2-CZ 4.01Å; L216-L237 HydrophobicContact CD1-CD2 3.88Å; L216-P241 HydrophobicContact CD1-CB 4.33Å
217	G	89.3	Confident	94.5	Very high	23 Å²	23	48.9 Å²	48.9	24%	0.237	26%	0.26	C	S	.	.			trans	-63.3	145.2	168.6	0	0	0	0	0	112.1	I190 K219 V220	I190-G217 PolarHBondContact O-N 3.2Å; G217-K219 PolarHBondContact O-N 2.78Å; G217-V220 WeakPolarHBondContact O-CB 3.4Å; G217-V220 VanDerWaalsContact O-CG1 3.24Å; G217-V220 WeakPolarHBondContact O-CG1 3.39Å; G217-V220 PolarHBondContact O-N 2.75Å; G217-V220 VanDerWaalsContact O-N 3.13Å
218	D	84.4	Confident	94.5	Very high	127 Å²	127	49.8 Å²	49.8	68%	0.679	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-34.9	-170.8	-78.3	-21.9	0	0	0	114.1	E192 N243	E192-D218 PolarHBondContact OE1-N 3.32Å; E192-D218 VanDerWaalsContact OE1-N 3.12Å; D218-N243 PolarHBondContact O-ND2 3.3Å
219	K	89.7	Confident	94.6	Very high	121 Å²	121	49.9 Å²	49.9	53%	0.526	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	18.5	-177.4	-65.8	177.3	-177.3	171.1	0	113.5	E192 G217 F221 M222	E192-K219 PolarHBondContact OE1-N 2.79Å; G217-K219 PolarHBondContact O-N 2.78Å; K219-F221 PolarHBondContact O-N 2.67Å; K219-M222 HydrophobicContact CB-CB 4.09Å; K219-M222 HydrophobicContact CB-SD 4.33Å; K219-M222 HydrophobicContact CD-SD 3.95Å; K219-M222 HydrophobicContact CG-SD 4.02Å; K219-M222 VanDerWaalsContact O-CB 3.31Å; K219-M222 WeakPolarHBondContact O-CB 3.47Å; K219-M222 PolarHBondContact O-N 3.47Å
220	V	94.1	Very high	94.6	Very high	8 Å²	8	49.6 Å²	49.6	5%	0.048	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-30.5	-171.3	71.2	0	0	0	0	114.8	I190 L195 L216 G217	I190-V220 HydrophobicContact CB-CG2 4.05Å; I190-V220 HydrophobicContact CG2-CG2 3.46Å; I190-V220 VanDerWaalsContact CG2-CG2 3.46Å; L195-V220 HydrophobicContact CD1-CG2 4.15Å; L216-V220 HydrophobicContact CB-CG1 4.5Å; G217-V220 WeakPolarHBondContact O-CB 3.4Å; G217-V220 VanDerWaalsContact O-CG1 3.24Å; G217-V220 WeakPolarHBondContact O-CG1 3.39Å; G217-V220 PolarHBondContact O-N 2.75Å; G217-V220 VanDerWaalsContact O-N 3.13Å
221	F	95	Very high	94.6	Very high	5 Å²	5	45.1 Å²	45.1	2%	0.022	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-8.6	177.6	-52.9	-60.4	0	0	0	114.3	I190 L195 L204 L206 L216 K219 N223 L224 L230 L232 L244 P245	I190-F221 HydrophobicContact CD1-CZ 4.46Å; L195-F221 HydrophobicContact CD1-CD1 4.09Å; L195-F221 HydrophobicContact CD1-CE1 4.02Å; L204-F221 HydrophobicContact CD2-CD1 4.15Å; L204-F221 HydrophobicContact CD2-CE1 3.87Å; L206-F221 HydrophobicContact CD1-CE1 4.35Å; L216-F221 HydrophobicContact CD1-CE2 4.36Å; L216-F221 HydrophobicContact CD2-CE2 4.19Å; L216-F221 HydrophobicContact CD2-CZ 4.01Å; K219-F221 PolarHBondContact O-N 2.67Å; F221-N223 VanDerWaalsContact C-N 3.3Å; F221-N223 PolarHBondContact O-N 3.16Å; F221-L224 HydrophobicContact CB-CD1 4.28Å; F221-L224 HydrophobicContact CD1-CD1 3.97Å; F221-L224 WeakPolarHBondContact O-CB 3.2Å; F221-L224 PolarHBondContact O-N 2.69Å; F221-L224 VanDerWaalsContact O-N 3.16Å; F221-L230 HydrophobicContact CD2-CD2 4.49Å; F221-L230 HydrophobicContact CE1-CD1 4.31Å; F221-L232 HydrophobicContact CZ-CD1 4.47Å; F221-L244 HydrophobicContact CB-CD2 4.35Å; F221-L244 HydrophobicContact CD2-CD2 3.86Å; F221-L244 HydrophobicContact CG-CD2 4.38Å; F221-P245 WeakPolarHBondContact O-CD 3.38Å; F221-P245 WeakPolarHBondContact O-CG 3.13Å
222	M	92.1	Very high	94.6	Very high	98 Å²	98	45.1 Å²	45.1	48%	0.483	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-33.3	-166.1	-173.7	178.6	175.7	0	0	113.2	K219	K219-M222 HydrophobicContact CB-CB 4.09Å; K219-M222 HydrophobicContact CB-SD 4.33Å; K219-M222 HydrophobicContact CD-SD 3.95Å; K219-M222 HydrophobicContact CG-SD 4.02Å; K219-M222 VanDerWaalsContact O-CB 3.31Å; K219-M222 WeakPolarHBondContact O-CB 3.47Å; K219-M222 PolarHBondContact O-N 3.47Å
223	N	91.8	Very high	94.7	Very high	71 Å²	71	43 Å²	43	38%	0.38	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-0.9	-177.6	-65.5	-13.1	0	0	0	113.9	F221 V225	F221-N223 VanDerWaalsContact C-N 3.3Å; F221-N223 PolarHBondContact O-N 3.16Å; N223-V225 PolarHBondContact O-N 2.7Å
224	L	95.8	Very high	94.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.239	C	C	.	.			trans	-80.8	63.7	180	-55.7	176.1	0	0	0	110.3	L195 L198 L201 L204 F221 N226 L227 P245	L195-L224 HydrophobicContact CB-CD2 4.33Å; L195-L224 HydrophobicContact CD1-CD1 4.31Å; L195-L224 WeakPolarHBondContact O-CD2 3.35Å; L198-L224 HydrophobicContact CB-CD2 3.93Å; L198-L224 WeakPolarHBondContact O-CD2 3.39Å; L201-L224 HydrophobicContact CB-CD2 4.34Å; L201-L224 HydrophobicContact CD2-CD1 4.19Å; L201-L224 HydrophobicContact CD2-CD2 4.04Å; L204-L224 HydrophobicContact CD2-CD1 4.24Å; F221-L224 HydrophobicContact CB-CD1 4.28Å; F221-L224 HydrophobicContact CD1-CD1 3.97Å; F221-L224 WeakPolarHBondContact O-CB 3.2Å; F221-L224 PolarHBondContact O-N 2.69Å; F221-L224 VanDerWaalsContact O-N 3.16Å; L224-N226 PolarHBondContact O-N 3.49Å; L224-L227 HydrophobicContact CB-CB 3.88Å; L224-L227 HydrophobicContact CB-CD2 4.24Å; L224-L227 HydrophobicContact CD1-CD2 4.03Å; L224-L227 WeakPolarHBondContact O-CB 3.39Å; L224-L227 PolarHBondContact O-N 2.82Å; L224-P245 HydrophobicContact CB-CG 4.35Å; L224-P245 WeakPolarHBondContact O-CB 3.2Å
225	V	94.5	Very high	95.1	Very high	63 Å²	63	38.5 Å²	38.5	38%	0.382	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-32.6	-168.7	-178.8	0	0	0	0	113	N223 T247 N248	N223-V225 PolarHBondContact O-N 2.7Å; V225-T247 HydrophobicContact CG1-CG2 3.96Å; V225-N248 PolarHBondContact O-ND2 3.3Å
226	N	97.2	Very high	95.3	Very high	61 Å²	61	40.6 Å²	40.6	33%	0.326	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	4.1	178.6	-69.7	-41.8	0	0	0	114.3	T199 L201 L224 T228	T199-N226 WeakPolarHBondContact O-CB 3.24Å; T199-N226 PolarHBondContact O-ND2 2.88Å; L201-N226 CarbonylContact O-C 3.37Å; L224-N226 PolarHBondContact O-N 3.49Å; N226-T228 WeakPolarHBondContact O-CG2 3.45Å; N226-T228 PolarHBondContact O-N 3.4Å
227	L	98.1	Very high	95.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.21	C	C	.	.			trans	-64.6	124.7	-176.7	-166.1	69.9	0	0	0	110.8	L201 L204 L224 L230 P245 N248 L249	L201-L227 HydrophobicContact CD2-CD1 4.37Å; L201-L227 HydrophobicContact CG-CD1 4.16Å; L201-L227 WeakPolarHBondContact O-CA 3.46Å; L201-L227 PolarHBondContact O-N 2.98Å; L204-L227 HydrophobicContact CB-CD1 3.92Å; L224-L227 HydrophobicContact CB-CB 3.88Å; L224-L227 HydrophobicContact CB-CD2 4.24Å; L224-L227 HydrophobicContact CD1-CD2 4.03Å; L224-L227 WeakPolarHBondContact O-CB 3.39Å; L224-L227 PolarHBondContact O-N 2.82Å; L227-L230 HydrophobicContact CD2-CB 4.1Å; L227-P245 HydrophobicContact CB-CG 4.02Å; L227-P245 HydrophobicContact CD2-CG 3.86Å; L227-N248 CarbonylContact O-C 3.55Å; L227-L249 HydrophobicContact CD2-CD1 4.26Å; L227-L249 HydrophobicContact CG-CD1 4.23Å; L227-L249 WeakPolarHBondContact O-CA 3.42Å; L227-L249 PolarHBondContact O-N 2.8Å
228	T	98.2	Very high	95.9	Very high	48 Å²	48	40.8 Å²	40.8	29%	0.294	21%	0.212	S	C	.	.			trans	-109.6	-30.4	-179.5	66.3	0	0	0	0	113	K202 N226 N248 R250 K251	K202-T228 WeakPolarHBondContact O-CA 3.43Å; K202-T228 PolarHBondContact O-N 2.53Å; K202-T228 PolarHBondContact O-OG1 2.97Å; N226-T228 WeakPolarHBondContact O-CG2 3.45Å; N226-T228 PolarHBondContact O-N 3.4Å; T228-N248 HydrophobicContact CG2-CB 4.49Å; T228-R250 PolarHBondContact O-N 2.86Å; T228-K251 PolarHBondContact O-N 2.83Å
229	E	98.6	Very high	96.5	Very high	16 Å²	16	35 Å²	35	8%	0.075	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	122.1	-177.3	-175.9	170.7	132.3	0	0	109.5	K202 R203 L204 K251 Y253	K202-E229 PolarHBondContact O-N 2.94Å; K202-E229 VanDerWaalsContact O-N 3.1Å; R203-E229 WeakPolarHBondContact CA-O 3.25Å; R203-E229 HydrophobicContact CB-CB 4.46Å; R203-E229 HydrophobicContact CG-CB 4.17Å; R203-E229 HydrophobicContact CG-CG 4.4Å; R203-E229 IonicContact CZ-OE1 2.7Å; R203-E229 VanDerWaalsContact CZ-OE1 3.25Å; R203-E229 IonicContact NE-OE1 3.99Å; R203-E229 PolarHBondContact NE-OE1 3.35Å; R203-E229 IonicContact NE-OE2 2.75Å; R203-E229 IonicContact NH2-OE1 2.67Å; R203-E229 PolarHBondContact NH2-OE1 2.91Å; L204-E229 PolarHBondContact N-O 2.94Å; E229-K251 WeakPolarHBondContact CA-O 3.43Å; E229-K251 HydrophobicContact CB-CB 4.29Å; E229-K251 HydrophobicContact CB-CD 4.27Å; E229-K251 HydrophobicContact CG-CB 4.02Å; E229-K251 HydrophobicContact CG-CD 3.96Å; E229-K251 WeakPolarHBondContact OE2-CD 3.16Å; E229-K251 WeakPolarHBondContact OE2-CE 3.24Å; E229-K251 IonicContact OE2-NZ 2.7Å; E229-K251 PolarHBondContact OE2-NZ 3.46Å; E229-Y253 HydrophobicContact CG-CD2 4.33Å; E229-Y253 HydrophobicContact CG-CE2 3.9Å
230	L	98.6	Very high	96.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	122.7	172.1	178.1	59.6	0	0	0	109	L204 F221 L227 L232 L244 L249 K251 L252 Y253	L204-L230 HydrophobicContact CB-CD1 4.1Å; L204-L230 HydrophobicContact CD2-CD1 3.98Å; L204-L230 HydrophobicContact CG-CD1 4.08Å; F221-L230 HydrophobicContact CD2-CD2 4.49Å; F221-L230 HydrophobicContact CE1-CD1 4.31Å; L227-L230 HydrophobicContact CD2-CB 4.1Å; L230-L232 HydrophobicContact CD1-CD1 4.38Å; L230-L232 HydrophobicContact CD1-CG 4.26Å; L230-L232 HydrophobicContact CD2-CD1 4.04Å; L230-L232 HydrophobicContact CG-CD1 4.14Å; L230-L232 HydrophobicContact CG-CG 4.32Å; L230-L244 HydrophobicContact CD2-CD2 3.67Å; L230-L249 HydrophobicContact CB-CD1 4.04Å; L230-K251 PolarHBondContact N-O 2.61Å; L230-K251 VanDerWaalsContact N-O 3.09Å; L230-L252 HydrophobicContact CB-CD1 4.08Å; L230-L252 HydrophobicContact CD2-CD1 3.96Å; L230-L252 HydrophobicContact CG-CD1 4.11Å; L230-Y253 PolarHBondContact O-N 2.91Å
231	S	98.6	Very high	96.9	Very high	6 Å²	6	29.3 Å²	29.3	4%	0.042	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	122.8	176.9	-144.6	0	0	0	0	110.2	L204 L206 D207	L204-S231 PolarHBondContact O-N 2.7Å; L206-S231 PolarHBondContact N-O 2.74Å; D207-S231 WeakPolarHBondContact OD1-CB 3.39Å; D207-S231 PolarHBondContact OD1-OG 3.16Å; D207-S231 WeakPolarHBondContact OD2-CB 3.49Å; D207-S231 PolarHBondContact OD2-OG 2.89Å
232	L	98.3	Very high	96.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.17	C	C	.	.			trans	-131.4	34.3	178.1	-71.1	163	0	0	0	110.2	L206 D207 L211 F221 L230 N235 L237 P241 Y253 L254 N257	L206-L232 HydrophobicContact CB-CD2 3.81Å; L206-L232 HydrophobicContact CD1-CD2 3.95Å; D207-L232 PolarHBondContact OD1-N 2.96Å; D207-L232 VanDerWaalsContact OD1-N 3.13Å; L211-L232 HydrophobicContact CD1-CD2 3.7Å; F221-L232 HydrophobicContact CZ-CD1 4.47Å; L230-L232 HydrophobicContact CD1-CD1 4.38Å; L230-L232 HydrophobicContact CD1-CG 4.26Å; L230-L232 HydrophobicContact CD2-CD1 4.04Å; L230-L232 HydrophobicContact CG-CD1 4.14Å; L230-L232 HydrophobicContact CG-CG 4.32Å; L232-N235 PolarHBondContact O-ND2 3.24Å; L232-L237 HydrophobicContact CB-CD1 4.11Å; L232-L237 HydrophobicContact CD1-CD1 4.26Å; L232-P241 HydrophobicContact CD1-CG 4.26Å; L232-Y253 PolarHBondContact N-O 3.26Å; L232-L254 HydrophobicContact CB-CD2 4.11Å; L232-L254 HydrophobicContact CD1-CD2 4.11Å; L232-N257 PolarHBondContact O-ND2 3.04Å
233	V	98.6	Very high	96.9	Very high	12 Å²	12	29.4 Å²	29.4	7%	0.073	16%	0.162	C	C	.	.			trans	-67.5	153.1	-176.4	178.5	0	0	0	0	110.8	D207 G208 N235 Q255	D207-V233 CarbonylContact C-O 3.58Å; D207-V233 WeakPolarHBondContact CA-O 3.32Å; D207-V233 HydrophobicContact CB-CB 3.99Å; D207-V233 VanDerWaalsContact CG-CB 3.48Å; D207-V233 WeakPolarHBondContact OD1-CB 3.28Å; D207-V233 PolarHBondContact OD1-N 2.85Å; G208-V233 PolarHBondContact N-O 2.93Å; V233-N235 VanDerWaalsContact C-N 3.31Å; V233-N235 PolarHBondContact O-N 3.34Å; V233-N235 PolarHBondContact O-ND2 2.82Å; V233-Q255 VanDerWaalsContact CA-O 3.31Å; V233-Q255 WeakPolarHBondContact CA-O 3.2Å; V233-Q255 HydrophobicContact CB-CG 4.5Å; V233-Q255 HydrophobicContact CG1-CG 3.86Å; V233-Q255 VanDerWaalsContact CG2-CD 3.42Å; V233-Q255 HydrophobicContact CG2-CG 4Å
234	R	98.2	Very high	97.1	Very high	116 Å²	116	26.8 Å²	26.8	44%	0.438	15%	0.148	S	C	.	.	S	Bend	trans	53.1	47.1	173.9	-73.8	166.7	51.9	-120.8	-10.4	112.6	D184 G208 N209 Q255 E256	D184-R234 IonicContact OD1-CZ 2.78Å; D184-R234 IonicContact OD1-NH1 3.21Å; D184-R234 PolarHBondContact OD1-NH1 3.27Å; D184-R234 IonicContact OD1-NH2 2.78Å; D184-R234 PolarHBondContact OD1-NH2 2.8Å; D184-R234 IonicContact OD2-NH1 2.75Å; G208-R234 CarbonylContact C-O 3.52Å; G208-R234 VanDerWaalsContact CA-O 3.24Å; G208-R234 WeakPolarHBondContact CA-O 3.26Å; G208-R234 PolarHBondContact N-O 2.88Å; N209-R234 PolarHBondContact N-O 2.85Å; R234-Q255 PolarHBondContact N-O 3.43Å; R234-Q255 VanDerWaalsContact N-O 3.14Å; R234-E256 WeakPolarHBondContact CA-O 3.13Å; R234-E256 HydrophobicContact CG-CB 3.86Å; R234-E256 WeakPolarHBondContact CG-OE2 3.45Å; R234-E256 PolarHBondContact N-O 3.32Å
235	N	98.4	Very high	97.1	Very high	6 Å²	6	27.1 Å²	27.1	3%	0.032	15%	0.15	C	C	.	.	S	Bend	trans	-121.4	-179.9	177.5	-86.7	-87	0	0	0	110.3	L206 N209 L211 L232 V233 L237 E256 N257	L206-N235 PolarHBondContact O-ND2 3.1Å; N209-N235 WeakPolarHBondContact CA-OD1 3.43Å; N209-N235 WeakPolarHBondContact CB-OD1 3.46Å; N209-N235 PolarHBondContact O-OD1 3.29Å; N209-N235 VanDerWaalsContact O-OD1 3.12Å; L211-N235 HydrophobicContact CB-CB 4.4Å; L211-N235 WeakPolarHBondContact CB-OD1 3.24Å; L211-N235 WeakPolarHBondContact CG-OD1 3.4Å; L211-N235 PolarHBondContact N-OD1 3.15Å; L211-N235 VanDerWaalsContact N-OD1 3.11Å; L232-N235 PolarHBondContact O-ND2 3.24Å; V233-N235 VanDerWaalsContact C-N 3.31Å; V233-N235 PolarHBondContact O-N 3.34Å; V233-N235 PolarHBondContact O-ND2 2.82Å; N235-L237 HydrophobicContact CB-CG 4.41Å; N235-E256 PolarHBondContact N-O 3.45Å; N235-N257 WeakPolarHBondContact CA-OD1 3.42Å; N235-N257 WeakPolarHBondContact CB-OD1 3.16Å; N235-N257 WeakPolarHBondContact O-CA 3.13Å; N235-N257 PolarHBondContact O-OD1 3.48Å; N235-N257 VanDerWaalsContact O-OD1 3.07Å
236	S	97.8	Very high	96.9	Very high	52 Å²	52	25 Å²	25	36%	0.364	14%	0.14	S	C	.	.			trans	-103.5	33.7	-179.4	-63.8	0	0	0	0	113.1	L211	L211-S236 CarbonylContact O-C 3.31Å; L211-S236 WeakPolarHBondContact O-CA 3.2Å; L211-S236 WeakPolarHBondContact O-CB 3.33Å; L211-S236 PolarHBondContact O-N 3.44Å
237	L	98	Very high	96.7	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.15	C	C	.	.			trans	-70	133.4	178.1	-57.6	176.1	0	0	0	110.9	L211 L216 L232 N235 L254 N257 H258 I259	L211-L237 PolarHBondContact O-N 2.79Å; L216-L237 HydrophobicContact CD1-CD2 3.88Å; L232-L237 HydrophobicContact CB-CD1 4.11Å; L232-L237 HydrophobicContact CD1-CD1 4.26Å; N235-L237 HydrophobicContact CB-CG 4.41Å; L237-L254 HydrophobicContact CD1-CD2 4.23Å; L237-N257 HydrophobicContact CB-CB 4.31Å; L237-N257 WeakPolarHBondContact CB-OD1 3.37Å; L237-N257 VanDerWaalsContact CG-OD1 3.26Å; L237-N257 WeakPolarHBondContact CG-OD1 3.2Å; L237-N257 PolarHBondContact N-OD1 2.91Å; L237-H258 CarbonylContact O-C 3.25Å; L237-H258 VanDerWaalsContact O-CA 3.27Å; L237-H258 WeakPolarHBondContact O-CA 3.32Å; L237-H258 PolarHBondContact O-N 2.8Å; L237-I259 HydrophobicContact CB-CG1 4.12Å; L237-I259 PolarHBondContact O-N 2.86Å
238	T	97.4	Very high	96.6	Very high	47 Å²	47	28.3 Å²	28.3	29%	0.288	16%	0.161	S	C	.	.	S	Bend	trans	-102.6	-16.5	177.8	73.5	0	0	0	0	113.4	N213 I259 N260 R261	N213-T238 WeakPolarHBondContact OD1-CA 3.48Å; N213-T238 PolarHBondContact OD1-N 2.93Å; N213-T238 PolarHBondContact OD1-OG1 2.92Å; T238-I259 WeakPolarHBondContact O-CA 3.21Å; T238-N260 PolarHBondContact O-N 2.73Å; T238-N260 PolarHBondContact O-OD1 2.75Å; T238-N260 VanDerWaalsContact O-OD1 3.05Å; T238-R261 PolarHBondContact O-NH1 3.04Å; T238-R261 PolarHBondContact OG1-NH1 2.8Å
239	A	97.4	Very high	96.6	Very high	5 Å²	5	26 Å²	26	4%	0.041	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-138.4	151.7	174.8	0	0	0	0	0	109.8	N213 R261 P263	N213-A239 PolarHBondContact ND2-O 3.48Å; N213-A239 PolarHBondContact OD1-N 3.27Å; A239-R261 VanDerWaalsContact CA-O 3.27Å; A239-R261 WeakPolarHBondContact CA-O 3.24Å; A239-R261 HydrophobicContact CB-CG 3.78Å; A239-P263 HydrophobicContact CB-CG 4.44Å
240	A	97.2	Very high	96.6	Very high	2 Å²	2	30.7 Å²	30.7	2%	0.017	16%	0.164	C	C	.	.			trans	-61	137.6	170.2	0	0	0	0	0	110.1	L254 R261 V262 A266 F267	A240-L254 HydrophobicContact CB-CD1 4.41Å; A240-R261 PolarHBondContact N-O 2.82Å; A240-V262 HydrophobicContact CB-CG1 4.05Å; A240-V262 HydrophobicContact CB-CG2 4.46Å; A240-A266 HydrophobicContact CB-CB 3.99Å; A240-F267 HydrophobicContact CB-CE1 4.27Å; A240-F267 HydrophobicContact CB-CZ 3.93Å
241	P	95.6	Very high	96.6	Very high	7 Å²	7	34.3 Å²	34.3	5%	0.045	18%	0.18	C	C	.	.			trans	-64.9	149.9	179.8	26.3	-33.2	0	0	0	111.5	L216 L232 L244 L254	L216-P241 HydrophobicContact CD1-CB 4.33Å; L232-P241 HydrophobicContact CD1-CG 4.26Å; P241-L244 HydrophobicContact CB-CD2 4.29Å; P241-L244 HydrophobicContact CG-CD1 4.26Å; P241-L244 HydrophobicContact CG-CD2 4.16Å; P241-L244 HydrophobicContact CG-CG 4.48Å; P241-L254 HydrophobicContact CG-CD2 4.16Å
242	V	93.8	Very high	96.6	Very high	47 Å²	47	34 Å²	34	29%	0.285	18%	0.178	S	C	.	.	S	Bend	trans	-106.3	171.9	177.4	-64	0	0	0	0	110.5	L244 P263 A266	V242-L244 PolarHBondContact O-N 3.21Å; V242-P263 HydrophobicContact CG1-CB 3.87Å; V242-P263 HydrophobicContact CG1-CG 3.97Å; V242-A266 HydrophobicContact CG1-CB 4.43Å
243	N	93.9	Very high	96.6	Very high	59 Å²	59	35.4 Å²	35.4	32%	0.316	18%	0.184	S	C	.	.	S	Bend	trans	57.4	32.9	175.9	-53.9	-33.3	0	0	0	114.1	D218	D218-N243 PolarHBondContact O-ND2 3.3Å
244	L	95.6	Very high	96.6	Very high	16 Å²	16	34.9 Å²	34.9	8%	0.084	18%	0.18	C	C	.	.			trans	-69.4	148.2	174.5	-66	-179.3	0	0	0	111.8	F221 L230 P241 V242 G246 L249 L252 L270	F221-L244 HydrophobicContact CB-CD2 4.35Å; F221-L244 HydrophobicContact CD2-CD2 3.86Å; F221-L244 HydrophobicContact CG-CD2 4.38Å; L230-L244 HydrophobicContact CD2-CD2 3.67Å; P241-L244 HydrophobicContact CB-CD2 4.29Å; P241-L244 HydrophobicContact CG-CD1 4.26Å; P241-L244 HydrophobicContact CG-CD2 4.16Å; P241-L244 HydrophobicContact CG-CG 4.48Å; V242-L244 PolarHBondContact O-N 3.21Å; L244-G246 PolarHBondContact O-N 3.31Å; L244-G246 VanDerWaalsContact O-N 3.12Å; L244-L249 HydrophobicContact CB-CD2 4.41Å; L244-L249 HydrophobicContact CD1-CD2 4.49Å; L244-L252 HydrophobicContact CD1-CD1 4.24Å; L244-L252 HydrophobicContact CD1-CD2 3.51Å; L244-L270 HydrophobicContact CB-CD2 4.02Å; L244-L270 HydrophobicContact CD1-CD1 4.18Å
245	P	94.4	Very high	96.6	Very high	6 Å²	6	31 Å²	31	4%	0.039	17%	0.167	C	C	.	.			trans	-76.4	99.5	-176	30.5	-35.4	0	0	0	112.1	F221 L224 L227 T247 L249	F221-P245 WeakPolarHBondContact O-CD 3.38Å; F221-P245 WeakPolarHBondContact O-CG 3.13Å; L224-P245 HydrophobicContact CB-CG 4.35Å; L224-P245 WeakPolarHBondContact O-CB 3.2Å; L227-P245 HydrophobicContact CB-CG 4.02Å; L227-P245 HydrophobicContact CD2-CG 3.86Å; P245-T247 VanDerWaalsContact C-N 3.27Å; P245-T247 PolarHBondContact O-N 3.29Å; P245-L249 WeakPolarHBondContact O-CB 3.42Å
246	G	90.9	Very high	96.6	Very high	18 Å²	18	35.1 Å²	35.1	19%	0.186	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-10.7	-178.1	0	0	0	0	0	116.8	L244 Y269	L244-G246 PolarHBondContact O-N 3.31Å; L244-G246 VanDerWaalsContact O-N 3.12Å; G246-Y269 WeakPolarHBondContact CA-O 3.24Å
247	T	93.6	Very high	96.6	Very high	86 Å²	86	32.9 Å²	32.9	53%	0.528	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-44.8	-171.1	-46.7	0	0	0	0	113.6	V225 P245 Q272	V225-T247 HydrophobicContact CG1-CG2 3.96Å; P245-T247 VanDerWaalsContact C-N 3.27Å; P245-T247 PolarHBondContact O-N 3.29Å; T247-Q272 WeakPolarHBondContact O-CG 3.27Å
248	N	96.4	Very high	96.6	Very high	46 Å²	46	38.8 Å²	38.8	25%	0.246	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132	-2.8	-174.9	-78.1	-66.7	0	0	0	114.4	V225 L227 T228 R250	V225-N248 PolarHBondContact O-ND2 3.3Å; L227-N248 CarbonylContact O-C 3.55Å; T228-N248 HydrophobicContact CG2-CB 4.49Å; N248-R250 WeakPolarHBondContact O-CG 3.39Å; N248-R250 PolarHBondContact O-N 2.98Å
249	L	98.1	Very high	96.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.184	C	C	.	.			trans	-67.2	119.6	-173.7	-171.4	68.9	0	0	0	110.8	L227 L230 L244 P245 L270 Q272 L273	L227-L249 HydrophobicContact CD2-CD1 4.26Å; L227-L249 HydrophobicContact CG-CD1 4.23Å; L227-L249 WeakPolarHBondContact O-CA 3.42Å; L227-L249 PolarHBondContact O-N 2.8Å; L230-L249 HydrophobicContact CB-CD1 4.04Å; L244-L249 HydrophobicContact CB-CD2 4.41Å; L244-L249 HydrophobicContact CD1-CD2 4.49Å; P245-L249 WeakPolarHBondContact O-CB 3.42Å; L249-L270 HydrophobicContact CD2-CD1 4.44Å; L249-L270 HydrophobicContact CD2-CD2 4.15Å; L249-Q272 CarbonylContact O-C 3.05Å; L249-L273 HydrophobicContact CD2-CD1 4.24Å; L249-L273 HydrophobicContact CG-CD1 3.99Å; L249-L273 VanDerWaalsContact O-CA 3.32Å; L249-L273 WeakPolarHBondContact O-CA 3.47Å; L249-L273 PolarHBondContact O-N 3.26Å; L249-L273 VanDerWaalsContact O-N 3.16Å
250	R	98.2	Very high	96.7	Very high	113 Å²	113	40 Å²	40	43%	0.426	20%	0.201	S	C	.	.			trans	-111.9	-30.4	-175.8	-72.3	170.9	-169.1	-69.6	-5.8	112.8	T228 N248 Y274 R275	T228-R250 PolarHBondContact O-N 2.86Å; N248-R250 WeakPolarHBondContact O-CG 3.39Å; N248-R250 PolarHBondContact O-N 2.98Å; R250-Y274 WeakPolarHBondContact O-CA 3.21Å; R250-Y274 PolarHBondContact O-N 3.07Å; R250-R275 PolarHBondContact O-N 3.41Å
251	K	98.6	Very high	96.6	Very high	76 Å²	76	45.8 Å²	45.8	33%	0.33	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	128.9	-178	-63.4	167.4	175.4	-172.7	0	109.8	T228 E229 L230 Y253 R275	T228-K251 PolarHBondContact O-N 2.83Å; E229-K251 WeakPolarHBondContact CA-O 3.43Å; E229-K251 HydrophobicContact CB-CB 4.29Å; E229-K251 HydrophobicContact CB-CD 4.27Å; E229-K251 HydrophobicContact CG-CB 4.02Å; E229-K251 HydrophobicContact CG-CD 3.96Å; E229-K251 WeakPolarHBondContact OE2-CD 3.16Å; E229-K251 WeakPolarHBondContact OE2-CE 3.24Å; E229-K251 IonicContact OE2-NZ 2.7Å; E229-K251 PolarHBondContact OE2-NZ 3.46Å; L230-K251 PolarHBondContact N-O 2.61Å; L230-K251 VanDerWaalsContact N-O 3.09Å; K251-Y253 HydrophobicContact CB-CE2 3.85Å; K251-Y253 HydrophobicContact CD-CE2 4.17Å; K251-R275 WeakPolarHBondContact CA-O 3.46Å; K251-R275 HydrophobicContact CG-CB 4.37Å
252	L	98.6	Very high	96.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	118.8	174.1	179.1	58.4	0	0	0	109.4	L230 L244 L254 F267 L270 L273 R275 L276 D277	L230-L252 HydrophobicContact CB-CD1 4.08Å; L230-L252 HydrophobicContact CD2-CD1 3.96Å; L230-L252 HydrophobicContact CG-CD1 4.11Å; L244-L252 HydrophobicContact CD1-CD1 4.24Å; L244-L252 HydrophobicContact CD1-CD2 3.51Å; L252-L254 HydrophobicContact CD1-CD2 4.23Å; L252-L254 HydrophobicContact CD1-CG 4.2Å; L252-L254 HydrophobicContact CD2-CD1 4.15Å; L252-L254 HydrophobicContact CG-CD1 4.17Å; L252-L254 HydrophobicContact CG-CG 4.1Å; L252-F267 HydrophobicContact CD2-CD1 4.2Å; L252-F267 HydrophobicContact CD2-CE1 3.82Å; L252-L270 HydrophobicContact CD2-CD1 4.46Å; L252-L273 HydrophobicContact CB-CD1 3.86Å; L252-R275 PolarHBondContact N-O 3.48Å; L252-L276 HydrophobicContact CB-CD1 4.02Å; L252-L276 HydrophobicContact CD2-CD1 3.88Å; L252-L276 HydrophobicContact CG-CD1 3.94Å; L252-D277 PolarHBondContact O-N 2.84Å
253	Y	98.8	Very high	96.8	Very high	30 Å²	30	44.9 Å²	44.9	12%	0.118	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	116.8	-179.1	-58.6	-73.5	0	0	0	110.1	E229 L230 L232 K251 D277	E229-Y253 HydrophobicContact CG-CD2 4.33Å; E229-Y253 HydrophobicContact CG-CE2 3.9Å; L230-Y253 PolarHBondContact O-N 2.91Å; L232-Y253 PolarHBondContact N-O 3.26Å; K251-Y253 HydrophobicContact CB-CE2 3.85Å; K251-Y253 HydrophobicContact CD-CE2 4.17Å; Y253-D277 HydrophobicContact CD1-CB 4.15Å
254	L	98.4	Very high	96.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.233	C	C	.	.			trans	-127.8	14.2	-178.1	-62.7	172.9	0	0	0	111.4	L232 L237 A240 P241 L252 N257 I259 F267 D277 M278 N281	L232-L254 HydrophobicContact CB-CD2 4.11Å; L232-L254 HydrophobicContact CD1-CD2 4.11Å; L237-L254 HydrophobicContact CD1-CD2 4.23Å; A240-L254 HydrophobicContact CB-CD1 4.41Å; P241-L254 HydrophobicContact CG-CD2 4.16Å; L252-L254 HydrophobicContact CD1-CD2 4.23Å; L252-L254 HydrophobicContact CD1-CG 4.2Å; L252-L254 HydrophobicContact CD2-CD1 4.15Å; L252-L254 HydrophobicContact CG-CD1 4.17Å; L252-L254 HydrophobicContact CG-CG 4.1Å; L254-N257 PolarHBondContact O-ND2 3.01Å; L254-I259 HydrophobicContact CB-CD1 3.95Å; L254-I259 HydrophobicContact CD1-CD1 4.31Å; L254-F267 HydrophobicContact CD1-CE1 4.35Å; L254-F267 HydrophobicContact CD1-CZ 4.4Å; L254-D277 WeakPolarHBondContact CA-O 3.12Å; L254-D277 PolarHBondContact N-O 2.87Å; L254-M278 HydrophobicContact CB-CG 4.13Å; L254-M278 HydrophobicContact CD1-CG 4.04Å; L254-M278 HydrophobicContact CD1-SD 4.2Å; L254-N281 PolarHBondContact O-ND2 2.84Å
255	Q	98.1	Very high	96.6	Very high	36 Å²	36	49.7 Å²	49.7	17%	0.168	25%	0.249	C	C	.	.			trans	-66.7	156.8	-177.1	63.7	-83.7	10.9	0	0	113.1	V233 R234 N257 S279	V233-Q255 VanDerWaalsContact CA-O 3.31Å; V233-Q255 WeakPolarHBondContact CA-O 3.2Å; V233-Q255 HydrophobicContact CB-CG 4.5Å; V233-Q255 HydrophobicContact CG1-CG 3.86Å; V233-Q255 VanDerWaalsContact CG2-CD 3.42Å; V233-Q255 HydrophobicContact CG2-CG 4Å; R234-Q255 PolarHBondContact N-O 3.43Å; R234-Q255 VanDerWaalsContact N-O 3.14Å; Q255-N257 PolarHBondContact O-N 3.43Å; Q255-N257 PolarHBondContact O-ND2 3.4Å; Q255-N257 VanDerWaalsContact O-ND2 3.11Å; Q255-S279 WeakPolarHBondContact CA-O 3.46Å; Q255-S279 WeakPolarHBondContact CB-O 3.44Å
256	E	98.1	Very high	96.7	Very high	92 Å²	92	49.5 Å²	49.5	43%	0.43	25%	0.248	S	C	.	.	S	Bend	trans	56.9	50.2	179.4	-65.3	173.4	-144.1	0	0	112.6	R234 N235 S279 N280	R234-E256 WeakPolarHBondContact CA-O 3.13Å; R234-E256 HydrophobicContact CG-CB 3.86Å; R234-E256 WeakPolarHBondContact CG-OE2 3.45Å; R234-E256 PolarHBondContact N-O 3.32Å; N235-E256 PolarHBondContact N-O 3.45Å; E256-S279 PolarHBondContact N-O 2.8Å; E256-S279 VanDerWaalsContact N-O 3.15Å; E256-N280 VanDerWaalsContact CA-O 3.28Å; E256-N280 WeakPolarHBondContact CA-O 3.43Å; E256-N280 HydrophobicContact CB-CB 4.47Å; E256-N280 HydrophobicContact CG-CB 3.67Å; E256-N280 PolarHBondContact N-O 2.59Å
257	N	98.6	Very high	96.9	Very high	5 Å²	5	48.8 Å²	48.8	3%	0.027	24%	0.24	C	C	.	.	S	Bend	trans	-121.7	-171.2	172.8	-85	-97.2	0	0	0	109.7	L232 N235 L237 L254 Q255 I259 N280 N281	L232-N257 PolarHBondContact O-ND2 3.04Å; N235-N257 WeakPolarHBondContact CA-OD1 3.42Å; N235-N257 WeakPolarHBondContact CB-OD1 3.16Å; N235-N257 WeakPolarHBondContact O-CA 3.13Å; N235-N257 PolarHBondContact O-OD1 3.48Å; N235-N257 VanDerWaalsContact O-OD1 3.07Å; L237-N257 HydrophobicContact CB-CB 4.31Å; L237-N257 WeakPolarHBondContact CB-OD1 3.37Å; L237-N257 VanDerWaalsContact CG-OD1 3.26Å; L237-N257 WeakPolarHBondContact CG-OD1 3.2Å; L237-N257 PolarHBondContact N-OD1 2.91Å; L254-N257 PolarHBondContact O-ND2 3.01Å; Q255-N257 PolarHBondContact O-N 3.43Å; Q255-N257 PolarHBondContact O-ND2 3.4Å; Q255-N257 VanDerWaalsContact O-ND2 3.11Å; N257-I259 HydrophobicContact CB-CD1 4.22Å; N257-I259 HydrophobicContact CB-CG1 3.95Å; N257-N280 PolarHBondContact N-O 3.28Å; N257-N281 WeakPolarHBondContact CA-OD1 3.38Å; N257-N281 WeakPolarHBondContact CB-OD1 3.47Å; N257-N281 PolarHBondContact O-OD1 3.33Å
258	H	97.9	Very high	96.9	Very high	123 Å²	123	46.4 Å²	46.4	57%	0.569	23%	0.227	S	C	*	.			trans	-112.4	30.4	177.2	-60.9	-26.8	0	0	0	111.8	L237 N260	L237-H258 CarbonylContact O-C 3.25Å; L237-H258 VanDerWaalsContact O-CA 3.27Å; L237-H258 WeakPolarHBondContact O-CA 3.32Å; L237-H258 PolarHBondContact O-N 2.8Å; H258-N260 PolarHBondContact O-N 2.75Å; H258-N260 VanDerWaalsContact O-N 3.09Å
259	I	98.4	Very high	96.9	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.247	C	C	.	.			trans	-64.7	114.9	-173.3	-60.4	173	0	0	0	109	L237 T238 L254 N257 R261 N281 N282 L283	L237-I259 HydrophobicContact CB-CG1 4.12Å; L237-I259 PolarHBondContact O-N 2.86Å; T238-I259 WeakPolarHBondContact O-CA 3.21Å; L254-I259 HydrophobicContact CB-CD1 3.95Å; L254-I259 HydrophobicContact CD1-CD1 4.31Å; N257-I259 HydrophobicContact CB-CD1 4.22Å; N257-I259 HydrophobicContact CB-CG1 3.95Å; I259-R261 WeakPolarHBondContact CG2-O 3.33Å; I259-N281 HydrophobicContact CB-CB 4.31Å; I259-N281 WeakPolarHBondContact CB-OD1 3.43Å; I259-N281 VanDerWaalsContact CG1-OD1 3.29Å; I259-N281 WeakPolarHBondContact CG1-OD1 3.38Å; I259-N281 PolarHBondContact N-OD1 3.09Å; I259-N282 CarbonylContact O-C 3.5Å; I259-N282 WeakPolarHBondContact O-CA 3.15Å; I259-N282 PolarHBondContact O-N 3.03Å; I259-L283 HydrophobicContact CG2-CD2 3.82Å; I259-L283 HydrophobicContact CG2-CG 4.31Å; I259-L283 PolarHBondContact O-N 2.91Å; I259-L283 VanDerWaalsContact O-N 3.14Å
260	N	97.3	Very high	96.8	Very high	78 Å²	78	52.5 Å²	52.5	42%	0.417	25%	0.247	S	C	.	.			trans	-105.3	-14.1	179.4	65.6	30.6	0	0	0	113.3	T238 H258	T238-N260 PolarHBondContact O-N 2.73Å; T238-N260 PolarHBondContact O-OD1 2.75Å; T238-N260 VanDerWaalsContact O-OD1 3.05Å; H258-N260 PolarHBondContact O-N 2.75Å; H258-N260 VanDerWaalsContact O-N 3.09Å
261	R	96.4	Very high	96.7	Very high	124 Å²	124	52.6 Å²	52.6	47%	0.468	25%	0.248	S	C	.	.	B	Isolated β-bridge	trans	-146.7	145.1	179	66.2	-164.1	-178.5	-76.2	2.7	111.7	T238 A239 A240 I259	T238-R261 PolarHBondContact O-NH1 3.04Å; T238-R261 PolarHBondContact OG1-NH1 2.8Å; A239-R261 VanDerWaalsContact CA-O 3.27Å; A239-R261 WeakPolarHBondContact CA-O 3.24Å; A239-R261 HydrophobicContact CB-CG 3.78Å; A240-R261 PolarHBondContact N-O 2.82Å; I259-R261 WeakPolarHBondContact CG2-O 3.33Å
262	V	97.6	Very high	96.7	Very high	7 Å²	7	52.2 Å²	52.2	4%	0.042	25%	0.247	C	C	.	.			trans	-106	116.7	166.5	-173.9	0	0	0	0	107.1	A240 A266 F267 M278 L283 L286 P287 V290	A240-V262 HydrophobicContact CB-CG1 4.05Å; A240-V262 HydrophobicContact CB-CG2 4.46Å; V262-A266 HydrophobicContact CG1-CB 3.91Å; V262-F267 HydrophobicContact CG1-CD2 4.03Å; V262-F267 HydrophobicContact CG1-CE2 3.48Å; V262-F267 VanDerWaalsContact CG1-CE2 3.48Å; V262-F267 HydrophobicContact CG1-CZ 4.01Å; V262-M278 HydrophobicContact CG2-CE 4.33Å; V262-M278 HydrophobicContact CG2-SD 4.28Å; V262-L283 HydrophobicContact CG2-CD1 4.26Å; V262-L283 HydrophobicContact CG2-CD2 3.82Å; V262-L286 HydrophobicContact CG2-CD2 3.81Å; V262-P287 WeakPolarHBondContact O-CG 3.1Å; V262-V290 HydrophobicContact CB-CG2 4.3Å; V262-V290 HydrophobicContact CG1-CG2 3.5Å
263	P	95.8	Very high	96.6	Very high	28 Å²	28	52.2 Å²	52.2	18%	0.182	25%	0.247	C	C	.	.			trans	-58	144	170.7	-25.5	34.2	0	0	0	111.4	A239 V242 N265 A266	A239-P263 HydrophobicContact CB-CG 4.44Å; V242-P263 HydrophobicContact CG1-CB 3.87Å; V242-P263 HydrophobicContact CG1-CG 3.97Å; P263-N265 PolarHBondContact O-N 2.73Å; P263-N265 VanDerWaalsContact O-N 3.09Å; P263-A266 HydrophobicContact CB-CB 4.21Å; P263-A266 HydrophobicContact CG-CB 4.42Å; P263-A266 VanDerWaalsContact O-CB 3.29Å; P263-A266 WeakPolarHBondContact O-CB 3.33Å; P263-A266 PolarHBondContact O-N 3.46Å
264	P	92.6	Very high	96.5	Very high	98 Å²	98	54.9 Å²	54.9	64%	0.636	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-29.6	-178	-26.4	35.1	0	0	0	114.2
265	N	92.4	Very high	96.5	Very high	78 Å²	78	57.5 Å²	57.5	42%	0.417	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	7.5	-179.8	67.1	-39.3	0	0	0	114.5	P263 F267 S268	P263-N265 PolarHBondContact O-N 2.73Å; P263-N265 VanDerWaalsContact O-N 3.09Å; N265-F267 VanDerWaalsContact C-N 3.3Å; N265-F267 PolarHBondContact O-N 3.07Å; N265-S268 WeakPolarHBondContact CA-OG 3.49Å
266	A	95.4	Very high	96.5	Very high	2 Å²	2	55.8 Å²	55.8	2%	0.017	26%	0.259	C	S	.	.	S	Bend	trans	-64.7	-34	-176.5	0	0	0	0	0	113.2	A240 V242 V262 P263	A240-A266 HydrophobicContact CB-CB 3.99Å; V242-A266 HydrophobicContact CG1-CB 4.43Å; V262-A266 HydrophobicContact CG1-CB 3.91Å; P263-A266 HydrophobicContact CB-CB 4.21Å; P263-A266 HydrophobicContact CG-CB 4.42Å; P263-A266 VanDerWaalsContact O-CB 3.29Å; P263-A266 WeakPolarHBondContact O-CB 3.33Å; P263-A266 PolarHBondContact O-N 3.46Å
267	F	96.6	Very high	96.6	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.009	24%	0.244	C	C	.	.	S	Bend	trans	-115.4	12.6	-178.9	-51.9	-43	0	0	0	113.8	A240 L252 L254 V262 N265 L270 L276 M278 V290 F291 L294	A240-F267 HydrophobicContact CB-CE1 4.27Å; A240-F267 HydrophobicContact CB-CZ 3.93Å; L252-F267 HydrophobicContact CD2-CD1 4.2Å; L252-F267 HydrophobicContact CD2-CE1 3.82Å; L254-F267 HydrophobicContact CD1-CE1 4.35Å; L254-F267 HydrophobicContact CD1-CZ 4.4Å; V262-F267 HydrophobicContact CG1-CD2 4.03Å; V262-F267 HydrophobicContact CG1-CE2 3.48Å; V262-F267 VanDerWaalsContact CG1-CE2 3.48Å; V262-F267 HydrophobicContact CG1-CZ 4.01Å; N265-F267 VanDerWaalsContact C-N 3.3Å; N265-F267 PolarHBondContact O-N 3.07Å; F267-L270 HydrophobicContact CB-CD1 4.08Å; F267-L270 HydrophobicContact CD1-CD1 3.88Å; F267-L270 HydrophobicContact CG-CD1 4.44Å; F267-L270 PolarHBondContact O-N 3.06Å; F267-L276 HydrophobicContact CD2-CD2 4.24Å; F267-L276 HydrophobicContact CE1-CD1 4.38Å; F267-L276 HydrophobicContact CE1-CD2 4.44Å; F267-L276 HydrophobicContact CE2-CD2 3.96Å; F267-L276 HydrophobicContact CZ-CD1 4.36Å; F267-L276 HydrophobicContact CZ-CD2 4.08Å; F267-M278 HydrophobicContact CE2-CE 3.84Å; F267-M278 HydrophobicContact CE2-SD 3.97Å; F267-M278 HydrophobicContact CZ-CE 4.05Å; F267-M278 HydrophobicContact CZ-SD 3.56Å; F267-M278 VanDerWaalsContact CZ-SD 3.56Å; F267-V290 HydrophobicContact CD2-CG2 4.15Å; F267-F291 HydrophobicContact CD2-CD1 4.23Å; F267-F291 HydrophobicContact CD2-CE1 4.08Å; F267-F291 HydrophobicContact CE2-CE1 4.15Å; F267-L294 HydrophobicContact CB-CD2 4.22Å
268	S	93.6	Very high	96.5	Very high	37 Å²	37	52 Å²	52	26%	0.259	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	144.3	174.3	-65.9	0	0	0	0	111.2	N265 L270 D293	N265-S268 WeakPolarHBondContact CA-OG 3.49Å; S268-L270 PolarHBondContact O-N 3.38Å; S268-L270 VanDerWaalsContact O-N 3.09Å; S268-D293 WeakPolarHBondContact CA-OD2 3.32Å
269	Y	94.9	Very high	96.5	Very high	173 Å²	173	46.7 Å²	46.7	68%	0.678	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	4.8	-179.7	-42.1	-70.1	0	0	0	116.6	G246 R271 D293	G246-Y269 WeakPolarHBondContact CA-O 3.24Å; Y269-R271 PolarHBondContact O-N 3.5Å; Y269-D293 VanDerWaalsContact N-CG 3.34Å; Y269-D293 PolarHBondContact N-OD2 2.76Å
270	L	96.9	Very high	96.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.233	C	C	.	.			trans	-77.6	47	-179.4	-61.3	-169.8	0	0	0	113.7	L244 L249 L252 F267 S268 Q272 L273 L294	L244-L270 HydrophobicContact CB-CD2 4.02Å; L244-L270 HydrophobicContact CD1-CD1 4.18Å; L249-L270 HydrophobicContact CD2-CD1 4.44Å; L249-L270 HydrophobicContact CD2-CD2 4.15Å; L252-L270 HydrophobicContact CD2-CD1 4.46Å; F267-L270 HydrophobicContact CB-CD1 4.08Å; F267-L270 HydrophobicContact CD1-CD1 3.88Å; F267-L270 HydrophobicContact CG-CD1 4.44Å; F267-L270 PolarHBondContact O-N 3.06Å; S268-L270 PolarHBondContact O-N 3.38Å; S268-L270 VanDerWaalsContact O-N 3.09Å; L270-Q272 PolarHBondContact O-N 3.06Å; L270-Q272 VanDerWaalsContact O-N 3.16Å; L270-L273 HydrophobicContact CB-CB 4.16Å; L270-L273 HydrophobicContact CD1-CD2 4.18Å; L270-L273 WeakPolarHBondContact O-CB 3.36Å; L270-L273 PolarHBondContact O-N 3.17Å; L270-L294 HydrophobicContact CB-CD2 3.73Å
271	R	96.3	Very high	96.6	Very high	116 Å²	116	46.2 Å²	46.2	44%	0.438	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.4	-171.2	-64.9	179.3	-179.6	-175.8	-0.7	115	Y269 D293 D295 N296	Y269-R271 PolarHBondContact O-N 3.5Å; R271-D293 WeakPolarHBondContact CA-O 3.43Å; R271-D293 VanDerWaalsContact CG-O 3.28Å; R271-D293 WeakPolarHBondContact CG-O 3.29Å; R271-D293 IonicContact CZ-OD1 3.76Å; R271-D293 PolarHBondContact N-O 3.08Å; R271-D293 IonicContact NE-OD1 3.39Å; R271-D293 PolarHBondContact NE-OD1 3.49Å; R271-D293 IonicContact NH2-OD1 3.18Å; R271-D293 PolarHBondContact NH2-OD1 3.48Å; R271-D295 HydrophobicContact CB-CB 4.35Å; R271-D295 WeakPolarHBondContact CB-OD2 3.28Å; R271-D295 VanDerWaalsContact CD-OD2 3.24Å; R271-D295 WeakPolarHBondContact CD-OD2 3.26Å; R271-D295 VanDerWaalsContact CG-OD2 3.25Å; R271-D295 WeakPolarHBondContact CG-OD2 3.22Å; R271-D295 IonicContact NE-OD2 3.87Å; R271-N296 WeakPolarHBondContact O-CB 3.43Å; R271-N296 PolarHBondContact O-N 3.23Å; R271-N296 PolarHBondContact O-ND2 3.1Å
272	Q	97.3	Very high	96.7	Very high	67 Å²	67	44.9 Å²	44.9	31%	0.313	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-3.9	175.6	-61.6	-54.7	-49.5	0	0	113.6	T247 L249 L270 Y274	T247-Q272 WeakPolarHBondContact O-CG 3.27Å; L249-Q272 CarbonylContact O-C 3.05Å; L270-Q272 PolarHBondContact O-N 3.06Å; L270-Q272 VanDerWaalsContact O-N 3.16Å; Q272-Y274 PolarHBondContact O-N 3.27Å
273	L	97.9	Very high	96.7	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.216	C	C	.	.			trans	-69.5	117.2	-174.1	-162.9	74.9	0	0	0	110.7	L249 L252 L270 L276 L294 N296 I297	L249-L273 HydrophobicContact CD2-CD1 4.24Å; L249-L273 HydrophobicContact CG-CD1 3.99Å; L249-L273 VanDerWaalsContact O-CA 3.32Å; L249-L273 WeakPolarHBondContact O-CA 3.47Å; L249-L273 PolarHBondContact O-N 3.26Å; L249-L273 VanDerWaalsContact O-N 3.16Å; L252-L273 HydrophobicContact CB-CD1 3.86Å; L270-L273 HydrophobicContact CB-CB 4.16Å; L270-L273 HydrophobicContact CD1-CD2 4.18Å; L270-L273 WeakPolarHBondContact O-CB 3.36Å; L270-L273 PolarHBondContact O-N 3.17Å; L273-L276 HydrophobicContact CD2-CB 4Å; L273-L276 HydrophobicContact CD2-CD2 4.45Å; L273-L294 HydrophobicContact CB-CD2 4.18Å; L273-L294 HydrophobicContact CD2-CD2 3.88Å; L273-N296 CarbonylContact O-C 3.15Å; L273-N296 VanDerWaalsContact O-C 3.25Å; L273-I297 WeakPolarHBondContact O-CA 3.2Å; L273-I297 PolarHBondContact O-N 3.15Å; L273-I297 VanDerWaalsContact O-N 3.16Å
274	Y	96.6	Very high	96.7	Very high	86 Å²	86	45 Å²	45	34%	0.337	22%	0.22	S	C	.	.			trans	-98.2	-37	-178.3	166.2	-90.4	0	0	0	111.8	R250 Q272 T298 Q299	R250-Y274 WeakPolarHBondContact O-CA 3.21Å; R250-Y274 PolarHBondContact O-N 3.07Å; Q272-Y274 PolarHBondContact O-N 3.27Å; Y274-T298 HydrophobicContact CD2-CG2 4.32Å; Y274-T298 WeakPolarHBondContact CD2-OG1 3.4Å; Y274-T298 HydrophobicContact CE2-CG2 3.56Å; Y274-T298 WeakPolarHBondContact CE2-OG1 2.97Å; Y274-T298 PolarHBondContact O-N 2.89Å; Y274-Q299 HydrophobicContact CE1-CG 4.2Å; Y274-Q299 PolarHBondContact O-N 3.09Å
275	R	98.3	Very high	96.8	Very high	55 Å²	55	43.6 Å²	43.6	21%	0.208	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	127.4	-179.8	-174.5	176.6	-172.6	143	-14.7	111.4	R250 K251 L252 Q299 F301	R250-R275 PolarHBondContact O-N 3.41Å; K251-R275 WeakPolarHBondContact CA-O 3.46Å; K251-R275 HydrophobicContact CG-CB 4.37Å; L252-R275 PolarHBondContact N-O 3.48Å; R275-Q299 WeakPolarHBondContact CA-O 3.41Å; R275-Q299 HydrophobicContact CB-CB 4.15Å; R275-Q299 VanDerWaalsContact CD-OE1 3.24Å; R275-Q299 HydrophobicContact CG-CB 3.91Å; R275-F301 HydrophobicContact CG-CE2 4.39Å
276	L	98.4	Very high	97	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	126.1	170.5	176.1	56.4	0	0	0	109	L252 F267 L273 M278 F291 L294 I297 Q299 L300 F301	L252-L276 HydrophobicContact CB-CD1 4.02Å; L252-L276 HydrophobicContact CD2-CD1 3.88Å; L252-L276 HydrophobicContact CG-CD1 3.94Å; F267-L276 HydrophobicContact CD2-CD2 4.24Å; F267-L276 HydrophobicContact CE1-CD1 4.38Å; F267-L276 HydrophobicContact CE1-CD2 4.44Å; F267-L276 HydrophobicContact CE2-CD2 3.96Å; F267-L276 HydrophobicContact CZ-CD1 4.36Å; F267-L276 HydrophobicContact CZ-CD2 4.08Å; L273-L276 HydrophobicContact CD2-CB 4Å; L273-L276 HydrophobicContact CD2-CD2 4.45Å; L276-M278 HydrophobicContact CD1-CG 4.07Å; L276-M278 HydrophobicContact CD2-CE 4.19Å; L276-M278 HydrophobicContact CG-CG 4.38Å; L276-F291 HydrophobicContact CD2-CE1 4.24Å; L276-L294 HydrophobicContact CD2-CD1 4.36Å; L276-I297 HydrophobicContact CB-CD1 4.06Å; L276-Q299 PolarHBondContact N-O 3.4Å; L276-L300 HydrophobicContact CB-CD1 3.84Å; L276-L300 HydrophobicContact CD2-CD1 3.81Å; L276-L300 HydrophobicContact CG-CD1 3.82Å; L276-L300 WeakPolarHBondContact O-CA 3.27Å; L276-F301 PolarHBondContact O-N 3.18Å
277	D	98.6	Very high	97	Very high	19 Å²	19	41.7 Å²	41.7	10%	0.102	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	120.1	173	-158.4	-25.2	0	0	0	110.4	L252 Y253 L254 S279 F301	L252-D277 PolarHBondContact O-N 2.84Å; Y253-D277 HydrophobicContact CD1-CB 4.15Å; L254-D277 WeakPolarHBondContact CA-O 3.12Å; L254-D277 PolarHBondContact N-O 2.87Å; D277-S279 WeakPolarHBondContact OD1-CB 3.44Å; D277-S279 PolarHBondContact OD1-N 3.26Å; D277-S279 PolarHBondContact OD1-OG 3.08Å; D277-F301 HydrophobicContact CB-CB 4.12Å; D277-F301 HydrophobicContact CB-CD2 4.42Å; D277-F301 VanDerWaalsContact CG-CB 3.43Å; D277-F301 WeakPolarHBondContact OD1-CB 3.38Å; D277-F301 WeakPolarHBondContact OD2-CB 3.21Å
278	M	97.9	Very high	96.9	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.234	C	C	.	.			trans	-124.7	27.1	172.8	-62.2	-169.5	-70.6	0	0	110.4	L254 V262 F267 L276 N281 L283 F291 F301 L302 N305	L254-M278 HydrophobicContact CB-CG 4.13Å; L254-M278 HydrophobicContact CD1-CG 4.04Å; L254-M278 HydrophobicContact CD1-SD 4.2Å; V262-M278 HydrophobicContact CG2-CE 4.33Å; V262-M278 HydrophobicContact CG2-SD 4.28Å; F267-M278 HydrophobicContact CE2-CE 3.84Å; F267-M278 HydrophobicContact CE2-SD 3.97Å; F267-M278 HydrophobicContact CZ-CE 4.05Å; F267-M278 HydrophobicContact CZ-SD 3.56Å; F267-M278 VanDerWaalsContact CZ-SD 3.56Å; L276-M278 HydrophobicContact CD1-CG 4.07Å; L276-M278 HydrophobicContact CD2-CE 4.19Å; L276-M278 HydrophobicContact CG-CG 4.38Å; M278-N281 PolarHBondContact O-ND2 3.31Å; M278-N281 VanDerWaalsContact O-ND2 3.15Å; M278-L283 HydrophobicContact CB-CD1 4.4Å; M278-L283 HydrophobicContact CE-CD1 4.28Å; M278-L283 HydrophobicContact SD-CD1 4.32Å; M278-F291 HydrophobicContact CE-CE1 4.38Å; M278-F291 HydrophobicContact CE-CZ 4.43Å; M278-F301 PolarHBondContact N-O 3.27Å; M278-L302 HydrophobicContact CB-CD2 3.96Å; M278-L302 HydrophobicContact CE-CD2 3.65Å; M278-N305 PolarHBondContact O-ND2 3.2Å
279	S	98.2	Very high	96.8	Very high	10 Å²	10	48.6 Å²	48.6	7%	0.07	23%	0.234	C	C	.	.			trans	-65.3	158.9	179.2	-54.6	0	0	0	0	112.2	Q255 E256 D277 N281 R303	Q255-S279 WeakPolarHBondContact CA-O 3.46Å; Q255-S279 WeakPolarHBondContact CB-O 3.44Å; E256-S279 PolarHBondContact N-O 2.8Å; E256-S279 VanDerWaalsContact N-O 3.15Å; D277-S279 WeakPolarHBondContact OD1-CB 3.44Å; D277-S279 PolarHBondContact OD1-N 3.26Å; D277-S279 PolarHBondContact OD1-OG 3.08Å; S279-N281 PolarHBondContact O-ND2 2.92Å; S279-N281 VanDerWaalsContact O-ND2 3.17Å; S279-R303 CarbonylContact C-O 3.58Å; S279-R303 WeakPolarHBondContact CA-O 3.19Å; S279-R303 PolarHBondContact OG-N 2.68Å
280	N	98.1	Very high	96.9	Very high	58 Å²	58	40.7 Å²	40.7	31%	0.31	20%	0.203	S	C	.	.	S	Bend	trans	54.1	57.4	-178.4	-55.1	-39.8	0	0	0	111.9	E256 N257 R303 N304	E256-N280 VanDerWaalsContact CA-O 3.28Å; E256-N280 WeakPolarHBondContact CA-O 3.43Å; E256-N280 HydrophobicContact CB-CB 4.47Å; E256-N280 HydrophobicContact CG-CB 3.67Å; E256-N280 PolarHBondContact N-O 2.59Å; N257-N280 PolarHBondContact N-O 3.28Å; N280-R303 PolarHBondContact N-O 3.21Å; N280-N304 WeakPolarHBondContact CA-O 3.41Å; N280-N304 PolarHBondContact N-O 2.84Å; N280-N304 WeakPolarHBondContact OD1-CB 3Å; N280-N304 PolarHBondContact OD1-ND2 3.47Å
281	N	98.6	Very high	96.8	Very high	10 Å²	10	41 Å²	41	5%	0.053	21%	0.205	C	C	.	.	S	Bend	trans	-135.5	179.9	178.6	-89.6	-77.2	0	0	0	110.1	L254 N257 I259 M278 S279 N304 N305 P306	L254-N281 PolarHBondContact O-ND2 2.84Å; N257-N281 WeakPolarHBondContact CA-OD1 3.38Å; N257-N281 WeakPolarHBondContact CB-OD1 3.47Å; N257-N281 PolarHBondContact O-OD1 3.33Å; I259-N281 HydrophobicContact CB-CB 4.31Å; I259-N281 WeakPolarHBondContact CB-OD1 3.43Å; I259-N281 VanDerWaalsContact CG1-OD1 3.29Å; I259-N281 WeakPolarHBondContact CG1-OD1 3.38Å; I259-N281 PolarHBondContact N-OD1 3.09Å; M278-N281 PolarHBondContact O-ND2 3.31Å; M278-N281 VanDerWaalsContact O-ND2 3.15Å; S279-N281 PolarHBondContact O-ND2 2.92Å; S279-N281 VanDerWaalsContact O-ND2 3.17Å; N281-N304 PolarHBondContact N-O 3.41Å; N281-N305 WeakPolarHBondContact CA-OD1 3.31Å; N281-N305 WeakPolarHBondContact CB-OD1 3.19Å; N281-N305 PolarHBondContact O-OD1 2.63Å; N281-N305 VanDerWaalsContact O-OD1 3.1Å; N281-P306 WeakPolarHBondContact O-CD 3.48Å
282	N	98	Very high	96.7	Very high	96 Å²	96	41 Å²	41	51%	0.513	21%	0.213	S	C	.	.			trans	-108.3	30.9	-174	-148.3	84.9	0	0	0	112.8	I259	I259-N282 CarbonylContact O-C 3.5Å; I259-N282 WeakPolarHBondContact O-CA 3.15Å; I259-N282 PolarHBondContact O-N 3.03Å
283	L	97.7	Very high	96.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.208	C	C	.	.			trans	-75.8	125.1	-179.6	-65.1	169.3	0	0	0	111.6	I259 V262 M278 L286 N305 P306 W307	I259-L283 HydrophobicContact CG2-CD2 3.82Å; I259-L283 HydrophobicContact CG2-CG 4.31Å; I259-L283 PolarHBondContact O-N 2.91Å; I259-L283 VanDerWaalsContact O-N 3.14Å; V262-L283 HydrophobicContact CG2-CD1 4.26Å; V262-L283 HydrophobicContact CG2-CD2 3.82Å; M278-L283 HydrophobicContact CB-CD1 4.4Å; M278-L283 HydrophobicContact CE-CD1 4.28Å; M278-L283 HydrophobicContact SD-CD1 4.32Å; L283-L286 HydrophobicContact CD1-CD2 4.44Å; L283-N305 HydrophobicContact CB-CB 4.37Å; L283-N305 VanDerWaalsContact CB-OD1 3.24Å; L283-N305 WeakPolarHBondContact CB-OD1 3.39Å; L283-N305 PolarHBondContact N-OD1 2.88Å; L283-P306 CarbonylContact O-C 2.98Å; L283-P306 VanDerWaalsContact O-CD 3.31Å; L283-P306 WeakPolarHBondContact O-CD 3.2Å; L283-W307 HydrophobicContact CB-CE3 4.48Å; L283-W307 HydrophobicContact CB-CH2 3.52Å; L283-W307 HydrophobicContact CB-CZ2 4.26Å; L283-W307 HydrophobicContact CB-CZ3 3.65Å; L283-W307 HydrophobicContact CD1-CH2 3.8Å; L283-W307 HydrophobicContact CD1-CZ2 4.48Å; L283-W307 HydrophobicContact CG-CH2 4.29Å
284	S	96.3	Very high	96.5	Very high	38 Å²	38	39.9 Å²	39.9	27%	0.266	21%	0.209	S	C	.	.			trans	-106.3	-21.8	171.6	-64.3	0	0	0	0	114.3	P306 H308	S284-P306 VanDerWaalsContact CA-O 3.25Å; S284-P306 WeakPolarHBondContact CA-O 3.44Å; S284-P306 WeakPolarHBondContact CB-O 3.43Å; S284-P306 PolarHBondContact OG-O 2.73Å; S284-H308 PolarHBondContact O-N 2.77Å
285	N	94.8	Very high	96.3	Very high	69 Å²	69	40.9 Å²	40.9	37%	0.369	22%	0.22	S	C	.	.			trans	-151.2	160.9	176.9	59.8	98.3	0	0	0	111	M313	N285-M313 HydrophobicContact CB-CE 4.45Å
286	L	96.4	Very high	96.2	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	23%	0.229	C	C	.	.			trans	-121.8	135.2	176	-65.6	171.5	0	0	0	108.7	V262 L283 V290 F291 W307 W315 V316	V262-L286 HydrophobicContact CG2-CD2 3.81Å; L283-L286 HydrophobicContact CD1-CD2 4.44Å; L286-V290 HydrophobicContact CB-CG1 4.29Å; L286-F291 HydrophobicContact CD1-CE2 3.73Å; L286-F291 HydrophobicContact CD1-CZ 3.76Å; L286-W307 HydrophobicContact CD1-CH2 4.06Å; L286-W307 HydrophobicContact CD1-CZ3 4.16Å; L286-W307 HydrophobicContact CD2-CH2 4.05Å; L286-W307 HydrophobicContact CD2-CZ3 4.18Å; L286-W307 HydrophobicContact CG-CH2 3.96Å; L286-W307 HydrophobicContact CG-CZ3 3.76Å; L286-W315 HydrophobicContact CB-CZ2 3.85Å; L286-W315 PolarHBondContact O-NE1 3.15Å; L286-W315 VanDerWaalsContact O-NE1 3.12Å; L286-V316 HydrophobicContact CB-CG2 4.47Å; L286-V316 HydrophobicContact CD1-CG2 4.48Å
287	P	95.7	Very high	96.1	Very high	37 Å²	37	42.4 Å²	42.4	24%	0.24	23%	0.233	C	C	.	.			trans	-67.2	145.4	174.1	25.2	-27.1	0	0	0	110.4	V262 G289 V290 W315	V262-P287 WeakPolarHBondContact O-CG 3.1Å; P287-G289 PolarHBondContact O-N 3.12Å; P287-V290 HydrophobicContact CG-CB 3.99Å; P287-V290 HydrophobicContact CG-CG2 4.01Å; P287-V290 WeakPolarHBondContact O-CB 3.31Å; P287-V290 WeakPolarHBondContact O-CG1 3.08Å; P287-V290 PolarHBondContact O-N 3.47Å; P287-W315 WeakPolarHBondContact O-CZ2 3.48Å
288	Q	94.4	Very high	96	Very high	161 Å²	161	42.1 Å²	42.1	75%	0.752	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	136.8	178.4	-175	174.9	-11.5	0	0	110.9	V290 W315	Q288-V290 VanDerWaalsContact C-N 3.33Å; Q288-W315 HydrophobicContact CB-CD2 4.28Å; Q288-W315 HydrophobicContact CB-CG 4.07Å; Q288-W315 HydrophobicContact CG-CB 4.17Å; Q288-W315 HydrophobicContact CG-CD2 4.17Å; Q288-W315 HydrophobicContact CG-CG 3.93Å
289	G	91.6	Very high	96	Very high	24 Å²	24	43.6 Å²	43.6	25%	0.247	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	1.7	178	0	0	0	0	0	115.7	P287 F291 D292	P287-G289 PolarHBondContact O-N 3.12Å; G289-F291 PolarHBondContact O-N 3.3Å; G289-D292 WeakPolarHBondContact CA-OD1 3.44Å; G289-D292 WeakPolarHBondContact CA-OD2 3.42Å; G289-D292 WeakPolarHBondContact O-CB 3.46Å; G289-D292 VanDerWaalsContact O-CG 3.3Å; G289-D292 PolarHBondContact O-N 2.94Å
290	V	96.3	Very high	95.9	Very high	6 Å²	6	43.1 Å²	43.1	4%	0.036	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-8.7	-175.9	77.3	0	0	0	0	114.7	V262 F267 L286 P287 Q288 W315	V262-V290 HydrophobicContact CB-CG2 4.3Å; V262-V290 HydrophobicContact CG1-CG2 3.5Å; F267-V290 HydrophobicContact CD2-CG2 4.15Å; L286-V290 HydrophobicContact CB-CG1 4.29Å; P287-V290 HydrophobicContact CG-CB 3.99Å; P287-V290 HydrophobicContact CG-CG2 4.01Å; P287-V290 WeakPolarHBondContact O-CB 3.31Å; P287-V290 WeakPolarHBondContact O-CG1 3.08Å; P287-V290 PolarHBondContact O-N 3.47Å; Q288-V290 VanDerWaalsContact C-N 3.33Å; V290-W315 HydrophobicContact CG1-CH2 4.1Å; V290-W315 HydrophobicContact CG1-CZ2 4.21Å
291	F	95.8	Very high	95.9	Very high	7 Å²	7	41 Å²	41	3%	0.031	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	7.5	176.7	-58.1	-38.7	0	0	0	113.2	F267 L276 M278 L286 G289 D293 L294 L300 L302 W315 W319	F267-F291 HydrophobicContact CD2-CD1 4.23Å; F267-F291 HydrophobicContact CD2-CE1 4.08Å; F267-F291 HydrophobicContact CE2-CE1 4.15Å; L276-F291 HydrophobicContact CD2-CE1 4.24Å; M278-F291 HydrophobicContact CE-CE1 4.38Å; M278-F291 HydrophobicContact CE-CZ 4.43Å; L286-F291 HydrophobicContact CD1-CE2 3.73Å; L286-F291 HydrophobicContact CD1-CZ 3.76Å; G289-F291 PolarHBondContact O-N 3.3Å; F291-D293 PolarHBondContact O-N 2.92Å; F291-L294 HydrophobicContact CB-CD1 4.02Å; F291-L294 HydrophobicContact CB-CG 4.47Å; F291-L294 HydrophobicContact CD1-CD1 3.6Å; F291-L294 HydrophobicContact CE1-CD1 4.47Å; F291-L294 HydrophobicContact CG-CD1 4.15Å; F291-L294 WeakPolarHBondContact O-CB 3.38Å; F291-L294 PolarHBondContact O-N 2.89Å; F291-L294 VanDerWaalsContact O-N 3.16Å; F291-L300 HydrophobicContact CD2-CD2 4.46Å; F291-L300 HydrophobicContact CE2-CD2 4.01Å; F291-L300 HydrophobicContact CZ-CD2 4.14Å; F291-L302 HydrophobicContact CZ-CD1 4.42Å; F291-W315 HydrophobicContact CD2-CH2 4.02Å; F291-W315 HydrophobicContact CE2-CH2 4.43Å; F291-W319 HydrophobicContact CB-CZ2 3.94Å; F291-W319 HydrophobicContact CD2-CE3 4.44Å; F291-W319 AromaticContact CD2-CH2 3.69Å; F291-W319 HydrophobicContact CD2-CH2 3.69Å; F291-W319 AromaticContact CD2-CZ2 3.76Å; F291-W319 HydrophobicContact CD2-CZ2 3.76Å; F291-W319 HydrophobicContact CD2-CZ3 4.04Å; F291-W319 HydrophobicContact CE2-CH2 4.19Å; F291-W319 HydrophobicContact CE2-CZ3 4.29Å; F291-W319 HydrophobicContact CG-CH2 4.44Å; F291-W319 HydrophobicContact CG-CZ2 4.2Å
292	D	94.1	Very high	95.9	Very high	115 Å²	115	40.5 Å²	40.5	62%	0.615	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-30.4	-170.6	-69.2	-3.2	0	0	0	113.4	G289 L294	G289-D292 WeakPolarHBondContact CA-OD1 3.44Å; G289-D292 WeakPolarHBondContact CA-OD2 3.42Å; G289-D292 WeakPolarHBondContact O-CB 3.46Å; G289-D292 VanDerWaalsContact O-CG 3.3Å; G289-D292 PolarHBondContact O-N 2.94Å; D292-L294 VanDerWaalsContact C-N 3.31Å
293	D	95.2	Very high	95.8	Very high	37 Å²	37	42.1 Å²	42.1	20%	0.198	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	4.3	175.5	-91.5	-43.3	0	0	0	113.5	S268 Y269 R271 F291 D295	S268-D293 WeakPolarHBondContact CA-OD2 3.32Å; Y269-D293 VanDerWaalsContact N-CG 3.34Å; Y269-D293 PolarHBondContact N-OD2 2.76Å; R271-D293 WeakPolarHBondContact CA-O 3.43Å; R271-D293 VanDerWaalsContact CG-O 3.28Å; R271-D293 WeakPolarHBondContact CG-O 3.29Å; R271-D293 IonicContact CZ-OD1 3.76Å; R271-D293 PolarHBondContact N-O 3.08Å; R271-D293 IonicContact NE-OD1 3.39Å; R271-D293 PolarHBondContact NE-OD1 3.49Å; R271-D293 IonicContact NH2-OD1 3.18Å; R271-D293 PolarHBondContact NH2-OD1 3.48Å; F291-D293 PolarHBondContact O-N 2.92Å; D293-D295 VanDerWaalsContact C-N 3.29Å; D293-D295 PolarHBondContact O-N 3.11Å; D293-D295 VanDerWaalsContact O-N 3.14Å
294	L	95.7	Very high	95.7	Very high	7 Å²	7	47.8 Å²	47.8	4%	0.037	25%	0.25	C	C	.	.			trans	-89.2	51.2	-175	-61.5	-173	0	0	0	113.4	F267 L270 L273 L276 F291 D292 N296 I297	F267-L294 HydrophobicContact CB-CD2 4.22Å; L270-L294 HydrophobicContact CB-CD2 3.73Å; L273-L294 HydrophobicContact CB-CD2 4.18Å; L273-L294 HydrophobicContact CD2-CD2 3.88Å; L276-L294 HydrophobicContact CD2-CD1 4.36Å; F291-L294 HydrophobicContact CB-CD1 4.02Å; F291-L294 HydrophobicContact CB-CG 4.47Å; F291-L294 HydrophobicContact CD1-CD1 3.6Å; F291-L294 HydrophobicContact CE1-CD1 4.47Å; F291-L294 HydrophobicContact CG-CD1 4.15Å; F291-L294 WeakPolarHBondContact O-CB 3.38Å; F291-L294 PolarHBondContact O-N 2.89Å; F291-L294 VanDerWaalsContact O-N 3.16Å; D292-L294 VanDerWaalsContact C-N 3.31Å; L294-N296 PolarHBondContact O-N 3.48Å; L294-I297 HydrophobicContact CB-CB 4.07Å; L294-I297 HydrophobicContact CB-CG2 4.21Å; L294-I297 WeakPolarHBondContact O-CB 3.17Å; L294-I297 VanDerWaalsContact O-CG2 3.28Å; L294-I297 WeakPolarHBondContact O-CG2 3.48Å; L294-I297 PolarHBondContact O-N 3.43Å
295	D	93.4	Very high	95.8	Very high	107 Å²	107	46.3 Å²	46.3	57%	0.572	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.2	-39.2	-172.5	-62.3	-19.8	0	0	0	115.3	R271 D293	R271-D295 HydrophobicContact CB-CB 4.35Å; R271-D295 WeakPolarHBondContact CB-OD2 3.28Å; R271-D295 VanDerWaalsContact CD-OD2 3.24Å; R271-D295 WeakPolarHBondContact CD-OD2 3.26Å; R271-D295 VanDerWaalsContact CG-OD2 3.25Å; R271-D295 WeakPolarHBondContact CG-OD2 3.22Å; R271-D295 IonicContact NE-OD2 3.87Å; D293-D295 VanDerWaalsContact C-N 3.29Å; D293-D295 PolarHBondContact O-N 3.11Å; D293-D295 VanDerWaalsContact O-N 3.14Å
296	N	95.2	Very high	95.9	Very high	72 Å²	72	44.4 Å²	44.4	39%	0.385	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	7.5	-174.9	-79	-54.4	0	0	0	115	R271 L273 L294 T298	R271-N296 WeakPolarHBondContact O-CB 3.43Å; R271-N296 PolarHBondContact O-N 3.23Å; R271-N296 PolarHBondContact O-ND2 3.1Å; L273-N296 CarbonylContact O-C 3.15Å; L273-N296 VanDerWaalsContact O-C 3.25Å; L294-N296 PolarHBondContact O-N 3.48Å; N296-T298 PolarHBondContact O-N 2.77Å; N296-T298 PolarHBondContact O-OG1 3.35Å
297	I	96.2	Very high	95.9	Very high	16 Å²	16	44.3 Å²	44.3	8%	0.082	23%	0.23	C	C	.	.			trans	-58.2	126.8	-175.3	-165.1	66.6	0	0	0	110.9	L273 L276 L294 L300 V327	L273-I297 WeakPolarHBondContact O-CA 3.2Å; L273-I297 PolarHBondContact O-N 3.15Å; L273-I297 VanDerWaalsContact O-N 3.16Å; L276-I297 HydrophobicContact CB-CD1 4.06Å; L294-I297 HydrophobicContact CB-CB 4.07Å; L294-I297 HydrophobicContact CB-CG2 4.21Å; L294-I297 WeakPolarHBondContact O-CB 3.17Å; L294-I297 VanDerWaalsContact O-CG2 3.28Å; L294-I297 WeakPolarHBondContact O-CG2 3.48Å; L294-I297 PolarHBondContact O-N 3.43Å; I297-L300 HydrophobicContact CG1-CB 4.38Å; I297-V327 HydrophobicContact CG2-CG1 4.18Å; I297-V327 WeakPolarHBondContact O-CG2 3.48Å
298	T	96.4	Very high	95.9	Very high	13 Å²	13	46.8 Å²	46.8	8%	0.08	24%	0.238	C	C	.	.			trans	-126.3	-27.2	-180	-59.6	0	0	0	0	111.3	Y274 N296 K326 N328	Y274-T298 HydrophobicContact CD2-CG2 4.32Å; Y274-T298 WeakPolarHBondContact CD2-OG1 3.4Å; Y274-T298 HydrophobicContact CE2-CG2 3.56Å; Y274-T298 WeakPolarHBondContact CE2-OG1 2.97Å; Y274-T298 PolarHBondContact O-N 2.89Å; N296-T298 PolarHBondContact O-N 2.77Å; N296-T298 PolarHBondContact O-OG1 3.35Å; T298-K326 HydrophobicContact CG2-CG 4.26Å; T298-N328 PolarHBondContact O-N 3.08Å
299	Q	97.4	Very high	95.9	Very high	30 Å²	30	39.2 Å²	39.2	14%	0.14	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	112	179.5	-66.4	-176.2	-16.9	0	0	109.8	Y274 R275 L276 F301	Y274-Q299 HydrophobicContact CE1-CG 4.2Å; Y274-Q299 PolarHBondContact O-N 3.09Å; R275-Q299 WeakPolarHBondContact CA-O 3.41Å; R275-Q299 HydrophobicContact CB-CB 4.15Å; R275-Q299 VanDerWaalsContact CD-OE1 3.24Å; R275-Q299 HydrophobicContact CG-CB 3.91Å; L276-Q299 PolarHBondContact N-O 3.4Å; Q299-F301 HydrophobicContact CB-CD2 4.5Å; Q299-F301 HydrophobicContact CB-CE2 3.77Å; Q299-F301 HydrophobicContact CB-CZ 4.23Å; Q299-F301 HydrophobicContact CG-CE2 4.44Å
300	L	97.5	Very high	95.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	113.2	175.9	179	62.9	0	0	0	110.4	L276 F291 I297 L302 W319 N328 V329 R330	L276-L300 HydrophobicContact CB-CD1 3.84Å; L276-L300 HydrophobicContact CD2-CD1 3.81Å; L276-L300 HydrophobicContact CG-CD1 3.82Å; L276-L300 WeakPolarHBondContact O-CA 3.27Å; F291-L300 HydrophobicContact CD2-CD2 4.46Å; F291-L300 HydrophobicContact CE2-CD2 4.01Å; F291-L300 HydrophobicContact CZ-CD2 4.14Å; I297-L300 HydrophobicContact CG1-CB 4.38Å; L300-L302 HydrophobicContact CD1-CD1 4.06Å; L300-L302 HydrophobicContact CD1-CG 4.15Å; L300-L302 HydrophobicContact CD2-CD1 3.73Å; L300-L302 HydrophobicContact CG-CD1 3.75Å; L300-L302 HydrophobicContact CG-CG 4.12Å; L300-W319 HydrophobicContact CD2-CH2 3.58Å; L300-W319 HydrophobicContact CD2-CZ3 4.11Å; L300-N328 PolarHBondContact N-O 2.99Å; L300-V329 HydrophobicContact CB-CG1 4.22Å; L300-V329 HydrophobicContact CB-CG2 4.25Å; L300-V329 HydrophobicContact CD2-CG1 4.03Å; L300-V329 HydrophobicContact CD2-CG2 4.49Å; L300-V329 HydrophobicContact CG-CG1 4.21Å; L300-V329 WeakPolarHBondContact O-CA 3.46Å; L300-R330 PolarHBondContact O-N 3.35Å
301	F	98.1	Very high	95.7	Very high	14 Å²	14	41.1 Å²	41.1	6%	0.061	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	120.6	-177.5	-60.1	-70.1	0	0	0	110.6	R275 L276 D277 M278 Q299 R330	R275-F301 HydrophobicContact CG-CE2 4.39Å; L276-F301 PolarHBondContact O-N 3.18Å; D277-F301 HydrophobicContact CB-CB 4.12Å; D277-F301 HydrophobicContact CB-CD2 4.42Å; D277-F301 VanDerWaalsContact CG-CB 3.43Å; D277-F301 WeakPolarHBondContact OD1-CB 3.38Å; D277-F301 WeakPolarHBondContact OD2-CB 3.21Å; M278-F301 PolarHBondContact N-O 3.27Å; Q299-F301 HydrophobicContact CB-CD2 4.5Å; Q299-F301 HydrophobicContact CB-CE2 3.77Å; Q299-F301 HydrophobicContact CB-CZ 4.23Å; Q299-F301 HydrophobicContact CG-CE2 4.44Å; F301-R330 HydrophobicContact CD1-CB 4.05Å; F301-R330 HydrophobicContact CD1-CG 4.41Å; F301-R330 HydrophobicContact CE1-CB 4.44Å; F301-R330 HydrophobicContact CE1-CG 4.3Å
302	L	96.9	Very high	95.5	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.			trans	-136.1	29.4	-171.6	-75.3	168.6	0	0	0	110.9	M278 F291 L300 W307 R330 G331 L332	M278-L302 HydrophobicContact CB-CD2 3.96Å; M278-L302 HydrophobicContact CE-CD2 3.65Å; F291-L302 HydrophobicContact CZ-CD1 4.42Å; L300-L302 HydrophobicContact CD1-CD1 4.06Å; L300-L302 HydrophobicContact CD1-CG 4.15Å; L300-L302 HydrophobicContact CD2-CD1 3.73Å; L300-L302 HydrophobicContact CG-CD1 3.75Å; L300-L302 HydrophobicContact CG-CG 4.12Å; L302-W307 HydrophobicContact CB-CZ2 3.93Å; L302-W307 HydrophobicContact CD2-CH2 4.12Å; L302-W307 HydrophobicContact CD2-CZ2 3.82Å; L302-W307 HydrophobicContact CG-CZ2 4.31Å; L302-W307 PolarHBondContact O-NE1 2.76Å; L302-R330 PolarHBondContact N-O 2.94Å; L302-G331 CarbonylContact O-C 3.37Å; L302-L332 HydrophobicContact CB-CD1 4.19Å; L302-L332 HydrophobicContact CB-CG 4.32Å; L302-L332 HydrophobicContact CD1-CD1 3.69Å; L302-L332 HydrophobicContact CD1-CD2 4.19Å; L302-L332 HydrophobicContact CD1-CG 4.03Å
303	R	96.3	Very high	95.4	Very high	129 Å²	129	42.6 Å²	42.6	49%	0.487	22%	0.215	S	C	.	.			trans	-70.3	157.6	-176	-66.6	175.8	174.3	154.7	-2.5	110.5	S279 N280 N305	S279-R303 CarbonylContact C-O 3.58Å; S279-R303 WeakPolarHBondContact CA-O 3.19Å; S279-R303 PolarHBondContact OG-N 2.68Å; N280-R303 PolarHBondContact N-O 3.21Å; R303-N305 PolarHBondContact O-N 2.78Å; R303-N305 PolarHBondContact O-ND2 2.66Å
304	N	96.6	Very high	95.3	Very high	119 Å²	119	44.6 Å²	44.6	64%	0.636	22%	0.222	S	C	*	.	S	Bend	trans	50.2	55.4	172.9	-55.8	-11.5	0	0	0	112.5	N280 N281	N280-N304 WeakPolarHBondContact CA-O 3.41Å; N280-N304 PolarHBondContact N-O 2.84Å; N280-N304 WeakPolarHBondContact OD1-CB 3Å; N280-N304 PolarHBondContact OD1-ND2 3.47Å; N281-N304 PolarHBondContact N-O 3.41Å
305	N	97.6	Very high	95.2	Very high	7 Å²	7	45.8 Å²	45.8	4%	0.037	23%	0.226	C	C	.	.			trans	-129.7	140.3	172.9	-86.8	-90.3	0	0	0	108.5	M278 N281 L283 R303 W307	M278-N305 PolarHBondContact O-ND2 3.2Å; N281-N305 WeakPolarHBondContact CA-OD1 3.31Å; N281-N305 WeakPolarHBondContact CB-OD1 3.19Å; N281-N305 PolarHBondContact O-OD1 2.63Å; N281-N305 VanDerWaalsContact O-OD1 3.1Å; L283-N305 HydrophobicContact CB-CB 4.37Å; L283-N305 VanDerWaalsContact CB-OD1 3.24Å; L283-N305 WeakPolarHBondContact CB-OD1 3.39Å; L283-N305 PolarHBondContact N-OD1 2.88Å; R303-N305 PolarHBondContact O-N 2.78Å; R303-N305 PolarHBondContact O-ND2 2.66Å; N305-W307 HydrophobicContact CB-CD2 4.21Å; N305-W307 HydrophobicContact CB-CH2 4.43Å; N305-W307 HydrophobicContact CB-CZ2 3.64Å; N305-W307 VanDerWaalsContact O-CD1 3.32Å; N305-W307 PolarHBondContact O-N 3.1Å
306	P	97.2	Very high	95.3	Very high	30 Å²	30	40.7 Å²	40.7	20%	0.195	20%	0.199	C	C	.	.			trans	-78.6	63.5	-175.3	33.1	-37.5	0	0	0	113.1	N281 L283 S284 H308	N281-P306 WeakPolarHBondContact O-CD 3.48Å; L283-P306 CarbonylContact O-C 2.98Å; L283-P306 VanDerWaalsContact O-CD 3.31Å; L283-P306 WeakPolarHBondContact O-CD 3.2Å; S284-P306 VanDerWaalsContact CA-O 3.25Å; S284-P306 WeakPolarHBondContact CA-O 3.44Å; S284-P306 WeakPolarHBondContact CB-O 3.43Å; S284-P306 PolarHBondContact OG-O 2.73Å; P306-H308 PolarHBondContact O-N 3.07Å
307	W	96.8	Very high	95.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.185	C	C	.	.			trans	-59.6	122.5	-176	-63.2	116.6	0	0	0	112.9	L283 L286 L302 N305 M313 G331 Q335 A336 I345	L283-W307 HydrophobicContact CB-CE3 4.48Å; L283-W307 HydrophobicContact CB-CH2 3.52Å; L283-W307 HydrophobicContact CB-CZ2 4.26Å; L283-W307 HydrophobicContact CB-CZ3 3.65Å; L283-W307 HydrophobicContact CD1-CH2 3.8Å; L283-W307 HydrophobicContact CD1-CZ2 4.48Å; L283-W307 HydrophobicContact CG-CH2 4.29Å; L286-W307 HydrophobicContact CD1-CH2 4.06Å; L286-W307 HydrophobicContact CD1-CZ3 4.16Å; L286-W307 HydrophobicContact CD2-CH2 4.05Å; L286-W307 HydrophobicContact CD2-CZ3 4.18Å; L286-W307 HydrophobicContact CG-CH2 3.96Å; L286-W307 HydrophobicContact CG-CZ3 3.76Å; L302-W307 HydrophobicContact CB-CZ2 3.93Å; L302-W307 HydrophobicContact CD2-CH2 4.12Å; L302-W307 HydrophobicContact CD2-CZ2 3.82Å; L302-W307 HydrophobicContact CG-CZ2 4.31Å; L302-W307 PolarHBondContact O-NE1 2.76Å; N305-W307 HydrophobicContact CB-CD2 4.21Å; N305-W307 HydrophobicContact CB-CH2 4.43Å; N305-W307 HydrophobicContact CB-CZ2 3.64Å; N305-W307 VanDerWaalsContact O-CD1 3.32Å; N305-W307 PolarHBondContact O-N 3.1Å; W307-M313 HydrophobicContact CE3-CE 3.72Å; W307-M313 HydrophobicContact CZ3-CE 4.34Å; W307-G331 PolarHBondContact NE1-O 2.81Å; W307-Q335 PolarHBondContact O-N 3.07Å; W307-A336 PolarHBondContact O-N 3.11Å; W307-A336 VanDerWaalsContact O-N 3.12Å; W307-I345 HydrophobicContact CB-CD1 4.32Å; W307-I345 HydrophobicContact CG-CD1 4.42Å
308	H	95.7	Very high	95.1	Very high	88 Å²	88	40.8 Å²	40.8	41%	0.407	20%	0.198	S	C	.	.	B	Isolated β-bridge	trans	-101	102.7	175.8	-179.8	-76	0	0	0	110.5	S284 P306 G310 A336	S284-H308 PolarHBondContact O-N 2.77Å; P306-H308 PolarHBondContact O-N 3.07Å; H308-G310 VanDerWaalsContact C-N 3.27Å; H308-G310 PolarHBondContact ND1-N 3.23Å; H308-G310 PolarHBondContact O-N 3.26Å; H308-A336 CarbonylContact C-O 3.16Å; H308-A336 WeakPolarHBondContact CA-O 2.99Å
309	C	94.6	Very high	95	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.014	20%	0.201	C	C	.	.			trans	-83	64.8	-176.2	-63.5	0	0	0	0	112.4	C334 A336 V340 I345 L348 F353	C309-C334 HydrophobicContact CB-CB 3.84Å; C309-C334 WeakPolarHBondContact CB-SG 3.26Å; C309-C334 WeakPolarHBondContact SG-CA 3.45Å; C309-C334 WeakPolarHBondContact SG-CB 3.43Å; C309-C334 CovalentContact SG-SG 2.02Å; C309-C334 PolarHBondContact SG-SG 2.85Å; C309-A336 PolarHBondContact N-O 3.13Å; C309-V340 HydrophobicContact CB-CG2 3.98Å; C309-I345 VanDerWaalsContact SG-CG1 3.54Å; C309-L348 HydrophobicContact CB-CD1 4.17Å; C309-F353 HydrophobicContact CB-CE1 4.15Å
310	G	91.6	Very high	94.9	Very high	12 Å²	12	42 Å²	42	12%	0.124	20%	0.202	C	C	.	.	S	Bend	trans	-103.9	-169.8	167.1	0	0	0	0	0	111.8	H308 K312 M313 F353	H308-G310 VanDerWaalsContact C-N 3.27Å; H308-G310 PolarHBondContact ND1-N 3.23Å; H308-G310 PolarHBondContact O-N 3.26Å; G310-K312 PolarHBondContact O-N 2.75Å; G310-M313 WeakPolarHBondContact O-CB 3.08Å; G310-M313 PolarHBondContact O-N 3.34Å; G310-F353 WeakPolarHBondContact O-CD1 3.2Å
311	C	90.8	Very high	94.6	Very high	59 Å²	59	48 Å²	48	40%	0.399	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-53.1	-35.4	-172.8	-161.9	0	0	0	0	115	M313 K314 C355	C311-M313 PolarHBondContact O-N 3.29Å; C311-K314 VanDerWaalsContact O-CB 3.32Å; C311-K314 WeakPolarHBondContact O-CB 3.47Å; C311-K314 PolarHBondContact O-N 2.95Å; C311-K314 VanDerWaalsContact O-N 3.09Å; C311-C355 WeakPolarHBondContact CA-SG 3.34Å; C311-C355 HydrophobicContact CB-CB 3.9Å; C311-C355 WeakPolarHBondContact CB-SG 3.19Å; C311-C355 VanDerWaalsContact SG-CA 3.57Å; C311-C355 WeakPolarHBondContact SG-CB 3.31Å; C311-C355 CovalentContact SG-SG 2.04Å; C311-C355 PolarHBondContact SG-SG 2.96Å
312	K	91.4	Very high	94.4	Very high	152 Å²	152	51.5 Å²	51.5	66%	0.661	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-60.5	-14.1	175	-65.5	-173.8	177.3	-176	0	114.9	G310 W315	G310-K312 PolarHBondContact O-N 2.75Å; K312-W315 PolarHBondContact O-NE1 2.86Å
313	M	93.3	Very high	94.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-100.6	-7.6	179.7	-163.5	60.7	68.5	0	0	112.9	N285 W307 G310 C311 W315 V316 R317 I345 F353	N285-M313 HydrophobicContact CB-CE 4.45Å; W307-M313 HydrophobicContact CE3-CE 3.72Å; W307-M313 HydrophobicContact CZ3-CE 4.34Å; G310-M313 WeakPolarHBondContact O-CB 3.08Å; G310-M313 PolarHBondContact O-N 3.34Å; C311-M313 PolarHBondContact O-N 3.29Å; M313-W315 VanDerWaalsContact C-N 3.32Å; M313-W315 PolarHBondContact O-N 3.45Å; M313-V316 HydrophobicContact CG-CB 4.34Å; M313-V316 WeakPolarHBondContact O-CB 3.35Å; M313-V316 PolarHBondContact O-N 3.02Å; M313-V316 HydrophobicContact SD-CB 3.62Å; M313-V316 HydrophobicContact SD-CG1 3.97Å; M313-V316 HydrophobicContact SD-CG2 3.49Å; M313-V316 WeakPolarHBondContact SD-CG2 3.42Å; M313-R317 PolarHBondContact O-N 3.15Å; M313-I345 HydrophobicContact CE-CD1 4.43Å; M313-I345 HydrophobicContact CG-CD1 3.77Å; M313-I345 HydrophobicContact CG-CG1 4.32Å; M313-I345 HydrophobicContact CG-CG2 4.02Å; M313-I345 HydrophobicContact SD-CD1 3.75Å; M313-F353 HydrophobicContact CB-CD1 4.39Å; M313-F353 HydrophobicContact CB-CE1 4.02Å; M313-F353 HydrophobicContact CG-CE1 4.29Å
314	K	92.3	Very high	94	Very high	79 Å²	79	51.2 Å²	51.2	34%	0.343	27%	0.269	S	S	.	.	H	α-helix	trans	-56.4	-45.2	-179.3	-178.8	178.5	175.2	-179.9	0	111.9	C311 V316 R317 D318 F353	C311-K314 VanDerWaalsContact O-CB 3.32Å; C311-K314 WeakPolarHBondContact O-CB 3.47Å; C311-K314 PolarHBondContact O-N 2.95Å; C311-K314 VanDerWaalsContact O-N 3.09Å; K314-V316 VanDerWaalsContact C-N 3.25Å; K314-V316 PolarHBondContact O-N 3.17Å; K314-R317 WeakPolarHBondContact O-CB 3.4Å; K314-R317 PolarHBondContact O-N 3.22Å; K314-D318 PolarHBondContact O-N 3.25Å; K314-D318 VanDerWaalsContact O-N 3.16Å; K314-F353 HydrophobicContact CB-CG 4.46Å
315	W	94.2	Very high	93.6	Very high	33 Å²	33	54.6 Å²	54.6	13%	0.125	29%	0.286	C	S	.	.	H	α-helix	trans	-60.3	-33.8	177.8	81.7	-96.2	0	0	0	112.7	L286 P287 Q288 V290 F291 K312 M313 D318 W319	L286-W315 HydrophobicContact CB-CZ2 3.85Å; L286-W315 PolarHBondContact O-NE1 3.15Å; L286-W315 VanDerWaalsContact O-NE1 3.12Å; P287-W315 WeakPolarHBondContact O-CZ2 3.48Å; Q288-W315 HydrophobicContact CB-CD2 4.28Å; Q288-W315 HydrophobicContact CB-CG 4.07Å; Q288-W315 HydrophobicContact CG-CB 4.17Å; Q288-W315 HydrophobicContact CG-CD2 4.17Å; Q288-W315 HydrophobicContact CG-CG 3.93Å; V290-W315 HydrophobicContact CG1-CH2 4.1Å; V290-W315 HydrophobicContact CG1-CZ2 4.21Å; F291-W315 HydrophobicContact CD2-CH2 4.02Å; F291-W315 HydrophobicContact CE2-CH2 4.43Å; K312-W315 PolarHBondContact O-NE1 2.86Å; M313-W315 VanDerWaalsContact C-N 3.32Å; M313-W315 PolarHBondContact O-N 3.45Å; W315-D318 PolarHBondContact O-N 2.98Å; W315-W319 HydrophobicContact CE3-CB 4.07Å; W315-W319 HydrophobicContact CZ3-CB 4.12Å; W315-W319 HydrophobicContact CZ3-CD2 4.47Å; W315-W319 HydrophobicContact CZ3-CG 4.1Å; W315-W319 VanDerWaalsContact O-CB 3.23Å; W315-W319 WeakPolarHBondContact O-CB 3.4Å; W315-W319 PolarHBondContact O-N 2.77Å
316	V	95.4	Very high	93.3	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-67.8	-38.3	180	178.1	0	0	0	0	110.8	L286 M313 K314 L320 L332 I345	L286-V316 HydrophobicContact CB-CG2 4.47Å; L286-V316 HydrophobicContact CD1-CG2 4.48Å; M313-V316 HydrophobicContact CG-CB 4.34Å; M313-V316 WeakPolarHBondContact O-CB 3.35Å; M313-V316 PolarHBondContact O-N 3.02Å; M313-V316 HydrophobicContact SD-CB 3.62Å; M313-V316 HydrophobicContact SD-CG1 3.97Å; M313-V316 HydrophobicContact SD-CG2 3.49Å; M313-V316 WeakPolarHBondContact SD-CG2 3.42Å; K314-V316 VanDerWaalsContact C-N 3.25Å; K314-V316 PolarHBondContact O-N 3.17Å; V316-L320 HydrophobicContact CG1-CD1 4.22Å; V316-L320 HydrophobicContact CG1-CG 4.42Å; V316-L320 WeakPolarHBondContact O-CB 3.44Å; V316-L320 WeakPolarHBondContact O-CG 3.33Å; V316-L320 PolarHBondContact O-N 3.13Å; V316-L332 HydrophobicContact CG1-CD2 3.4Å; V316-I345 HydrophobicContact CB-CG2 4.48Å; V316-I345 HydrophobicContact CG1-CG2 4.28Å
317	R	94.2	Very high	93.1	Very high	23 Å²	23	61.2 Å²	61.2	9%	0.087	31%	0.313	C	S	.	.	H	α-helix	trans	-62.5	-49.8	171.2	176.4	-157.3	66.7	171.6	0.6	110.8	M313 K314 W319 L320 Q321 I345 L348 N349 F353	M313-R317 PolarHBondContact O-N 3.15Å; K314-R317 WeakPolarHBondContact O-CB 3.4Å; K314-R317 PolarHBondContact O-N 3.22Å; R317-W319 PolarHBondContact O-N 3.11Å; R317-L320 PolarHBondContact O-N 3.48Å; R317-L320 VanDerWaalsContact O-N 3.09Å; R317-Q321 WeakPolarHBondContact O-CG 3.41Å; R317-Q321 PolarHBondContact O-N 3.14Å; R317-I345 HydrophobicContact CB-CG2 4.01Å; R317-I345 WeakPolarHBondContact CG-O 3.14Å; R317-L348 WeakPolarHBondContact CD-O 3.43Å; R317-L348 PolarHBondContact NH1-O 2.98Å; R317-N349 VanDerWaalsContact NH1-C 3.31Å; R317-F353 HydrophobicContact CB-CZ 4.28Å
318	D	93	Very high	93	Very high	67 Å²	67	63.6 Å²	63.6	36%	0.358	33%	0.326	S	S	.	.	H	α-helix	trans	-61.5	-38	-176.1	-59.8	-17.1	0	0	0	110.7	K314 W315 Q321 S322	K314-D318 PolarHBondContact O-N 3.25Å; K314-D318 VanDerWaalsContact O-N 3.16Å; W315-D318 PolarHBondContact O-N 2.98Å; D318-Q321 PolarHBondContact O-N 2.86Å; D318-S322 PolarHBondContact O-N 2.97Å; D318-S322 VanDerWaalsContact O-N 3.14Å; D318-S322 PolarHBondContact O-OG 3.02Å
319	W	94.9	Very high	92.9	Very high	36 Å²	36	60.3 Å²	60.3	14%	0.136	31%	0.312	C	S	.	.	H	α-helix	trans	-64.1	-48.5	170.1	178.6	82.4	0	0	0	112.6	F291 L300 W315 R317 Q321 S322 L323 V329	F291-W319 HydrophobicContact CB-CZ2 3.94Å; F291-W319 HydrophobicContact CD2-CE3 4.44Å; F291-W319 AromaticContact CD2-CH2 3.69Å; F291-W319 HydrophobicContact CD2-CH2 3.69Å; F291-W319 AromaticContact CD2-CZ2 3.76Å; F291-W319 HydrophobicContact CD2-CZ2 3.76Å; F291-W319 HydrophobicContact CD2-CZ3 4.04Å; F291-W319 HydrophobicContact CE2-CH2 4.19Å; F291-W319 HydrophobicContact CE2-CZ3 4.29Å; F291-W319 HydrophobicContact CG-CH2 4.44Å; F291-W319 HydrophobicContact CG-CZ2 4.2Å; L300-W319 HydrophobicContact CD2-CH2 3.58Å; L300-W319 HydrophobicContact CD2-CZ3 4.11Å; W315-W319 HydrophobicContact CE3-CB 4.07Å; W315-W319 HydrophobicContact CZ3-CB 4.12Å; W315-W319 HydrophobicContact CZ3-CD2 4.47Å; W315-W319 HydrophobicContact CZ3-CG 4.1Å; W315-W319 VanDerWaalsContact O-CB 3.23Å; W315-W319 WeakPolarHBondContact O-CB 3.4Å; W315-W319 PolarHBondContact O-N 2.77Å; R317-W319 PolarHBondContact O-N 3.11Å; W319-Q321 PolarHBondContact O-N 2.94Å; W319-Q321 VanDerWaalsContact O-N 3.15Å; W319-S322 PolarHBondContact O-N 3.05Å; W319-S322 PolarHBondContact O-OG 3.29Å; W319-S322 VanDerWaalsContact O-OG 3.06Å; W319-L323 HydrophobicContact CD2-CD1 4.36Å; W319-L323 HydrophobicContact CD2-CG 4.31Å; W319-L323 HydrophobicContact CE3-CD1 4.09Å; W319-L323 HydrophobicContact CH2-CD1 3.8Å; W319-L323 HydrophobicContact CH2-CD2 4.35Å; W319-L323 HydrophobicContact CH2-CG 4.47Å; W319-L323 HydrophobicContact CZ2-CD1 4.09Å; W319-L323 HydrophobicContact CZ2-CD2 3.82Å; W319-L323 HydrophobicContact CZ2-CG 4.29Å; W319-L323 HydrophobicContact CZ3-CD1 3.81Å; W319-L323 WeakPolarHBondContact O-CG 3.3Å; W319-L323 PolarHBondContact O-N 2.76Å; W319-V329 HydrophobicContact CH2-CG2 4.42Å
320	L	94.1	Very high	92.9	Very high	33 Å²	33	66.3 Å²	66.3	17%	0.173	34%	0.335	C	S	.	.	H	α-helix	trans	-58.8	-27.4	176	-75.6	172.4	0	0	0	113.2	V316 R317 L323 V329 L332 I345 K346	V316-L320 HydrophobicContact CG1-CD1 4.22Å; V316-L320 HydrophobicContact CG1-CG 4.42Å; V316-L320 WeakPolarHBondContact O-CB 3.44Å; V316-L320 WeakPolarHBondContact O-CG 3.33Å; V316-L320 PolarHBondContact O-N 3.13Å; R317-L320 PolarHBondContact O-N 3.48Å; R317-L320 VanDerWaalsContact O-N 3.09Å; L320-L323 HydrophobicContact CD2-CD1 4.03Å; L320-V329 HydrophobicContact CD2-CB 4.01Å; L320-V329 HydrophobicContact CD2-CG1 3.86Å; L320-V329 HydrophobicContact CD2-CG2 4.16Å; L320-L332 HydrophobicContact CD1-CB 4.4Å; L320-L332 HydrophobicContact CD1-CD2 4.35Å; L320-L332 HydrophobicContact CD2-CD1 4.43Å; L320-I345 HydrophobicContact CD1-CB 4.28Å; L320-I345 HydrophobicContact CD1-CG2 4.23Å; L320-K346 HydrophobicContact CB-CB 4.08Å; L320-K346 HydrophobicContact CD1-CB 4.04Å
321	Q	91.9	Very high	92.9	Very high	124 Å²	124	66.5 Å²	66.5	58%	0.579	34%	0.337	S	S	*	.	H	α-helix	trans	-84.1	-24.5	176.3	-69	-179.6	0.4	0	0	113.3	R317 D318 W319 K346	R317-Q321 WeakPolarHBondContact O-CG 3.41Å; R317-Q321 PolarHBondContact O-N 3.14Å; D318-Q321 PolarHBondContact O-N 2.86Å; W319-Q321 PolarHBondContact O-N 2.94Å; W319-Q321 VanDerWaalsContact O-N 3.15Å; Q321-K346 PolarHBondContact NE2-O 3.33Å
322	S	93.8	Very high	93.1	Very high	89 Å²	89	64.3 Å²	64.3	62%	0.622	32%	0.321	S	S	*	.	H	α-helix	trans	-89.2	-11.6	175.5	68.7	0	0	0	0	114	D318 W319	D318-S322 PolarHBondContact O-N 2.97Å; D318-S322 VanDerWaalsContact O-N 3.14Å; D318-S322 PolarHBondContact O-OG 3.02Å; W319-S322 PolarHBondContact O-N 3.05Å; W319-S322 PolarHBondContact O-OG 3.29Å; W319-S322 VanDerWaalsContact O-OG 3.06Å
323	L	92.5	Very high	93.2	Very high	36 Å²	36	62.4 Å²	62.4	19%	0.188	32%	0.315	C	S	.	.	S	Bend	trans	-60.9	139.4	-179.9	-83.4	179.1	0	0	0	113.7	W319 L320 V327 V329	W319-L323 HydrophobicContact CD2-CD1 4.36Å; W319-L323 HydrophobicContact CD2-CG 4.31Å; W319-L323 HydrophobicContact CE3-CD1 4.09Å; W319-L323 HydrophobicContact CH2-CD1 3.8Å; W319-L323 HydrophobicContact CH2-CD2 4.35Å; W319-L323 HydrophobicContact CH2-CG 4.47Å; W319-L323 HydrophobicContact CZ2-CD1 4.09Å; W319-L323 HydrophobicContact CZ2-CD2 3.82Å; W319-L323 HydrophobicContact CZ2-CG 4.29Å; W319-L323 HydrophobicContact CZ3-CD1 3.81Å; W319-L323 WeakPolarHBondContact O-CG 3.3Å; W319-L323 PolarHBondContact O-N 2.76Å; L320-L323 HydrophobicContact CD2-CD1 4.03Å; L323-V327 HydrophobicContact CD1-CB 4.49Å; L323-V327 HydrophobicContact CD1-CG1 4.26Å; L323-V327 HydrophobicContact CD2-CB 4.31Å; L323-V327 HydrophobicContact CD2-CG1 4.24Å; L323-V327 HydrophobicContact CD2-CG2 4.24Å; L323-V329 HydrophobicContact CD1-CG2 3.47Å; L323-V329 VanDerWaalsContact CD1-CG2 3.47Å
324	P	91.6	Very high	93.3	Very high	87 Å²	87	62.6 Å²	62.6	57%	0.565	32%	0.317	S	S	*	.			trans	-62.9	145.6	170.8	-21.1	32.4	0	0	0	112.8	K326 V327	P324-K326 PolarHBondContact O-N 3.27Å; P324-V327 HydrophobicContact CB-CG2 4.41Å; P324-V327 HydrophobicContact CG-CG2 4.48Å; P324-V327 PolarHBondContact O-N 2.7Å
325	L	87.9	Confident	93.5	Very high	190 Å²	190	63.3 Å²	63.3	100%	0.995	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-18.3	178.5	-65.6	174.7	0	0	0	115.3	V327	L325-V327 VanDerWaalsContact C-N 3.33Å
326	K	91.4	Very high	93.5	Very high	151 Å²	151	63.2 Å²	63.2	66%	0.657	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-27.3	175.2	-175.5	-174.1	169.8	-161.1	0	112.5	T298 P324 N328	T298-K326 HydrophobicContact CG2-CG 4.26Å; P324-K326 PolarHBondContact O-N 3.27Å; K326-N328 PolarHBondContact O-N 3.17Å
327	V	93.4	Very high	93.3	Very high	24 Å²	24	65.7 Å²	65.7	15%	0.145	34%	0.344	C	S	.	.			trans	-82.8	108.8	-172.3	-169.2	0	0	0	0	110.1	I297 L323 P324 L325 V329	I297-V327 HydrophobicContact CG2-CG1 4.18Å; I297-V327 WeakPolarHBondContact O-CG2 3.48Å; L323-V327 HydrophobicContact CD1-CB 4.49Å; L323-V327 HydrophobicContact CD1-CG1 4.26Å; L323-V327 HydrophobicContact CD2-CB 4.31Å; L323-V327 HydrophobicContact CD2-CG1 4.24Å; L323-V327 HydrophobicContact CD2-CG2 4.24Å; P324-V327 HydrophobicContact CB-CG2 4.41Å; P324-V327 HydrophobicContact CG-CG2 4.48Å; P324-V327 PolarHBondContact O-N 2.7Å; L325-V327 VanDerWaalsContact C-N 3.33Å; V327-V329 HydrophobicContact CG1-CG2 3.87Å; V327-V329 PolarHBondContact O-N 2.9Å
328	N	94.1	Very high	93.2	Very high	51 Å²	51	70.8 Å²	70.8	27%	0.273	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	98.3	176.8	-176.3	16.5	0	0	0	110.2	T298 L300 K326 R330	T298-N328 PolarHBondContact O-N 3.08Å; L300-N328 PolarHBondContact N-O 2.99Å; K326-N328 PolarHBondContact O-N 3.17Å; N328-R330 PolarHBondContact OD1-NE 3.24Å; N328-R330 PolarHBondContact OD1-NH1 3.04Å; N328-R330 PolarHBondContact OD1-NH2 3.07Å
329	V	95.2	Very high	93.1	Very high	19 Å²	19	76.4 Å²	76.4	12%	0.115	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	135.3	172.5	-167.3	0	0	0	0	110.8	L300 W319 L320 L323 V327 L332	L300-V329 HydrophobicContact CB-CG1 4.22Å; L300-V329 HydrophobicContact CB-CG2 4.25Å; L300-V329 HydrophobicContact CD2-CG1 4.03Å; L300-V329 HydrophobicContact CD2-CG2 4.49Å; L300-V329 HydrophobicContact CG-CG1 4.21Å; L300-V329 WeakPolarHBondContact O-CA 3.46Å; W319-V329 HydrophobicContact CH2-CG2 4.42Å; L320-V329 HydrophobicContact CD2-CB 4.01Å; L320-V329 HydrophobicContact CD2-CG1 3.86Å; L320-V329 HydrophobicContact CD2-CG2 4.16Å; L323-V329 HydrophobicContact CD1-CG2 3.47Å; L323-V329 VanDerWaalsContact CD1-CG2 3.47Å; V327-V329 HydrophobicContact CG1-CG2 3.87Å; V327-V329 PolarHBondContact O-N 2.9Å; V329-L332 HydrophobicContact CG1-CD1 3.25Å
330	R	94.2	Very high	92.9	Very high	128 Å²	128	75 Å²	75	48%	0.483	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	142.6	-179.4	-64.6	-66.5	-178.3	-105.9	4.6	111.8	L300 F301 L302 N328	L300-R330 PolarHBondContact O-N 3.35Å; F301-R330 HydrophobicContact CD1-CB 4.05Å; F301-R330 HydrophobicContact CD1-CG 4.41Å; F301-R330 HydrophobicContact CE1-CB 4.44Å; F301-R330 HydrophobicContact CE1-CG 4.3Å; L302-R330 PolarHBondContact N-O 2.94Å; N328-R330 PolarHBondContact OD1-NE 3.24Å; N328-R330 PolarHBondContact OD1-NH1 3.04Å; N328-R330 PolarHBondContact OD1-NH2 3.07Å
331	G	91.2	Very high	92.9	Very high	16 Å²	16	79.9 Å²	79.9	17%	0.165	40%	0.401	C	S	.	.			trans	104.5	-7.2	168.9	0	0	0	0	0	116.9	L302 W307 M333	L302-G331 CarbonylContact O-C 3.37Å; W307-G331 PolarHBondContact NE1-O 2.81Å; G331-M333 VanDerWaalsContact C-N 3.3Å; G331-M333 PolarHBondContact O-N 3.44Å
332	L	94.5	Very high	92.9	Very high	13 Å²	13	76.6 Å²	76.6	7%	0.068	40%	0.401	C	S	.	.			trans	-78	77.3	175.6	-65.5	104.8	0	0	0	112.1	L302 V316 L320 V329 I345	L302-L332 HydrophobicContact CB-CD1 4.19Å; L302-L332 HydrophobicContact CB-CG 4.32Å; L302-L332 HydrophobicContact CD1-CD1 3.69Å; L302-L332 HydrophobicContact CD1-CD2 4.19Å; L302-L332 HydrophobicContact CD1-CG 4.03Å; V316-L332 HydrophobicContact CG1-CD2 3.4Å; L320-L332 HydrophobicContact CD1-CB 4.4Å; L320-L332 HydrophobicContact CD1-CD2 4.35Å; L320-L332 HydrophobicContact CD2-CD1 4.43Å; V329-L332 HydrophobicContact CG1-CD1 3.25Å; L332-I345 HydrophobicContact CB-CB 4.29Å; L332-I345 HydrophobicContact CB-CD1 3.79Å; L332-I345 HydrophobicContact CB-CG1 4.3Å; L332-I345 HydrophobicContact CD2-CD1 4.09Å; L332-I345 HydrophobicContact CG-CD1 4.48Å; L332-I345 PolarHBondContact O-N 3.1Å
333	M	94.7	Very high	92.8	Very high	111 Å²	111	76.6 Å²	76.6	55%	0.547	39%	0.392	S	S	.	.	B	Isolated β-bridge	trans	-117.6	134.1	172.3	-60	-179.2	-60.9	0	0	109.2	G331 Q335 M343	G331-M333 VanDerWaalsContact C-N 3.3Å; G331-M333 PolarHBondContact O-N 3.44Å; M333-Q335 PolarHBondContact O-N 3.39Å; M333-M343 CarbonylContact C-O 3.5Å; M333-M343 WeakPolarHBondContact CA-O 3.25Å
334	C	95.4	Very high	92.9	Very high	4 Å²	4	76.2 Å²	76.2	3%	0.027	39%	0.394	C	S	.	.			trans	-67	130.9	-177.2	-60.2	0	0	0	0	111.5	C309 V340 R341 G342 M343 L348	C309-C334 HydrophobicContact CB-CB 3.84Å; C309-C334 WeakPolarHBondContact CB-SG 3.26Å; C309-C334 WeakPolarHBondContact SG-CA 3.45Å; C309-C334 WeakPolarHBondContact SG-CB 3.43Å; C309-C334 CovalentContact SG-SG 2.02Å; C309-C334 PolarHBondContact SG-SG 2.85Å; C334-V340 HydrophobicContact CB-CG2 4.15Å; C334-V340 VanDerWaalsContact CB-O 3.26Å; C334-V340 WeakPolarHBondContact CB-O 3.5Å; C334-R341 CarbonylContact O-C 3.42Å; C334-R341 WeakPolarHBondContact O-CA 3.43Å; C334-G342 PolarHBondContact O-N 3.04Å; C334-M343 PolarHBondContact N-O 3.41Å; C334-L348 VanDerWaalsContact SG-CD1 3.54Å
335	Q	96.1	Very high	93	Very high	94 Å²	94	72.1 Å²	72.1	44%	0.439	37%	0.367	S	S	.	.			trans	-100.7	-27.5	168.6	-174.1	164.3	-20.1	0	0	111.9	W307 M333 R341	W307-Q335 PolarHBondContact O-N 3.07Å; M333-Q335 PolarHBondContact O-N 3.39Å; Q335-R341 WeakPolarHBondContact O-CD 3.49Å; Q335-R341 WeakPolarHBondContact O-CG 3.19Å
336	A	93.1	Very high	93.2	Very high	31 Å²	31	68.1 Å²	68.1	26%	0.256	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-141.1	157.6	176.1	0	0	0	0	0	111.2	W307 H308 C309	W307-A336 PolarHBondContact O-N 3.11Å; W307-A336 VanDerWaalsContact O-N 3.12Å; H308-A336 CarbonylContact C-O 3.16Å; H308-A336 WeakPolarHBondContact CA-O 2.99Å; C309-A336 PolarHBondContact N-O 3.13Å
337	P	92.9	Very high	93.1	Very high	53 Å²	53	66 Å²	66	34%	0.344	34%	0.338	S	S	.	.	S	Bend	cis	-69.8	163.4	-11.7	31	-36.1	0	0	0	112.3	K339 V340 R341	P337-K339 PolarHBondContact O-N 2.85Å; P337-V340 HydrophobicContact CG-CG2 4.12Å; P337-V340 WeakPolarHBondContact O-CG2 3.48Å; P337-V340 PolarHBondContact O-N 3.11Å; P337-R341 PolarHBondContact O-N 3.23Å
338	E	90.9	Very high	92.9	Very high	129 Å²	129	65.2 Å²	65.2	60%	0.603	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-51.5	-31.4	-176.2	-67.9	-62.7	156.2	0	0	114.1	V340 R341	E338-V340 PolarHBondContact O-N 3.45Å; E338-V340 VanDerWaalsContact O-N 3.14Å; E338-R341 PolarHBondContact O-N 2.96Å; E338-R341 IonicContact OE1-CZ 3.7Å; E338-R341 IonicContact OE1-NH1 2.86Å; E338-R341 PolarHBondContact OE1-NH1 2.88Å; E338-R341 WeakPolarHBondContact OE2-CD 3.49Å; E338-R341 IonicContact OE2-CZ 3.83Å; E338-R341 IonicContact OE2-NE 3.69Å; E338-R341 IonicContact OE2-NH1 3.84Å; E338-R341 PolarHBondContact OE2-NH1 3.2Å
339	K	90.4	Very high	92.3	Very high	186 Å²	186	66.7 Å²	66.7	81%	0.809	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-55.3	-29.7	176.8	-64.2	-177.3	-178.1	176.7	0	114.3	P337	P337-K339 PolarHBondContact O-N 2.85Å
340	V	92	Very high	91.4	Very high	5 Å²	5	67.3 Å²	67.3	3%	0.03	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-122.5	11.8	-176.8	-63.7	0	0	0	0	112.4	C309 C334 P337 E338 G342 M343 L348 L352	C309-V340 HydrophobicContact CB-CG2 3.98Å; C334-V340 HydrophobicContact CB-CG2 4.15Å; C334-V340 VanDerWaalsContact CB-O 3.26Å; C334-V340 WeakPolarHBondContact CB-O 3.5Å; P337-V340 HydrophobicContact CG-CG2 4.12Å; P337-V340 WeakPolarHBondContact O-CG2 3.48Å; P337-V340 PolarHBondContact O-N 3.11Å; E338-V340 PolarHBondContact O-N 3.45Å; E338-V340 VanDerWaalsContact O-N 3.14Å; V340-G342 PolarHBondContact O-N 2.73Å; V340-M343 HydrophobicContact CB-SD 4.11Å; V340-M343 HydrophobicContact CG1-SD 4.21Å; V340-M343 VanDerWaalsContact O-CB 3.3Å; V340-M343 WeakPolarHBondContact O-CB 3.34Å; V340-M343 WeakPolarHBondContact O-CG 3.24Å; V340-M343 PolarHBondContact O-N 2.93Å; V340-M343 VanDerWaalsContact O-N 3.12Å; V340-L348 HydrophobicContact CB-CD1 4.46Å; V340-L348 HydrophobicContact CB-CD2 4.19Å; V340-L348 HydrophobicContact CG1-CD2 3.97Å; V340-L352 HydrophobicContact CG1-CB 4.43Å
341	R	93.5	Very high	90.5	Very high	136 Å²	136	69 Å²	69	51%	0.513	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	135.3	-178.1	-178.1	174.1	179.8	173.7	-2.7	111.2	C334 Q335 P337 E338 M343	C334-R341 CarbonylContact O-C 3.42Å; C334-R341 WeakPolarHBondContact O-CA 3.43Å; Q335-R341 WeakPolarHBondContact O-CD 3.49Å; Q335-R341 WeakPolarHBondContact O-CG 3.19Å; P337-R341 PolarHBondContact O-N 3.23Å; E338-R341 PolarHBondContact O-N 2.96Å; E338-R341 IonicContact OE1-CZ 3.7Å; E338-R341 IonicContact OE1-NH1 2.86Å; E338-R341 PolarHBondContact OE1-NH1 2.88Å; E338-R341 WeakPolarHBondContact OE2-CD 3.49Å; E338-R341 IonicContact OE2-CZ 3.83Å; E338-R341 IonicContact OE2-NE 3.69Å; E338-R341 IonicContact OE2-NH1 3.84Å; E338-R341 PolarHBondContact OE2-NH1 3.2Å; R341-M343 VanDerWaalsContact C-N 3.26Å; R341-M343 PolarHBondContact O-N 3.07Å
342	G	91.4	Very high	89.8	Confident	56 Å²	56	72.8 Å²	72.8	58%	0.577	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	-11.8	-175	0	0	0	0	0	115	C334 V340	C334-G342 PolarHBondContact O-N 3.04Å; V340-G342 PolarHBondContact O-N 2.73Å
343	M	92.6	Very high	89.1	Confident	89 Å²	89	72.3 Å²	72.3	44%	0.438	38%	0.375	S	S	.	.			trans	-77.3	143.9	179.5	-57.2	-175.7	-174.8	0	0	111.4	M333 C334 V340 R341 L348	M333-M343 CarbonylContact C-O 3.5Å; M333-M343 WeakPolarHBondContact CA-O 3.25Å; C334-M343 PolarHBondContact N-O 3.41Å; V340-M343 HydrophobicContact CB-SD 4.11Å; V340-M343 HydrophobicContact CG1-SD 4.21Å; V340-M343 VanDerWaalsContact O-CB 3.3Å; V340-M343 WeakPolarHBondContact O-CB 3.34Å; V340-M343 WeakPolarHBondContact O-CG 3.24Å; V340-M343 PolarHBondContact O-N 2.93Å; V340-M343 VanDerWaalsContact O-N 3.12Å; R341-M343 VanDerWaalsContact C-N 3.26Å; R341-M343 PolarHBondContact O-N 3.07Å; M343-L348 HydrophobicContact CB-CD2 3.93Å; M343-L348 HydrophobicContact CG-CD2 4.47Å; M343-L348 HydrophobicContact SD-CD2 3.71Å
344	A	94.1	Very high	88	Confident	28 Å²	28	73.4 Å²	73.4	23%	0.231	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-77.8	134.4	175.2	0	0	0	0	0	111	K346 D347	A344-K346 VanDerWaalsContact C-N 3.27Å; A344-K346 HydrophobicContact CB-CG 4.23Å; A344-K346 PolarHBondContact O-N 3.04Å; A344-D347 PolarHBondContact O-N 3.3Å
345	I	94	Very high	87.2	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-58.2	-38.3	-172.5	-69.1	171.5	0	0	0	112.4	W307 C309 M313 V316 R317 L320 L332 D347 L348	W307-I345 HydrophobicContact CB-CD1 4.32Å; W307-I345 HydrophobicContact CG-CD1 4.42Å; C309-I345 VanDerWaalsContact SG-CG1 3.54Å; M313-I345 HydrophobicContact CE-CD1 4.43Å; M313-I345 HydrophobicContact CG-CD1 3.77Å; M313-I345 HydrophobicContact CG-CG1 4.32Å; M313-I345 HydrophobicContact CG-CG2 4.02Å; M313-I345 HydrophobicContact SD-CD1 3.75Å; V316-I345 HydrophobicContact CB-CG2 4.48Å; V316-I345 HydrophobicContact CG1-CG2 4.28Å; R317-I345 HydrophobicContact CB-CG2 4.01Å; R317-I345 WeakPolarHBondContact CG-O 3.14Å; L320-I345 HydrophobicContact CD1-CB 4.28Å; L320-I345 HydrophobicContact CD1-CG2 4.23Å; L332-I345 HydrophobicContact CB-CB 4.29Å; L332-I345 HydrophobicContact CB-CD1 3.79Å; L332-I345 HydrophobicContact CB-CG1 4.3Å; L332-I345 HydrophobicContact CD2-CD1 4.09Å; L332-I345 HydrophobicContact CG-CD1 4.48Å; L332-I345 PolarHBondContact O-N 3.1Å; I345-D347 PolarHBondContact O-N 2.99Å; I345-L348 PolarHBondContact O-N 2.81Å
346	K	91.2	Very high	86.1	Confident	106 Å²	106	78.8 Å²	78.8	46%	0.461	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-59.5	-26	178.3	56.7	165.1	-171.6	88.5	0	114.7	L320 Q321 A344	L320-K346 HydrophobicContact CB-CB 4.08Å; L320-K346 HydrophobicContact CD1-CB 4.04Å; Q321-K346 PolarHBondContact NE2-O 3.33Å; A344-K346 VanDerWaalsContact C-N 3.27Å; A344-K346 HydrophobicContact CB-CG 4.23Å; A344-K346 PolarHBondContact O-N 3.04Å
347	D	90.1	Very high	84.3	Confident	108 Å²	108	84.6 Å²	84.6	58%	0.578	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-99.9	-0.1	-171.2	-57.1	-38.3	0	0	0	112.5	A344 I345	A344-D347 PolarHBondContact O-N 3.3Å; I345-D347 PolarHBondContact O-N 2.99Å
348	L	88.3	Confident	82	Confident	7 Å²	7	89.4 Å²	89.4	4%	0.037	46%	0.458	C	S	.	.			trans	-81.4	134.4	-179	-71.7	179.6	0	0	0	113.4	C309 R317 C334 V340 M343 I345 L352 F353	C309-L348 HydrophobicContact CB-CD1 4.17Å; R317-L348 WeakPolarHBondContact CD-O 3.43Å; R317-L348 PolarHBondContact NH1-O 2.98Å; C334-L348 VanDerWaalsContact SG-CD1 3.54Å; V340-L348 HydrophobicContact CB-CD1 4.46Å; V340-L348 HydrophobicContact CB-CD2 4.19Å; V340-L348 HydrophobicContact CG1-CD2 3.97Å; M343-L348 HydrophobicContact CB-CD2 3.93Å; M343-L348 HydrophobicContact CG-CD2 4.47Å; M343-L348 HydrophobicContact SD-CD2 3.71Å; I345-L348 PolarHBondContact O-N 2.81Å; L348-L352 HydrophobicContact CD2-CD1 4.01Å; L348-F353 HydrophobicContact CB-CE2 3.65Å; L348-F353 HydrophobicContact CB-CZ 3.73Å; L348-F353 HydrophobicContact CD1-CE1 3.99Å; L348-F353 HydrophobicContact CD1-CE2 4.28Å; L348-F353 HydrophobicContact CD1-CZ 3.65Å; L348-F353 HydrophobicContact CG-CZ 4.35Å
349	N	83.3	Confident	79.8	Confident	82 Å²	82	86.2 Å²	86.2	44%	0.439	46%	0.46	S	S	.	.			trans	-68.2	153.6	170.9	-168	20.1	0	0	0	111.8	R317 E351 L352 F353	R317-N349 VanDerWaalsContact NH1-C 3.31Å; N349-E351 VanDerWaalsContact C-N 3.26Å; N349-E351 PolarHBondContact ND2-OE2 3.19Å; N349-E351 VanDerWaalsContact ND2-OE2 3.14Å; N349-E351 PolarHBondContact O-N 3.03Å; N349-L352 HydrophobicContact CB-CD1 4.26Å; N349-L352 HydrophobicContact CB-CG 4.31Å; N349-L352 PolarHBondContact O-N 2.86Å; N349-L352 VanDerWaalsContact O-N 3.16Å; N349-F353 WeakPolarHBondContact O-CD2 3.31Å
350	A	76.5	Confident	77.3	Confident	31 Å²	31	82.7 Å²	82.7	26%	0.256	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-63.8	-35.1	-173.1	0	0	0	0	0	112.3	L352 F353	A350-L352 VanDerWaalsContact C-N 3.26Å; A350-L352 PolarHBondContact O-N 2.99Å; A350-F353 PolarHBondContact O-N 2.84Å
351	E	74.4	Confident	74.7	Confident	165 Å²	165	89.3 Å²	89.3	77%	0.771	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-71.7	-15.7	-179.5	-62.4	158.8	-171.4	0	0	113.3	N349	N349-E351 VanDerWaalsContact C-N 3.26Å; N349-E351 PolarHBondContact ND2-OE2 3.19Å; N349-E351 VanDerWaalsContact ND2-OE2 3.14Å; N349-E351 PolarHBondContact O-N 3.03Å
352	L	77.3	Confident	71.9	Confident	94 Å²	94	87 Å²	87	49%	0.492	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-82.9	-19	177	-63.6	176.3	0	0	0	112.6	V340 L348 N349 A350 D354	V340-L352 HydrophobicContact CG1-CB 4.43Å; L348-L352 HydrophobicContact CD2-CD1 4.01Å; N349-L352 HydrophobicContact CB-CD1 4.26Å; N349-L352 HydrophobicContact CB-CG 4.31Å; N349-L352 PolarHBondContact O-N 2.86Å; N349-L352 VanDerWaalsContact O-N 3.16Å; A350-L352 VanDerWaalsContact C-N 3.26Å; A350-L352 PolarHBondContact O-N 2.99Å; L352-D354 PolarHBondContact O-N 2.95Å
353	F	77.8	Confident	69.1	Low	4 Å²	4	90 Å²	90	2%	0.018	50%	0.499	C	S	.	.	S	Bend	trans	-80.1	111.4	164.8	-57.6	-86.9	0	0	0	106.9	C309 G310 M313 K314 R317 L348 N349 A350 C355	C309-F353 HydrophobicContact CB-CE1 4.15Å; G310-F353 WeakPolarHBondContact O-CD1 3.2Å; M313-F353 HydrophobicContact CB-CD1 4.39Å; M313-F353 HydrophobicContact CB-CE1 4.02Å; M313-F353 HydrophobicContact CG-CE1 4.29Å; K314-F353 HydrophobicContact CB-CG 4.46Å; R317-F353 HydrophobicContact CB-CZ 4.28Å; L348-F353 HydrophobicContact CB-CE2 3.65Å; L348-F353 HydrophobicContact CB-CZ 3.73Å; L348-F353 HydrophobicContact CD1-CE1 3.99Å; L348-F353 HydrophobicContact CD1-CE2 4.28Å; L348-F353 HydrophobicContact CD1-CZ 3.65Å; L348-F353 HydrophobicContact CG-CZ 4.35Å; N349-F353 WeakPolarHBondContact O-CD2 3.31Å; A350-F353 PolarHBondContact O-N 2.84Å; F353-C355 PolarHBondContact O-N 2.95Å
354	D	72.8	Confident	66.4	Low	133 Å²	133	92.4 Å²	92.4	71%	0.711	51%	0.512	S	S	*	.			trans	-68.1	67.2	-179.7	-166	7.4	0	0	0	111.1	L352	L352-D354 PolarHBondContact O-N 2.95Å
355	C	78.2	Confident	63.4	Low	36 Å²	36	99.4 Å²	99.4	24%	0.243	54%	0.54	C	S	.	.			trans	-84.2	104.6	172.3	-71.7	0	0	0	0	107.5	C311 F353 D357	C311-C355 WeakPolarHBondContact CA-SG 3.34Å; C311-C355 HydrophobicContact CB-CB 3.9Å; C311-C355 WeakPolarHBondContact CB-SG 3.19Å; C311-C355 VanDerWaalsContact SG-CA 3.57Å; C311-C355 WeakPolarHBondContact SG-CB 3.31Å; C311-C355 CovalentContact SG-SG 2.04Å; C311-C355 PolarHBondContact SG-SG 2.96Å; F353-C355 PolarHBondContact O-N 2.95Å; C355-D357 PolarHBondContact O-N 3Å
356	K	73.6	Confident	60.4	Low	176 Å²	176	106.6 Å²	106.6	77%	0.765	58%	0.577	S	S	*	*			trans	-68.9	128.4	155.7	-65.3	-176.7	-179	-179.6	0	107.1	D358	K356-D358 PolarHBondContact O-N 2.98Å; K356-D358 VanDerWaalsContact O-N 3.08Å
357	D	54.6	Low	57.4	Low	153 Å²	153	107.9 Å²	107.9	82%	0.818	59%	0.594	S	S	*	*			trans	-63.6	110.7	167.7	-68.4	-46.3	0	0	0	107.8	C355 G359	C355-D357 PolarHBondContact O-N 3Å; D357-G359 PolarHBondContact O-N 2.82Å
358	D	45.8	Very low	54.5	Low	154 Å²	154	108.9 Å²	108.9	82%	0.824	60%	0.604	S	S	*	*			trans	-71.6	61.6	162.7	-84.4	-33.4	0	0	0	108.8	K356 V360	K356-D358 PolarHBondContact O-N 2.98Å; K356-D358 VanDerWaalsContact O-N 3.08Å; D358-V360 PolarHBondContact O-N 3.27Å
359	G	43.7	Very low	51.6	Low	62 Å²	62	113.2 Å²	113.2	64%	0.639	64%	0.641	S	S	*	*			trans	-72.2	55.2	170.6	0	0	0	0	0	111	D357 I361	D357-G359 PolarHBondContact O-N 2.82Å; G359-I361 PolarHBondContact O-N 2.74Å
360	V	37.3	Very low	49.1	Very low	111 Å²	111	116 Å²	116	67%	0.673	65%	0.654	S	S	*	*			trans	-74.9	76.7	166	-172.7	0	0	0	0	107.6	D358 S362	D358-V360 PolarHBondContact O-N 3.27Å; V360-S362 PolarHBondContact O-N 3.34Å
361	I	39	Very low	46.9	Very low	144 Å²	144	120.6 Å²	120.6	74%	0.738	68%	0.682	S	S	*	*			trans	-66.2	94.5	157.2	-61	177.8	0	0	0	105.5	G359 T363	G359-I361 PolarHBondContact O-N 2.74Å; I361-T363 HydrophobicContact CG2-CG2 4.29Å; I361-T363 PolarHBondContact O-N 3.14Å
362	S	33.8	Very low	44.5	Very low	87 Å²	87	119.3 Å²	119.3	61%	0.608	68%	0.68	S	S	*	*			trans	-63.2	88.4	170.6	-66.2	0	0	0	0	109.2	V360 I364	V360-S362 PolarHBondContact O-N 3.34Å; S362-I364 PolarHBondContact O-N 2.99Å
363	T	32.3	Very low	42.2	Very low	119 Å²	119	121.7 Å²	121.7	73%	0.73	70%	0.699	S	S	*	*			trans	-67.9	80.1	165	50	0	0	0	0	108.6	I361 Q365	I361-T363 HydrophobicContact CG2-CG2 4.29Å; I361-T363 PolarHBondContact O-N 3.14Å; T363-Q365 PolarHBondContact O-N 3.12Å
364	I	36.2	Very low	39.8	Very low	140 Å²	140	129.3 Å²	129.3	72%	0.718	74%	0.738	S	S	*	*			trans	-66.3	99.5	169	-62.1	176.6	0	0	0	106.5	S362 I366	S362-I364 PolarHBondContact O-N 2.99Å; I364-I366 PolarHBondContact O-N 3.49Å
365	Q	31.8	Very low	37.6	Very low	176 Å²	176	131.7 Å²	131.7	82%	0.822	75%	0.745	S	S	*	*			trans	-65	116.2	165.8	-73.4	-174.3	-64.4	0	0	108.1	T363 T367	T363-Q365 PolarHBondContact O-N 3.12Å; Q365-T367 PolarHBondContact O-N 2.93Å; Q365-T367 VanDerWaalsContact O-N 3.07Å
366	I	29.9	Very low	35.4	Very low	151 Å²	151	135.9 Å²	135.9	77%	0.774	77%	0.772	S	S	*	*			trans	-73.9	99	177.1	-60.2	168.1	0	0	0	108.1	I364	I364-I366 PolarHBondContact O-N 3.49Å
367	T	28.7	Very low	33.1	Very low	132 Å²	132	132.2 Å²	132.2	81%	0.81	78%	0.775	S	S	*	*			trans	-89.7	116.8	161.6	48.9	0	0	0	0	109.6	Q365	Q365-T367 PolarHBondContact O-N 2.93Å; Q365-T367 VanDerWaalsContact O-N 3.07Å
368	T	29.4	Very low	31.9	Very low	129 Å²	129	133.7 Å²	133.7	79%	0.791	78%	0.776	S	S	*	*			trans	-66	127.8	-177.3	49	0	0	0	0	113.4
369	A	27.8	Very low	31	Very low	98 Å²	98	130 Å²	130	81%	0.81	77%	0.774	S	S	*	*			trans	-146.2	116.3	156.2	0	0	0	0	0	109.9
370	I	30.5	Very low	30.2	Very low	140 Å²	140	135.1 Å²	135.1	72%	0.718	78%	0.781	S	S	*	*			trans	-95.6	138.4	176.8	-61.2	163.8	0	0	0	107.8	N372	I370-N372 WeakPolarHBondContact CG2-OD1 3.29Å
371	P	29.2	Very low	29.7	Very low	129 Å²	129	141.4 Å²	141.4	84%	0.838	79%	0.793	S	S	*	*				-127.3	141.7	121.5	1.2	19.9	0	0	0	113.1
372	N	24.3	Very low	29.1	Very low	137 Å²	137	139.7 Å²	139.7	73%	0.733	79%	0.791	S	S	*	*			trans	-79.4	146.8	176.9	-53.1	-49.3	0	0	0	112	I370	I370-N372 WeakPolarHBondContact CG2-OD1 3.29Å
373	T	29.4	Very low	28.7	Very low	145 Å²	145	142 Å²	142	89%	0.89	80%	0.801	S	S	*	*			trans	-158	164.5	134.2	29.7	0	0	0	0	111
374	L	27	Very low	28.5	Very low	163 Å²	163	141.7 Å²	141.7	85%	0.853	80%	0.804	S	S	*	*			trans	-87.1	153	-153.7	-83.2	64.4	0	0	0	116.6
375	H	27.8	Very low	28	Very low	184 Å²	184	140.7 Å²	140.7	85%	0.852	80%	0.804	S	S	*	*			trans	-68.5	150.7	154.2	-76.6	-66.1	0	0	0	112
376	P	30.4	Very low	27.8	Very low	123 Å²	123	139 Å²	139	80%	0.799	81%	0.806	S	S	*	*				-141.9	177.7	88.7	38.7	-21.9	0	0	0	112
377	A	25.4	Very low	27.6	Very low	100 Å²	100	141.1 Å²	141.1	83%	0.826	81%	0.809	S	S	*	*			cis	-147.8	-177.3	-3.1	0	0	0	0	0	110
378	Q	29.3	Very low	27.4	Very low	184 Å²	184	142.8 Å²	142.8	86%	0.86	81%	0.808	S	S	*	*			trans	-73.1	153	-171.8	-62.3	162	-42.8	0	0	115.7
379	G	27	Very low	27.2	Very low	75 Å²	75	142 Å²	142	77%	0.773	81%	0.805	S	S	*	*			trans	-150.1	109.8	157	0	0	0	0	0	110.8
380	H	27.6	Very low	27	Very low	170 Å²	170	144.9 Å²	144.9	79%	0.787	81%	0.807	S	S	*	*			trans	-90.7	143.9	176.7	-90.4	67.3	0	0	0	111.3
381	W	25.9	Very low	26.9	Very low	244 Å²	244	145.2 Å²	145.2	92%	0.924	81%	0.809	S	S	*	*			trans	-132	153.5	159.4	-78.1	92.7	0	0	0	109.8
382	P	27	Very low	26.7	Very low	107 Å²	107	148.1 Å²	148.1	70%	0.695	81%	0.808	S	S	*	*			trans	-90.6	161.8	-152.1	34.8	-37	0	0	0	115.7
383	V	26.7	Very low	26.8	Very low	135 Å²	135	147.3 Å²	147.3	82%	0.818	81%	0.808	S	S	*	*			trans	-76.6	120.9	174.3	178.3	0	0	0	0	110.8
384	S	26.9	Very low	26.8	Very low	113 Å²	113	146.2 Å²	146.2	79%	0.79	80%	0.803	S	S	*	*			trans	-89.3	108.3	172.4	-65.4	0	0	0	0	111.3
385	V	26.1	Very low	26.7	Very low	119 Å²	119	146 Å²	146	72%	0.721	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-72.9	123	172.4	175.1	0	0	0	0	110.2	K387	V385-K387 HydrophobicContact CG1-CG 4.36Å
386	T	26.8	Very low	27.1	Very low	140 Å²	140	145.2 Å²	145.2	86%	0.859	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-100.7	116.3	162.2	38.1	0	0	0	0	110.2
387	K	26.7	Very low	27.1	Very low	196 Å²	196	146.4 Å²	146.4	85%	0.852	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-79.8	131.2	172.8	-76.2	-178	175.3	179.1	0	110.3	V385	V385-K387 HydrophobicContact CG1-CG 4.36Å
388	Q	24.8	Very low	27.1	Very low	168 Å²	168	149.7 Å²	149.7	79%	0.785	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-73.9	138.8	171.5	-176	176.6	8.7	0	0	110.9
389	P	25.2	Very low	27	Very low	111 Å²	111	149 Å²	149	72%	0.721	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-90.6	148.3	164.8	32.1	-27.8	0	0	0	111.9
390	D	23.9	Very low	27	Very low	160 Å²	160	154.6 Å²	154.6	86%	0.856	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-64.4	134.2	-169.6	-69.7	-62.7	0	0	0	115.5
391	I	27.7	Very low	26.9	Very low	146 Å²	146	158 Å²	158	75%	0.749	81%	0.807	S	S	*	*			trans	-85.3	110.3	165.4	-63.7	171.4	0	0	0	108.7
392	K	25.5	Very low	26.8	Very low	191 Å²	191	152.6 Å²	152.6	83%	0.83	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-88.9	124.4	165.2	-75.4	-177	178.1	176	0	110.3
393	T	26.6	Very low	26.8	Very low	120 Å²	120	153.5 Å²	153.5	74%	0.736	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-70.8	136.9	176.8	44.2	0	0	0	0	112.1
394	P	27.7	Very low	26.9	Very low	121 Å²	121	151.6 Å²	151.6	79%	0.786	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-85.4	134.1	165.1	-7.3	25.6	0	0	0	111.1
395	N	26.1	Very low	27	Very low	159 Å²	159	151.3 Å²	151.3	85%	0.85	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.1	133.3	-179.8	-72.8	-68.6	0	0	0	113.2	N397	N395-N397 PolarHBondContact O-N 3.33Å; N395-N397 VanDerWaalsContact O-N 3.16Å
396	L	35.1	Very low	27.5	Very low	167 Å²	167	151.5 Å²	151.5	87%	0.874	81%	0.805	S	S	*	*	S	Bend	trans	-68.8	102.3	159.3	-99.6	76.5	0	0	0	109.7
397	N	30.3	Very low	28.3	Very low	149 Å²	149	151 Å²	151	80%	0.797	80%	0.801	S	S	*	*			trans	169.9	86.4	139.9	-93.3	-22.4	0	0	0	111.5	N395	N395-N397 PolarHBondContact O-N 3.33Å; N395-N397 VanDerWaalsContact O-N 3.16Å
398	K	27.3	Very low	29.4	Very low	169 Å²	169	152.7 Å²	152.7	74%	0.735	80%	0.802	S	S	*	*			trans	-142.6	111.7	154.2	-80.6	-166.8	176.4	176.2	0	110	Y400	K398-Y400 HydrophobicContact CB-CD2 4.3Å; K398-Y400 HydrophobicContact CB-CE2 3.98Å; K398-Y400 HydrophobicContact CD-CE2 4.49Å; K398-Y400 PolarHBondContact O-N 3.2Å
399	N	26.3	Very low	31	Very low	169 Å²	169	150.5 Å²	150.5	90%	0.904	79%	0.79	S	S	*	*			trans	-68.1	99.6	170.8	-74	-19	0	0	0	109.7	R401	N399-R401 PolarHBondContact O-N 2.9Å
400	Y	26.1	Very low	33.1	Very low	193 Å²	193	147 Å²	147	76%	0.757	77%	0.765	S	S	*	*			trans	-82.9	111	163.8	-79.3	-81.8	0	0	0	109.1	K398 T402	K398-Y400 HydrophobicContact CB-CD2 4.3Å; K398-Y400 HydrophobicContact CB-CE2 3.98Å; K398-Y400 HydrophobicContact CD-CE2 4.49Å; K398-Y400 PolarHBondContact O-N 3.2Å; Y400-T402 PolarHBondContact O-N 2.86Å; Y400-T402 VanDerWaalsContact O-N 3.1Å
401	R	25.4	Very low	35.6	Very low	242 Å²	242	139.7 Å²	139.7	91%	0.913	73%	0.726	S	S	*	*			trans	-79.3	86.9	177.4	-166.2	-178	-162.6	-180	5.1	108.7	N399 T403	N399-R401 PolarHBondContact O-N 2.9Å; R401-T403 PolarHBondContact O-N 3.03Å
402	T	25	Very low	38.2	Very low	130 Å²	130	135.4 Å²	135.4	80%	0.798	71%	0.707	S	S	*	*			trans	-70.3	99.7	-179.3	-25.7	0	0	0	0	110.4	Y400 A404	Y400-T402 PolarHBondContact O-N 2.86Å; Y400-T402 VanDerWaalsContact O-N 3.1Å; T402-A404 PolarHBondContact O-N 3Å; T402-A404 VanDerWaalsContact O-N 3.09Å
403	T	27.1	Very low	41.1	Very low	126 Å²	126	127.1 Å²	127.1	77%	0.773	67%	0.671	S	S	*	*			trans	-71.2	97.7	165.7	46.4	0	0	0	0	108.7	R401 S405	R401-T403 PolarHBondContact O-N 3.03Å; T403-S405 PolarHBondContact O-N 3.09Å
404	A	27.9	Very low	43.9	Very low	94 Å²	94	126.1 Å²	126.1	78%	0.777	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-71.6	116.8	175.1	0	0	0	0	0	110.4	T402	T402-A404 PolarHBondContact O-N 3Å; T402-A404 VanDerWaalsContact O-N 3.09Å
405	S	29.8	Very low	46.8	Very low	107 Å²	107	121.8 Å²	121.8	75%	0.748	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-72.6	139.2	165.3	-55.5	0	0	0	0	109.4	T403 V407	T403-S405 PolarHBondContact O-N 3.09Å; S405-V407 PolarHBondContact O-N 3.1Å
406	P	37.1	Very low	49.6	Very low	123 Å²	123	121.4 Å²	121.4	80%	0.799	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-70.6	130	-178.9	28.1	-33.7	0	0	0	111.3	R408	P406-R408 PolarHBondContact O-N 3.01Å
407	V	41.8	Very low	51.7	Low	130 Å²	130	115.6 Å²	115.6	79%	0.788	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-61.2	127	168	177.9	0	0	0	0	108.3	S405 K409	S405-V407 PolarHBondContact O-N 3.1Å; V407-K409 PolarHBondContact O-N 2.75Å
408	R	49.8	Very low	54.1	Low	231 Å²	231	112.8 Å²	112.8	87%	0.872	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-76.6	119	177	-72.8	-178.3	174.5	178.7	-2.1	109.4	P406	P406-R408 PolarHBondContact O-N 3.01Å
409	K	58.8	Low	56.6	Low	122 Å²	122	106.6 Å²	106.6	53%	0.53	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-60	135.4	169.9	-71.8	-174.1	167	-129.1	0	110.4	V407 E495	V407-K409 PolarHBondContact O-N 2.75Å; K409-E495 VanDerWaalsContact CD-OE1 3.23Å; K409-E495 WeakPolarHBondContact CD-OE1 3.39Å; K409-E495 VanDerWaalsContact CE-OE1 3.25Å; K409-E495 WeakPolarHBondContact CE-OE1 3.46Å; K409-E495 IonicContact NZ-OE1 3.22Å; K409-E495 PolarHBondContact NZ-OE1 3.28Å; K409-E495 IonicContact NZ-OE2 2.7Å; K409-E495 PolarHBondContact NZ-OE2 3.26Å
410	I	69.7	Low	59.2	Low	38 Å²	38	100.5 Å²	100.5	20%	0.195	53%	0.527	C	S	.	.	S	Bend	trans	-79.2	-37.9	-176.1	-62.9	146.9	0	0	0	111.2	A430 M433 L489 D491	I410-A430 PolarHBondContact O-N 3.04Å; I410-M433 HydrophobicContact CG2-CE 3.43Å; I410-M433 VanDerWaalsContact CG2-CE 3.43Å; I410-L489 HydrophobicContact CD1-CD2 3.77Å; I410-L489 HydrophobicContact CG1-CD2 4.09Å; I410-L489 HydrophobicContact CG2-CD2 3.91Å; I410-D491 HydrophobicContact CD1-CB 4.13Å
411	I	76.9	Confident	61.9	Low	7 Å²	7	96.4 Å²	96.4	4%	0.036	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	145.6	175.3	-61.3	163.6	0	0	0	107.8	I413 K428 V429 M433 L436 M479 P481	I411-I413 HydrophobicContact CG2-CG1 4.05Å; I411-K428 CarbonylContact C-O 3.17Å; I411-K428 WeakPolarHBondContact CA-O 3.46Å; I411-V429 HydrophobicContact CG1-CG1 4.21Å; I411-M433 HydrophobicContact CD1-CE 4.49Å; I411-M433 HydrophobicContact CG1-CE 4.37Å; I411-L436 HydrophobicContact CD1-CD2 3.54Å; I411-L436 HydrophobicContact CG1-CD2 4.28Å; I411-M479 HydrophobicContact CG2-SD 4.17Å; I411-P481 HydrophobicContact CD1-CB 4.29Å; I411-P481 HydrophobicContact CD1-CG 4.38Å
412	T	82.2	Confident	64.6	Low	56 Å²	56	86.1 Å²	86.1	34%	0.344	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	121.8	167.9	-57.1	0	0	0	0	109	F414 W427 K428	T412-F414 HydrophobicContact CG2-CE1 4.25Å; T412-F414 HydrophobicContact CG2-CE2 3.83Å; T412-F414 HydrophobicContact CG2-CZ 3.59Å; T412-W427 CarbonylContact O-C 3.45Å; T412-W427 WeakPolarHBondContact O-CA 3.36Å; T412-W427 WeakPolarHBondContact O-CB 3.2Å; T412-K428 PolarHBondContact N-O 3.09Å; T412-K428 PolarHBondContact O-N 2.87Å
413	I	86.5	Confident	67.5	Low	16 Å²	16	80 Å²	80	8%	0.082	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	138.6	-176.1	-44.8	171.7	0	0	0	109.4	I411 V415 I425 M479 E495 I497	I411-I413 HydrophobicContact CG2-CG1 4.05Å; I413-V415 HydrophobicContact CG2-CG2 3.99Å; I413-I425 HydrophobicContact CG2-CG2 3.87Å; I413-M479 HydrophobicContact CD1-CB 3.5Å; I413-M479 HydrophobicContact CG1-CB 4.19Å; I413-E495 HydrophobicContact CD1-CB 3.88Å; I413-E495 WeakPolarHBondContact CD1-O 3.26Å; I413-E495 HydrophobicContact CG1-CB 4.32Å; I413-I497 HydrophobicContact CB-CG2 4.45Å; I413-I497 HydrophobicContact CG2-CG2 4.16Å
414	F	86	Confident	70.4	Confident	100 Å²	100	77 Å²	77	44%	0.439	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	132.7	173.7	-56.1	-85.1	0	0	0	108.5	T412 S426 K428	T412-F414 HydrophobicContact CG2-CE1 4.25Å; T412-F414 HydrophobicContact CG2-CE2 3.83Å; T412-F414 HydrophobicContact CG2-CZ 3.59Å; F414-S426 PolarHBondContact N-O 2.95Å; F414-S426 PolarHBondContact O-N 2.97Å; F414-S426 VanDerWaalsContact O-O 3.06Å; F414-K428 HydrophobicContact CE2-CD 4.37Å; F414-K428 HydrophobicContact CE2-CG 4.28Å
415	V	87.2	Confident	73.4	Confident	30 Å²	30	72.5 Å²	72.5	18%	0.182	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	136.5	-177.4	-176.8	0	0	0	0	109.9	I413 I423 I425 I497 T499	I413-V415 HydrophobicContact CG2-CG2 3.99Å; V415-I423 HydrophobicContact CG1-CG2 3.21Å; V415-I425 HydrophobicContact CG1-CG1 4.39Å; V415-I425 HydrophobicContact CG2-CG1 4.17Å; V415-I425 HydrophobicContact CG2-CG2 4.19Å; V415-I497 HydrophobicContact CB-CG2 4.23Å; V415-I497 HydrophobicContact CG2-CG2 3.42Å; V415-I497 VanDerWaalsContact CG2-CG2 3.42Å; V415-T499 HydrophobicContact CG1-CG2 3.67Å
416	K	85.1	Confident	76.2	Confident	150 Å²	150	69.2 Å²	69.2	65%	0.652	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.2	120.5	-178.4	-175.7	-179.6	-179.9	-175.3	0	109.4	V418 H424	K416-V418 PolarHBondContact O-N 3.06Å; K416-H424 PolarHBondContact N-O 3.2Å; K416-H424 PolarHBondContact O-N 3.06Å
417	S	80.2	Confident	78.7	Confident	45 Å²	45	63.7 Å²	63.7	32%	0.315	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	130.9	167.3	41.5	0	0	0	0	109.9	E500	S417-E500 VanDerWaalsContact CB-O 3.28Å; S417-E500 WeakPolarHBondContact CB-O 3.42Å; S417-E500 PolarHBondContact OG-O 3.05Å
418	V	79.6	Confident	80.8	Confident	90 Å²	90	64.4 Å²	64.4	55%	0.545	32%	0.315	S	S	.	.			trans	-108.9	-33.4	-176.4	175.5	0	0	0	0	110.8	K416 T422 H424	K416-V418 PolarHBondContact O-N 3.06Å; V418-T422 PolarHBondContact N-O 2.82Å; V418-H424 HydrophobicContact CG2-CB 3.57Å
419	S	80.4	Confident	82.2	Confident	40 Å²	40	55.4 Å²	55.4	28%	0.28	29%	0.285	S	S	.	.	S	Bend	trans	-146	-171.9	173.7	75.1	0	0	0	0	111.3	E421 T422 A502	S419-E421 PolarHBondContact O-N 2.84Å; S419-E421 PolarHBondContact OG-N 2.87Å; S419-T422 WeakPolarHBondContact CB-OG1 3.47Å; S419-T422 PolarHBondContact N-O 3Å; S419-T422 PolarHBondContact N-OG1 3.12Å; S419-T422 WeakPolarHBondContact OG-CB 3.44Å; S419-T422 WeakPolarHBondContact OG-CG2 3.38Å; S419-T422 PolarHBondContact OG-N 3.31Å; S419-T422 VanDerWaalsContact OG-N 3.16Å; S419-T422 PolarHBondContact OG-OG1 2.87Å; S419-A502 WeakPolarHBondContact O-CB 3.06Å; S419-A502 PolarHBondContact O-N 3.2Å
420	T	80.7	Confident	82.9	Confident	41 Å²	41	52.9 Å²	52.9	25%	0.252	29%	0.287	S	S	.	.	S	Bend	trans	-62.1	-22.6	170.8	45.9	0	0	0	0	113.3	P471 T501 A502 L504	T420-P471 VanDerWaalsContact O-CA 3.23Å; T420-P471 WeakPolarHBondContact O-CA 3.44Å; T420-T501 WeakPolarHBondContact O-CB 3.33Å; T420-A502 WeakPolarHBondContact CA-O 3.33Å; T420-L504 HydrophobicContact CG2-CD2 4.26Å; T420-L504 HydrophobicContact CG2-CG 4.23Å
421	E	82	Confident	82.9	Confident	106 Å²	106	55.6 Å²	55.6	50%	0.495	30%	0.301	S	S	.	.	S	Bend	trans	-129.7	4.4	-172.1	-60.1	175.6	-167.9	0	0	113.2	S419 A468 L469	S419-E421 PolarHBondContact O-N 2.84Å; S419-E421 PolarHBondContact OG-N 2.87Å; E421-A468 PolarHBondContact O-N 3.06Å; E421-L469 WeakPolarHBondContact CA-O 3.39Å; E421-L469 PolarHBondContact O-N 3.1Å; E421-L469 VanDerWaalsContact O-N 3.11Å
422	T	83.2	Confident	82.3	Confident	27 Å²	27	61.5 Å²	61.5	17%	0.166	34%	0.34	C	S	.	.			trans	-135.1	137.5	-175.4	67.3	0	0	0	0	113.6	V418 S419 L466 T467	V418-T422 PolarHBondContact N-O 2.82Å; S419-T422 WeakPolarHBondContact CB-OG1 3.47Å; S419-T422 PolarHBondContact N-O 3Å; S419-T422 PolarHBondContact N-OG1 3.12Å; S419-T422 WeakPolarHBondContact OG-CB 3.44Å; S419-T422 WeakPolarHBondContact OG-CG2 3.38Å; S419-T422 PolarHBondContact OG-N 3.31Å; S419-T422 VanDerWaalsContact OG-N 3.16Å; S419-T422 PolarHBondContact OG-OG1 2.87Å; T422-L466 VanDerWaalsContact CA-O 3.26Å; T422-L466 WeakPolarHBondContact CA-O 3.32Å; T422-L466 WeakPolarHBondContact CB-O 3.38Å; T422-T467 HydrophobicContact CG2-CG2 4.13Å
423	I	86.4	Confident	81.7	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	122.4	178.4	-66.9	179.7	0	0	0	108.1	V415 I425 L466 L469 Y475 T499 T501	V415-I423 HydrophobicContact CG1-CG2 3.21Å; I423-I425 HydrophobicContact CG2-CG1 4.28Å; I423-L466 HydrophobicContact CB-CB 4.28Å; I423-L466 HydrophobicContact CB-CD1 4.43Å; I423-L466 PolarHBondContact N-O 2.88Å; I423-L466 VanDerWaalsContact N-O 3.12Å; I423-L466 PolarHBondContact O-N 3.39Å; I423-L469 HydrophobicContact CB-CD1 3.79Å; I423-L469 HydrophobicContact CD1-CD1 3.5Å; I423-L469 VanDerWaalsContact CD1-CD1 3.5Å; I423-L469 HydrophobicContact CG1-CD1 3.51Å; I423-Y475 HydrophobicContact CD1-CD2 4.17Å; I423-T499 HydrophobicContact CD1-CG2 3.73Å; I423-T499 HydrophobicContact CG2-CG2 4.33Å; I423-T501 HydrophobicContact CD1-CG2 3.84Å; I423-T501 HydrophobicContact CG1-CG2 4.04Å
424	H	87	Confident	81	Confident	63 Å²	63	63.4 Å²	63.4	29%	0.292	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	123.7	174.9	-179	-77.9	0	0	0	109.8	K416 V418 L465	K416-H424 PolarHBondContact N-O 3.2Å; K416-H424 PolarHBondContact O-N 3.06Å; V418-H424 HydrophobicContact CG2-CB 3.57Å; H424-L465 HydrophobicContact CB-CD1 4.15Å
425	I	90.1	Very high	80.7	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	134.5	178	-55.1	166.3	0	0	0	107.2	I413 V415 I423 W427 L438 D463 Y464 L466 V477	I413-I425 HydrophobicContact CG2-CG2 3.87Å; V415-I425 HydrophobicContact CG1-CG1 4.39Å; V415-I425 HydrophobicContact CG2-CG1 4.17Å; V415-I425 HydrophobicContact CG2-CG2 4.19Å; I423-I425 HydrophobicContact CG2-CG1 4.28Å; I425-W427 HydrophobicContact CG2-CE3 4.05Å; I425-W427 HydrophobicContact CG2-CZ3 4.23Å; I425-L438 HydrophobicContact CD1-CD1 4.09Å; I425-L438 HydrophobicContact CD1-CD2 4.05Å; I425-D463 CarbonylContact O-C 3.28Å; I425-D463 VanDerWaalsContact O-CA 3.32Å; I425-D463 WeakPolarHBondContact O-CA 3.42Å; I425-Y464 PolarHBondContact N-O 3Å; I425-Y464 PolarHBondContact O-N 3.14Å; I425-L466 HydrophobicContact CD1-CD1 3.72Å; I425-L466 HydrophobicContact CD1-CD2 4.03Å; I425-L466 HydrophobicContact CD1-CG 3.6Å; I425-L466 HydrophobicContact CG1-CG 4.43Å; I425-V477 HydrophobicContact CD1-CG1 3.66Å; I425-V477 HydrophobicContact CD1-CG2 4.33Å; I425-V477 HydrophobicContact CG1-CG1 4.32Å
426	S	88.8	Confident	80.6	Confident	39 Å²	39	58.1 Å²	58.1	27%	0.273	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	152.8	168	54.9	0	0	0	0	110.5	F414 N462	F414-S426 PolarHBondContact N-O 2.95Å; F414-S426 PolarHBondContact O-N 2.97Å; F414-S426 VanDerWaalsContact O-O 3.06Å; S426-N462 CarbonylContact C-O 3.27Å; S426-N462 WeakPolarHBondContact CA-O 3.32Å; S426-N462 WeakPolarHBondContact CB-O 3.41Å
427	W	90.4	Very high	80.6	Confident	6 Å²	6	55.2 Å²	55.2	2%	0.023	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	166.3	-176.5	56.2	91.4	0	0	0	112.1	T412 I425 L436 V457 R461 N462 D463 M479	T412-W427 CarbonylContact O-C 3.45Å; T412-W427 WeakPolarHBondContact O-CA 3.36Å; T412-W427 WeakPolarHBondContact O-CB 3.2Å; I425-W427 HydrophobicContact CG2-CE3 4.05Å; I425-W427 HydrophobicContact CG2-CZ3 4.23Å; W427-L436 VanDerWaalsContact NE1-CD1 3.34Å; W427-V457 HydrophobicContact CH2-CB 4.48Å; W427-V457 HydrophobicContact CH2-CG1 3.84Å; W427-V457 HydrophobicContact CH2-CG2 4.42Å; W427-V457 HydrophobicContact CZ2-CB 4.36Å; W427-V457 HydrophobicContact CZ2-CG1 3.7Å; W427-R461 HydrophobicContact CZ2-CB 4.33Å; W427-R461 VanDerWaalsContact CZ2-O 3.26Å; W427-R461 WeakPolarHBondContact CZ2-O 3.28Å; W427-R461 PolarHBondContact NE1-O 3.16Å; W427-R461 VanDerWaalsContact NE1-O 3.07Å; W427-N462 PolarHBondContact N-O 3.03Å; W427-D463 WeakPolarHBondContact CH2-O 3.46Å; W427-D463 VanDerWaalsContact CZ3-C 3.44Å; W427-M479 HydrophobicContact CB-SD 4.27Å; W427-M479 HydrophobicContact CD2-CE 3.58Å; W427-M479 HydrophobicContact CD2-SD 3.95Å; W427-M479 HydrophobicContact CE3-CE 3.52Å; W427-M479 HydrophobicContact CE3-SD 4.44Å; W427-M479 HydrophobicContact CG-CE 4.12Å; W427-M479 HydrophobicContact CG-SD 3.86Å; W427-M479 HydrophobicContact CH2-CE 4.26Å; W427-M479 HydrophobicContact CZ2-CE 4.31Å; W427-M479 HydrophobicContact CZ3-CE 3.88Å
428	K	85.1	Confident	81	Confident	146 Å²	146	53.1 Å²	53.1	64%	0.635	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	133.4	168.3	-66	-174.7	179.2	-176.7	0	108.6	I411 T412 F414	I411-K428 CarbonylContact C-O 3.17Å; I411-K428 WeakPolarHBondContact CA-O 3.46Å; T412-K428 PolarHBondContact N-O 3.09Å; T412-K428 PolarHBondContact O-N 2.87Å; F414-K428 HydrophobicContact CE2-CD 4.37Å; F414-K428 HydrophobicContact CE2-CG 4.28Å
429	V	80.6	Confident	81.3	Confident	42 Å²	42	49.7 Å²	49.7	26%	0.255	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.2	176.2	-158	0	0	0	0	108.8	I411 L431 M433 L436	I411-V429 HydrophobicContact CG1-CG1 4.21Å; V429-L431 VanDerWaalsContact C-N 3.33Å; V429-L431 WeakPolarHBondContact CG1-O 3.16Å; V429-M433 HydrophobicContact CG1-CE 3.5Å; V429-M433 VanDerWaalsContact CG1-CE 3.5Å; V429-M433 HydrophobicContact CG1-CG 4.03Å; V429-M433 HydrophobicContact CG1-SD 3.58Å; V429-M433 VanDerWaalsContact CG1-SD 3.58Å; V429-L436 HydrophobicContact CG2-CD1 4.07Å
430	A	72.9	Confident	81.6	Confident	69 Å²	69	49.8 Å²	49.8	57%	0.57	27%	0.273	S	S	*	.	S	Bend	trans	-82.3	-12.1	-179.9	0	0	0	0	0	113.6	I410	I410-A430 PolarHBondContact O-N 3.04Å
431	L	69.3	Low	81.8	Confident	94 Å²	94	50.1 Å²	50.1	49%	0.492	27%	0.273	S	S	.	.	S	Bend	trans	-137.1	145.8	-178.4	-70.6	165	0	0	0	108.7	V429 L489	V429-L431 VanDerWaalsContact C-N 3.33Å; V429-L431 WeakPolarHBondContact CG1-O 3.16Å; L431-L489 HydrophobicContact CD1-CD2 3.87Å
432	P	65.3	Low	81.8	Confident	132 Å²	132	48.5 Å²	48.5	86%	0.857	26%	0.264	S	S	*	.			trans	-65.2	135.2	173.6	27.8	-33.3	0	0	0	110.4
433	M	69	Low	81.4	Confident	34 Å²	34	50.8 Å²	50.8	17%	0.167	27%	0.274	C	S	.	.			trans	-132	159.3	179.5	-64.9	180	-177.9	0	0	109.8	I410 I411 V429 L436 G459 P481 L489	I410-M433 HydrophobicContact CG2-CE 3.43Å; I410-M433 VanDerWaalsContact CG2-CE 3.43Å; I411-M433 HydrophobicContact CD1-CE 4.49Å; I411-M433 HydrophobicContact CG1-CE 4.37Å; V429-M433 HydrophobicContact CG1-CE 3.5Å; V429-M433 VanDerWaalsContact CG1-CE 3.5Å; V429-M433 HydrophobicContact CG1-CG 4.03Å; V429-M433 HydrophobicContact CG1-SD 3.58Å; V429-M433 VanDerWaalsContact CG1-SD 3.58Å; M433-L436 HydrophobicContact SD-CD2 3.77Å; M433-L436 HydrophobicContact SD-CG 4.46Å; M433-G459 WeakPolarHBondContact O-CA 3.37Å; M433-P481 HydrophobicContact CE-CB 3.78Å; M433-P481 HydrophobicContact SD-CB 3.64Å; M433-L489 HydrophobicContact CE-CD1 4.43Å
434	T	72.3	Confident	80.4	Confident	77 Å²	77	53.4 Å²	53.4	47%	0.472	30%	0.301	S	S	.	.	S	Bend	trans	-92.5	-35.6	177.6	57.6	0	0	0	0	112.4	G459 T484	T434-G459 PolarHBondContact O-N 2.98Å; T434-T484 WeakPolarHBondContact CG2-OG1 3.43Å; T434-T484 VanDerWaalsContact OG1-CG2 3.26Å; T434-T484 WeakPolarHBondContact OG1-CG2 3.32Å; T434-T484 PolarHBondContact OG1-OG1 2.88Å
435	A	79.2	Confident	78.5	Confident	19 Å²	19	60.5 Å²	60.5	16%	0.157	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	149.9	179.7	0	0	0	0	0	112.6	I456 V457 M482	A435-I456 HydrophobicContact CB-CG2 3.96Å; A435-V457 CarbonylContact C-O 3.52Å; A435-V457 WeakPolarHBondContact CA-O 3.17Å; A435-M482 HydrophobicContact CB-CB 4.17Å; A435-M482 HydrophobicContact CB-SD 4.46Å; A435-M482 PolarHBondContact O-N 3.24Å; A435-M482 VanDerWaalsContact O-N 3.07Å
436	L	84.3	Confident	76.5	Confident	0 Å²	0	64 Å²	64	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	134	177	-71.5	155.6	0	0	0	108.1	I411 W427 V429 M433 V457 M479	I411-L436 HydrophobicContact CD1-CD2 3.54Å; I411-L436 HydrophobicContact CG1-CD2 4.28Å; W427-L436 VanDerWaalsContact NE1-CD1 3.34Å; V429-L436 HydrophobicContact CG2-CD1 4.07Å; M433-L436 HydrophobicContact SD-CD2 3.77Å; M433-L436 HydrophobicContact SD-CG 4.46Å; L436-V457 PolarHBondContact N-O 3.22Å; L436-V457 PolarHBondContact O-N 3.03Å; L436-M479 HydrophobicContact CB-CG 4.23Å; L436-M479 HydrophobicContact CB-SD 4.11Å; L436-M479 HydrophobicContact CD1-SD 4.01Å; L436-M479 HydrophobicContact CD2-CG 4.08Å; L436-M479 HydrophobicContact CD2-SD 3.95Å; L436-M479 HydrophobicContact CG-SD 4.27Å
437	R	85.9	Confident	74.6	Confident	90 Å²	90	69.3 Å²	69.3	34%	0.34	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	120.3	171.5	-173.7	168.5	61.1	132.9	-3.3	109.4	E454 M479 V480 M482	R437-E454 WeakPolarHBondContact CD-OE2 3.17Å; R437-E454 IonicContact CZ-OE2 2.66Å; R437-E454 IonicContact NE-OE2 3.21Å; R437-E454 VanDerWaalsContact NH1-CD 3.31Å; R437-E454 IonicContact NH1-OE1 2.68Å; R437-E454 PolarHBondContact NH1-OE1 3.05Å; R437-E454 VanDerWaalsContact NH1-OE1 3.13Å; R437-E454 IonicContact NH1-OE2 3.25Å; R437-E454 PolarHBondContact NH1-OE2 2.91Å; R437-M479 WeakPolarHBondContact O-CA 3.42Å; R437-V480 PolarHBondContact N-O 2.83Å; R437-V480 PolarHBondContact O-N 2.96Å; R437-M482 HydrophobicContact CB-CG 4.08Å; R437-M482 HydrophobicContact CB-SD 4.01Å
438	L	88.3	Confident	72.5	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	129.6	176.1	173.5	62.5	0	0	0	109.1	I425 E454 T455 V457 Y464 V477 M479	I425-L438 HydrophobicContact CD1-CD1 4.09Å; I425-L438 HydrophobicContact CD1-CD2 4.05Å; L438-E454 CarbonylContact O-C 3.53Å; L438-E454 WeakPolarHBondContact O-CA 3.47Å; L438-T455 HydrophobicContact CB-CG2 3.98Å; L438-T455 HydrophobicContact CD2-CG2 4.15Å; L438-T455 HydrophobicContact CG-CG2 4.32Å; L438-T455 PolarHBondContact N-O 2.92Å; L438-T455 PolarHBondContact O-N 3.48Å; L438-V457 HydrophobicContact CB-CG2 4.13Å; L438-V457 HydrophobicContact CD2-CG2 4.38Å; L438-Y464 HydrophobicContact CD2-CD1 3.78Å; L438-Y464 HydrophobicContact CD2-CD2 4.34Å; L438-Y464 HydrophobicContact CD2-CE1 4.39Å; L438-Y464 HydrophobicContact CD2-CG 3.76Å; L438-V477 HydrophobicContact CD1-CG1 3.69Å; L438-M479 HydrophobicContact CB-CE 4.18Å; L438-M479 HydrophobicContact CD1-CE 3.94Å; L438-M479 HydrophobicContact CG-CE 4.49Å
439	S	86.1	Confident	70.6	Confident	18 Å²	18	75.1 Å²	75.1	13%	0.126	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	149.5	174.2	62.2	0	0	0	0	112.1	T453 V477 C478	S439-T453 VanDerWaalsContact CA-O 3.3Å; S439-T453 WeakPolarHBondContact CA-O 3.01Å; S439-V477 CarbonylContact O-C 3.56Å; S439-V477 WeakPolarHBondContact O-CA 3.37Å; S439-C478 PolarHBondContact N-O 3.18Å; S439-C478 PolarHBondContact O-N 2.86Å
440	W	87.4	Confident	69.3	Low	42 Å²	42	75.2 Å²	75.2	16%	0.159	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	149.4	173.8	66.9	103.1	0	0	0	112.1	T453 T455 L466 R476 V477	W440-T453 HydrophobicContact CZ2-CG2 4.46Å; W440-T453 WeakPolarHBondContact CZ2-OG1 3.49Å; W440-T453 PolarHBondContact N-O 2.76Å; W440-T453 PolarHBondContact NE1-OG1 3.45Å; W440-T453 VanDerWaalsContact NE1-OG1 3.08Å; W440-T453 PolarHBondContact O-N 3.18Å; W440-T453 VanDerWaalsContact O-N 3.16Å; W440-T453 PolarHBondContact O-OG1 3.04Å; W440-T455 HydrophobicContact CZ3-CG2 4.07Å; W440-L466 HydrophobicContact CB-CD1 4.13Å; W440-L466 HydrophobicContact CD2-CD1 3.99Å; W440-L466 HydrophobicContact CD2-CD2 3.64Å; W440-L466 HydrophobicContact CD2-CG 4.49Å; W440-L466 HydrophobicContact CE3-CD2 3.71Å; W440-L466 HydrophobicContact CG-CD1 3.74Å; W440-L466 HydrophobicContact CG-CD2 4.3Å; W440-L466 HydrophobicContact CH2-CD2 3.96Å; W440-L466 HydrophobicContact CZ2-CD2 3.87Å; W440-L466 HydrophobicContact CZ3-CD2 3.88Å; W440-R476 CarbonylContact C-O 3.57Å; W440-R476 VanDerWaalsContact CA-O 3.28Å; W440-R476 WeakPolarHBondContact CA-O 3.24Å; W440-V477 HydrophobicContact CB-CG2 4.12Å
441	L	84.4	Confident	68.5	Low	48 Å²	48	76.7 Å²	76.7	25%	0.251	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	130.5	-176.2	175.9	63.4	0	0	0	109.6	M443 G450 I452 Y475 R476	L441-M443 HydrophobicContact CD2-SD 4.26Å; L441-M443 HydrophobicContact CG-SD 4.5Å; L441-G450 WeakPolarHBondContact CD1-O 3.21Å; L441-I452 HydrophobicContact CD1-CG1 4.15Å; L441-Y475 CarbonylContact O-C 3.43Å; L441-Y475 WeakPolarHBondContact O-CA 3.11Å; L441-R476 PolarHBondContact N-O 2.98Å; L441-R476 PolarHBondContact O-N 3.25Å
442	K	82.4	Confident	68.5	Low	73 Å²	73	77.3 Å²	77.3	32%	0.317	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	128	168.5	-167.9	-169.7	-178.1	-169.1	0	109.5	E470 S473 Y475	K442-E470 WeakPolarHBondContact CD-OE1 3.49Å; K442-E470 WeakPolarHBondContact CE-OE1 3.42Å; K442-E470 IonicContact NZ-OE1 3.47Å; K442-E470 PolarHBondContact NZ-OE1 2.65Å; K442-E470 IonicContact NZ-OE2 3.18Å; K442-E470 PolarHBondContact NZ-OE2 3.16Å; K442-S473 WeakPolarHBondContact CE-OG 3.48Å; K442-Y475 HydrophobicContact CB-CD1 4.02Å; K442-Y475 HydrophobicContact CB-CE1 3.57Å; K442-Y475 HydrophobicContact CG-CD1 4.5Å; K442-Y475 HydrophobicContact CG-CE1 3.97Å
443	M	73.4	Confident	69	Low	74 Å²	74	73.6 Å²	73.6	37%	0.365	42%	0.424	S	S	.	.			trans	-90.5	133.9	175.9	-58.6	-65.4	-74.8	0	0	109.1	L441 P474 R476	L441-M443 HydrophobicContact CD2-SD 4.26Å; L441-M443 HydrophobicContact CG-SD 4.5Å; M443-P474 HydrophobicContact CB-CB 4.17Å; M443-P474 HydrophobicContact CB-CG 4.02Å; M443-P474 PolarHBondContact N-O 2.02Å; M443-R476 HydrophobicContact CG-CB 4.17Å; M443-R476 HydrophobicContact SD-CB 4.07Å
444	G	65.3	Low	69.6	Low	56 Å²	56	76.5 Å²	76.5	58%	0.577	44%	0.437	S	S	*	.			trans	-163.6	168	-173.8	0	0	0	0	0	113.9	S446	G444-S446 PolarHBondContact O-N 3.07Å
445	H	47.9	Very low	70	Confident	212 Å²	212	74.8 Å²	74.8	98%	0.981	43%	0.427	S	S	*	.	S	Bend	trans	-76.1	49.4	-171.5	-75.7	71.1	0	0	0	114.3
446	S	48.6	Very low	70.1	Confident	74 Å²	74	78.9 Å²	78.9	52%	0.517	45%	0.445	S	S	.	.			trans	-163.6	123.7	160.6	-179.1	0	0	0	0	109.9	G444 A448	G444-S446 PolarHBondContact O-N 3.07Å; S446-A448 PolarHBondContact O-N 2.87Å; S446-A448 VanDerWaalsContact O-N 3.09Å
447	P	48.7	Very low	70.1	Confident	149 Å²	149	79.2 Å²	79.2	97%	0.968	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	5.4	-178.6	31.6	-36.1	0	0	0	114.1
448	A	46.5	Very low	69.7	Low	71 Å²	71	78.2 Å²	78.2	59%	0.587	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-31.2	-169.7	0	0	0	0	0	115.3	S446	S446-A448 PolarHBondContact O-N 2.87Å; S446-A448 VanDerWaalsContact O-N 3.09Å
449	F	44.9	Very low	68.8	Low	204 Å²	204	79.5 Å²	79.5	90%	0.895	46%	0.464	S	S	*	.			trans	-149.5	99.7	-176	-86.8	-84.3	0	0	0	112.6
450	G	53.7	Low	68.2	Low	43 Å²	43	84.6 Å²	84.6	44%	0.443	49%	0.49	S	S	.	.			trans	-127.3	122	154	0	0	0	0	0	108.1	L441 I452	L441-G450 WeakPolarHBondContact CD1-O 3.21Å; G450-I452 PolarHBondContact O-N 2.78Å
451	S	56	Low	67.8	Low	101 Å²	101	89.1 Å²	89.1	71%	0.706	51%	0.507	S	S	*	.			trans	-70.8	116	177.5	51.3	0	0	0	0	109.4	T453	S451-T453 PolarHBondContact O-N 3.48Å
452	I	68.5	Low	67.8	Low	106 Å²	106	90.9 Å²	90.9	54%	0.544	52%	0.516	S	S	.	.			trans	-71.8	120.6	170.3	-57.1	173.2	0	0	0	107.1	L441 G450 E454	L441-I452 HydrophobicContact CD1-CG1 4.15Å; G450-I452 PolarHBondContact O-N 2.78Å; I452-E454 HydrophobicContact CG2-CG 3.8Å
453	T	77.1	Confident	68	Low	54 Å²	54	91.7 Å²	91.7	33%	0.331	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	126.8	171.5	35.7	0	0	0	0	108.7	S439 W440 S451	S439-T453 VanDerWaalsContact CA-O 3.3Å; S439-T453 WeakPolarHBondContact CA-O 3.01Å; W440-T453 HydrophobicContact CZ2-CG2 4.46Å; W440-T453 WeakPolarHBondContact CZ2-OG1 3.49Å; W440-T453 PolarHBondContact N-O 2.76Å; W440-T453 PolarHBondContact NE1-OG1 3.45Å; W440-T453 VanDerWaalsContact NE1-OG1 3.08Å; W440-T453 PolarHBondContact O-N 3.18Å; W440-T453 VanDerWaalsContact O-N 3.16Å; W440-T453 PolarHBondContact O-OG1 3.04Å; S451-T453 PolarHBondContact O-N 3.48Å
454	E	81.1	Confident	68.6	Low	95 Å²	95	91.5 Å²	91.5	44%	0.444	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	149.3	-178.5	-50.3	-158.1	149.3	0	0	111	R437 L438 I452	R437-E454 WeakPolarHBondContact CD-OE2 3.17Å; R437-E454 IonicContact CZ-OE2 2.66Å; R437-E454 IonicContact NE-OE2 3.21Å; R437-E454 VanDerWaalsContact NH1-CD 3.31Å; R437-E454 IonicContact NH1-OE1 2.68Å; R437-E454 PolarHBondContact NH1-OE1 3.05Å; R437-E454 VanDerWaalsContact NH1-OE1 3.13Å; R437-E454 IonicContact NH1-OE2 3.25Å; R437-E454 PolarHBondContact NH1-OE2 2.91Å; L438-E454 CarbonylContact O-C 3.53Å; L438-E454 WeakPolarHBondContact O-CA 3.47Å; I452-E454 HydrophobicContact CG2-CG 3.8Å
455	T	79.6	Confident	69.7	Low	41 Å²	41	93 Å²	93	25%	0.252	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	153.9	172.4	-163.8	0	0	0	0	110.2	L438 W440 V457 Y464	L438-T455 HydrophobicContact CB-CG2 3.98Å; L438-T455 HydrophobicContact CD2-CG2 4.15Å; L438-T455 HydrophobicContact CG-CG2 4.32Å; L438-T455 PolarHBondContact N-O 2.92Å; L438-T455 PolarHBondContact O-N 3.48Å; W440-T455 HydrophobicContact CZ3-CG2 4.07Å; T455-V457 HydrophobicContact CG2-CG2 4.22Å; T455-Y464 HydrophobicContact CG2-CE1 4.45Å; T455-Y464 HydrophobicContact CG2-CE2 4.03Å
456	I	81.7	Confident	71.5	Confident	106 Å²	106	83 Å²	83	54%	0.544	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	126.6	176.1	-58.2	175	0	0	0	107.6	A435 M482	A435-I456 HydrophobicContact CB-CG2 3.96Å; I456-M482 HydrophobicContact CD1-CE 4.23Å; I456-M482 HydrophobicContact CD1-SD 3.95Å; I456-M482 HydrophobicContact CG1-SD 3.96Å; I456-M482 HydrophobicContact CG2-SD 3.89Å
457	V	83.6	Confident	73.2	Confident	6 Å²	6	83.9 Å²	83.9	4%	0.036	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	132.4	177.7	-168.6	0	0	0	0	108.7	W427 A435 L436 L438 T455 R461 Y464	W427-V457 HydrophobicContact CH2-CB 4.48Å; W427-V457 HydrophobicContact CH2-CG1 3.84Å; W427-V457 HydrophobicContact CH2-CG2 4.42Å; W427-V457 HydrophobicContact CZ2-CB 4.36Å; W427-V457 HydrophobicContact CZ2-CG1 3.7Å; A435-V457 CarbonylContact C-O 3.52Å; A435-V457 WeakPolarHBondContact CA-O 3.17Å; L436-V457 PolarHBondContact N-O 3.22Å; L436-V457 PolarHBondContact O-N 3.03Å; L438-V457 HydrophobicContact CB-CG2 4.13Å; L438-V457 HydrophobicContact CD2-CG2 4.38Å; T455-V457 HydrophobicContact CG2-CG2 4.22Å; V457-R461 HydrophobicContact CG1-CB 3.81Å; V457-R461 HydrophobicContact CG1-CG 4.45Å; V457-Y464 HydrophobicContact CG2-CD2 4Å; V457-Y464 HydrophobicContact CG2-CE2 4.37Å
458	T	78.2	Confident	74.5	Confident	70 Å²	70	81.1 Å²	81.1	43%	0.429	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	143.2	175.6	50.9	0	0	0	0	110.8	D460 R461	T458-D460 WeakPolarHBondContact CB-OD1 3.42Å; T458-D460 PolarHBondContact O-N 2.92Å; T458-D460 VanDerWaalsContact O-N 3.13Å; T458-D460 PolarHBondContact OG1-OD1 3.22Å; T458-R461 PolarHBondContact O-N 3.17Å
459	G	69.7	Low	76.2	Confident	26 Å²	26	78.2 Å²	78.2	27%	0.268	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-1.4	-172	0	0	0	0	0	115.8	M433 T434	M433-G459 WeakPolarHBondContact O-CA 3.37Å; T434-G459 PolarHBondContact O-N 2.98Å
460	D	73.5	Confident	77.8	Confident	126 Å²	126	73.3 Å²	73.3	67%	0.674	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-16.4	167.9	66.2	-33.6	0	0	0	112.9	T458	T458-D460 WeakPolarHBondContact CB-OD1 3.42Å; T458-D460 PolarHBondContact O-N 2.92Å; T458-D460 VanDerWaalsContact O-N 3.13Å; T458-D460 PolarHBondContact OG1-OD1 3.22Å
461	R	78.1	Confident	79.1	Confident	137 Å²	137	73.3 Å²	73.3	52%	0.517	41%	0.407	S	S	.	.			trans	-95.1	148.2	178.4	-61.8	-178.2	-179.8	-147.2	1	112.1	W427 V457 T458	W427-R461 HydrophobicContact CZ2-CB 4.33Å; W427-R461 VanDerWaalsContact CZ2-O 3.26Å; W427-R461 WeakPolarHBondContact CZ2-O 3.28Å; W427-R461 PolarHBondContact NE1-O 3.16Å; W427-R461 VanDerWaalsContact NE1-O 3.07Å; V457-R461 HydrophobicContact CG1-CB 3.81Å; V457-R461 HydrophobicContact CG1-CG 4.45Å; T458-R461 PolarHBondContact O-N 3.17Å
462	N	84.7	Confident	80.3	Confident	84 Å²	84	74.4 Å²	74.4	45%	0.449	40%	0.401	S	S	.	.			trans	-125.5	2.7	179.4	-67.8	-60.2	0	0	0	113.6	S426 W427	S426-N462 CarbonylContact C-O 3.27Å; S426-N462 WeakPolarHBondContact CA-O 3.32Å; S426-N462 WeakPolarHBondContact CB-O 3.41Å; W427-N462 PolarHBondContact N-O 3.03Å
463	D	87.4	Confident	80.8	Confident	91 Å²	91	69.8 Å²	69.8	49%	0.487	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	150.8	-175	60.8	-32.8	0	0	0	112.9	I425 W427	I425-D463 CarbonylContact O-C 3.28Å; I425-D463 VanDerWaalsContact O-CA 3.32Å; I425-D463 WeakPolarHBondContact O-CA 3.42Å; W427-D463 WeakPolarHBondContact CH2-O 3.46Å; W427-D463 VanDerWaalsContact CZ3-C 3.44Å
464	Y	86.9	Confident	81.1	Confident	69 Å²	69	69.6 Å²	69.6	27%	0.271	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	138.7	177.4	-161.8	-87.2	0	0	0	110.3	I425 L438 T455 V457 L466	I425-Y464 PolarHBondContact N-O 3Å; I425-Y464 PolarHBondContact O-N 3.14Å; L438-Y464 HydrophobicContact CD2-CD1 3.78Å; L438-Y464 HydrophobicContact CD2-CD2 4.34Å; L438-Y464 HydrophobicContact CD2-CE1 4.39Å; L438-Y464 HydrophobicContact CD2-CG 3.76Å; T455-Y464 HydrophobicContact CG2-CE1 4.45Å; T455-Y464 HydrophobicContact CG2-CE2 4.03Å; V457-Y464 HydrophobicContact CG2-CD2 4Å; V457-Y464 HydrophobicContact CG2-CE2 4.37Å; Y464-L466 HydrophobicContact CD1-CD2 3.88Å; Y464-L466 HydrophobicContact CE1-CD2 3.83Å
465	L	87.5	Confident	81.3	Confident	88 Å²	88	65.8 Å²	65.8	46%	0.461	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	113.1	178	-175.5	68.5	0	0	0	109.9	H424 T467	H424-L465 HydrophobicContact CB-CD1 4.15Å; L465-T467 HydrophobicContact CD2-CG2 4.06Å; L465-T467 HydrophobicContact CG-CG2 4.04Å
466	L	85	Confident	81.6	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.016	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	135.8	166.3	-58	-174.6	0	0	0	109.6	T422 I423 I425 W440 Y464 L469 V477	T422-L466 VanDerWaalsContact CA-O 3.26Å; T422-L466 WeakPolarHBondContact CA-O 3.32Å; T422-L466 WeakPolarHBondContact CB-O 3.38Å; I423-L466 HydrophobicContact CB-CB 4.28Å; I423-L466 HydrophobicContact CB-CD1 4.43Å; I423-L466 PolarHBondContact N-O 2.88Å; I423-L466 VanDerWaalsContact N-O 3.12Å; I423-L466 PolarHBondContact O-N 3.39Å; I425-L466 HydrophobicContact CD1-CD1 3.72Å; I425-L466 HydrophobicContact CD1-CD2 4.03Å; I425-L466 HydrophobicContact CD1-CG 3.6Å; I425-L466 HydrophobicContact CG1-CG 4.43Å; W440-L466 HydrophobicContact CB-CD1 4.13Å; W440-L466 HydrophobicContact CD2-CD1 3.99Å; W440-L466 HydrophobicContact CD2-CD2 3.64Å; W440-L466 HydrophobicContact CD2-CG 4.49Å; W440-L466 HydrophobicContact CE3-CD2 3.71Å; W440-L466 HydrophobicContact CG-CD1 3.74Å; W440-L466 HydrophobicContact CG-CD2 4.3Å; W440-L466 HydrophobicContact CH2-CD2 3.96Å; W440-L466 HydrophobicContact CZ2-CD2 3.87Å; W440-L466 HydrophobicContact CZ3-CD2 3.88Å; Y464-L466 HydrophobicContact CD1-CD2 3.88Å; Y464-L466 HydrophobicContact CE1-CD2 3.83Å; L466-L469 HydrophobicContact CB-CD1 3.74Å; L466-L469 HydrophobicContact CB-CD2 4.38Å; L466-L469 HydrophobicContact CB-CG 4.21Å; L466-L469 HydrophobicContact CD1-CD1 4.15Å; L466-V477 HydrophobicContact CD1-CG2 4.43Å
467	T	84	Confident	81.9	Confident	91 Å²	91	63.6 Å²	63.6	56%	0.558	34%	0.34	S	S	*	.			trans	-132.5	165.3	178.8	59.4	0	0	0	0	110.4	T422 L465 L469	T422-T467 HydrophobicContact CG2-CG2 4.13Å; L465-T467 HydrophobicContact CD2-CG2 4.06Å; L465-T467 HydrophobicContact CG-CG2 4.04Å; T467-L469 VanDerWaalsContact C-N 3.27Å; T467-L469 PolarHBondContact O-N 3.21Å
468	A	77.1	Confident	82	Confident	92 Å²	92	64.2 Å²	64.2	76%	0.76	34%	0.344	S	S	*	.	S	Bend	trans	56.7	37.2	-177	0	0	0	0	0	113.8	E421	E421-A468 PolarHBondContact O-N 3.06Å
469	L	82.1	Confident	82.4	Confident	10 Å²	10	60.9 Å²	60.9	5%	0.052	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-85.2	155.3	171.6	-58.2	177.3	0	0	0	110.8	E421 I423 L466 T467 Y475 T501	E421-L469 WeakPolarHBondContact CA-O 3.39Å; E421-L469 PolarHBondContact O-N 3.1Å; E421-L469 VanDerWaalsContact O-N 3.11Å; I423-L469 HydrophobicContact CB-CD1 3.79Å; I423-L469 HydrophobicContact CD1-CD1 3.5Å; I423-L469 VanDerWaalsContact CD1-CD1 3.5Å; I423-L469 HydrophobicContact CG1-CD1 3.51Å; L466-L469 HydrophobicContact CB-CD1 3.74Å; L466-L469 HydrophobicContact CB-CD2 4.38Å; L466-L469 HydrophobicContact CB-CG 4.21Å; L466-L469 HydrophobicContact CD1-CD1 4.15Å; T467-L469 VanDerWaalsContact C-N 3.27Å; T467-L469 PolarHBondContact O-N 3.21Å; L469-Y475 HydrophobicContact CB-CE2 3.96Å; L469-Y475 HydrophobicContact CD1-CE2 4.45Å; L469-Y475 HydrophobicContact CD2-CD1 4.39Å; L469-Y475 HydrophobicContact CD2-CE1 3.82Å; L469-Y475 HydrophobicContact CD2-CE2 4.34Å; L469-Y475 HydrophobicContact CG-CE2 4.49Å; L469-T501 HydrophobicContact CB-CG2 3.93Å; L469-T501 HydrophobicContact CD1-CG2 4.17Å
470	E	78.9	Confident	83	Confident	101 Å²	101	61 Å²	61	47%	0.472	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-76.1	141.7	175.4	-73.3	-179.2	-109.5	0	0	111.4	K442 S473 Y475 T501	K442-E470 WeakPolarHBondContact CD-OE1 3.49Å; K442-E470 WeakPolarHBondContact CE-OE1 3.42Å; K442-E470 IonicContact NZ-OE1 3.47Å; K442-E470 PolarHBondContact NZ-OE1 2.65Å; K442-E470 IonicContact NZ-OE2 3.18Å; K442-E470 PolarHBondContact NZ-OE2 3.16Å; E470-S473 WeakPolarHBondContact CB-OG 3.27Å; E470-S473 WeakPolarHBondContact O-CB 3.39Å; E470-Y475 PolarHBondContact N-OH 3Å; E470-T501 WeakPolarHBondContact O-CB 3.41Å; E470-T501 WeakPolarHBondContact O-CG2 3.36Å; E470-T501 PolarHBondContact O-OG1 3.37Å
471	P	80.1	Confident	83.3	Confident	43 Å²	43	56.3 Å²	56.3	28%	0.279	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	155.9	172.8	28.4	-34.4	0	0	0	112	T420 S473 L504	T420-P471 VanDerWaalsContact O-CA 3.23Å; T420-P471 WeakPolarHBondContact O-CA 3.44Å; P471-S473 PolarHBondContact O-N 2.85Å; P471-S473 PolarHBondContact O-OG 2.84Å; P471-L504 HydrophobicContact CB-CD1 3.85Å; P471-L504 HydrophobicContact CB-CG 4Å; P471-L504 HydrophobicContact CG-CD1 3.73Å; P471-L504 HydrophobicContact CG-CG 4.37Å
472	E	80.8	Confident	82.7	Confident	123 Å²	123	53.3 Å²	53.3	58%	0.575	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	33.7	176.1	-65.5	176.7	-166.3	0	0	114	T501 P503 L504	E472-T501 PolarHBondContact N-OG1 2.99Å; E472-T501 VanDerWaalsContact N-OG1 3.08Å; E472-P503 HydrophobicContact CG-CB 4.04Å; E472-P503 WeakPolarHBondContact OE1-CA 3.49Å; E472-P503 WeakPolarHBondContact OE1-CB 3.36Å; E472-L504 PolarHBondContact OE1-N 3.28Å
473	S	79.3	Confident	81.5	Confident	10 Å²	10	57.5 Å²	57.5	7%	0.07	31%	0.305	C	S	.	.			trans	-119.2	128.4	-172.9	-68.7	0	0	0	0	111.1	K442 E470 P471 Y475 T501	K442-S473 WeakPolarHBondContact CE-OG 3.48Å; E470-S473 WeakPolarHBondContact CB-OG 3.27Å; E470-S473 WeakPolarHBondContact O-CB 3.39Å; P471-S473 PolarHBondContact O-N 2.85Å; P471-S473 PolarHBondContact O-OG 2.84Å; S473-Y475 VanDerWaalsContact O-CD2 3.27Å; S473-Y475 WeakPolarHBondContact O-CD2 3.46Å; S473-T501 PolarHBondContact N-OG1 3.24Å; S473-T501 PolarHBondContact O-N 3.13Å; S473-T501 PolarHBondContact O-OG1 3.01Å
474	P	84.6	Confident	79.6	Confident	49 Å²	49	56.6 Å²	56.6	32%	0.318	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	134.9	172.6	25.1	-26.8	0	0	0	110.8	M443 T499 E500	M443-P474 HydrophobicContact CB-CB 4.17Å; M443-P474 HydrophobicContact CB-CG 4.02Å; M443-P474 PolarHBondContact N-O 2.02Å; P474-T499 CarbonylContact C-O 3.16Å; P474-T499 WeakPolarHBondContact CA-O 3.41Å; P474-E500 HydrophobicContact CB-CG 3.92Å
475	Y	84.7	Confident	77.5	Confident	15 Å²	15	58 Å²	58	6%	0.059	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	137.1	176.7	-75.2	-88	0	0	0	110.3	I423 L441 K442 L469 E470 S473 E498 T499 T501	I423-Y475 HydrophobicContact CD1-CD2 4.17Å; L441-Y475 CarbonylContact O-C 3.43Å; L441-Y475 WeakPolarHBondContact O-CA 3.11Å; K442-Y475 HydrophobicContact CB-CD1 4.02Å; K442-Y475 HydrophobicContact CB-CE1 3.57Å; K442-Y475 HydrophobicContact CG-CD1 4.5Å; K442-Y475 HydrophobicContact CG-CE1 3.97Å; L469-Y475 HydrophobicContact CB-CE2 3.96Å; L469-Y475 HydrophobicContact CD1-CE2 4.45Å; L469-Y475 HydrophobicContact CD2-CD1 4.39Å; L469-Y475 HydrophobicContact CD2-CE1 3.82Å; L469-Y475 HydrophobicContact CD2-CE2 4.34Å; L469-Y475 HydrophobicContact CG-CE2 4.49Å; E470-Y475 PolarHBondContact N-OH 3Å; S473-Y475 VanDerWaalsContact O-CD2 3.27Å; S473-Y475 WeakPolarHBondContact O-CD2 3.46Å; Y475-E498 WeakPolarHBondContact O-CA 3.28Å; Y475-T499 PolarHBondContact N-O 2.96Å; Y475-T499 PolarHBondContact O-N 2.91Å; Y475-T501 HydrophobicContact CD2-CG2 4.21Å; Y475-T501 HydrophobicContact CE2-CG2 4.02Å
476	R	86.7	Confident	75.3	Confident	102 Å²	102	62.1 Å²	62.1	39%	0.385	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	121	169	-174.3	170.6	177.1	130.2	-6.4	108.9	W440 L441 M443 E498	W440-R476 CarbonylContact C-O 3.57Å; W440-R476 VanDerWaalsContact CA-O 3.28Å; W440-R476 WeakPolarHBondContact CA-O 3.24Å; L441-R476 PolarHBondContact N-O 2.98Å; L441-R476 PolarHBondContact O-N 3.25Å; M443-R476 HydrophobicContact CG-CB 4.17Å; M443-R476 HydrophobicContact SD-CB 4.07Å; R476-E498 HydrophobicContact CB-CG 4.03Å; R476-E498 WeakPolarHBondContact CD-OE1 3.45Å; R476-E498 HydrophobicContact CG-CG 3.9Å; R476-E498 IonicContact CZ-OE1 2.75Å; R476-E498 IonicContact NE-OE1 2.75Å; R476-E498 IonicContact NH1-OE1 3.95Å; R476-E498 PolarHBondContact NH1-OE1 3.05Å
477	V	86.5	Confident	73.1	Confident	0 Å²	0	67 Å²	67	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.6	179.9	-179.7	0	0	0	0	108.4	I425 L438 S439 W440 L466 C496 I497 T499	I425-V477 HydrophobicContact CD1-CG1 3.66Å; I425-V477 HydrophobicContact CD1-CG2 4.33Å; I425-V477 HydrophobicContact CG1-CG1 4.32Å; L438-V477 HydrophobicContact CD1-CG1 3.69Å; S439-V477 CarbonylContact O-C 3.56Å; S439-V477 WeakPolarHBondContact O-CA 3.37Å; W440-V477 HydrophobicContact CB-CG2 4.12Å; L466-V477 HydrophobicContact CD1-CG2 4.43Å; V477-C496 CarbonylContact O-C 3.05Å; V477-C496 VanDerWaalsContact O-CA 3.23Å; V477-C496 WeakPolarHBondContact O-CA 3.36Å; V477-I497 HydrophobicContact CB-CG2 4.31Å; V477-I497 PolarHBondContact N-O 3.33Å; V477-I497 PolarHBondContact O-N 3.38Å; V477-T499 HydrophobicContact CG2-CG2 4.39Å
478	C	86.3	Confident	71.1	Confident	18 Å²	18	73.6 Å²	73.6	12%	0.122	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	147.7	180	-61.6	0	0	0	0	111.3	S439 P494 E495 C496	S439-C478 PolarHBondContact N-O 3.18Å; S439-C478 PolarHBondContact O-N 2.86Å; C478-P494 HydrophobicContact CB-CB 4.42Å; C478-E495 CarbonylContact C-O 3.52Å; C478-E495 VanDerWaalsContact CA-O 3.27Å; C478-E495 WeakPolarHBondContact CA-O 3.4Å; C478-C496 HydrophobicContact CB-CB 4.14Å; C478-C496 WeakPolarHBondContact CB-SG 3.44Å; C478-C496 WeakPolarHBondContact SG-CB 3.33Å; C478-C496 CovalentContact SG-SG 2.04Å; C478-C496 PolarHBondContact SG-SG 2.79Å
479	M	85.9	Confident	69.7	Low	1 Å²	1	72.5 Å²	72.5	1%	0.005	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	140.3	174.9	-170.3	172.1	-78.5	0	0	111.7	I411 I413 W427 L436 R437 L438 E495	I411-M479 HydrophobicContact CG2-SD 4.17Å; I413-M479 HydrophobicContact CD1-CB 3.5Å; I413-M479 HydrophobicContact CG1-CB 4.19Å; W427-M479 HydrophobicContact CB-SD 4.27Å; W427-M479 HydrophobicContact CD2-CE 3.58Å; W427-M479 HydrophobicContact CD2-SD 3.95Å; W427-M479 HydrophobicContact CE3-CE 3.52Å; W427-M479 HydrophobicContact CE3-SD 4.44Å; W427-M479 HydrophobicContact CG-CE 4.12Å; W427-M479 HydrophobicContact CG-SD 3.86Å; W427-M479 HydrophobicContact CH2-CE 4.26Å; W427-M479 HydrophobicContact CZ2-CE 4.31Å; W427-M479 HydrophobicContact CZ3-CE 3.88Å; L436-M479 HydrophobicContact CB-CG 4.23Å; L436-M479 HydrophobicContact CB-SD 4.11Å; L436-M479 HydrophobicContact CD1-SD 4.01Å; L436-M479 HydrophobicContact CD2-CG 4.08Å; L436-M479 HydrophobicContact CD2-SD 3.95Å; L436-M479 HydrophobicContact CG-SD 4.27Å; R437-M479 WeakPolarHBondContact O-CA 3.42Å; L438-M479 HydrophobicContact CB-CE 4.18Å; L438-M479 HydrophobicContact CD1-CE 3.94Å; L438-M479 HydrophobicContact CG-CE 4.49Å; M479-E495 PolarHBondContact N-O 2.74Å; M479-E495 PolarHBondContact O-N 3.47Å
480	V	84	Confident	67.8	Low	27 Å²	27	77.9 Å²	77.9	16%	0.164	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	133.9	-177.6	-174.5	0	0	0	0	109.5	R437 P494	R437-V480 PolarHBondContact N-O 2.83Å; R437-V480 PolarHBondContact O-N 2.96Å; V480-P494 HydrophobicContact CG2-CB 3.71Å
481	P	78.3	Confident	66.3	Low	29 Å²	29	76.4 Å²	76.4	19%	0.188	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	140.8	171.9	30.4	-34.6	0	0	0	110.8	I411 M433	I411-P481 HydrophobicContact CD1-CB 4.29Å; I411-P481 HydrophobicContact CD1-CG 4.38Å; M433-P481 HydrophobicContact CE-CB 3.78Å; M433-P481 HydrophobicContact SD-CB 3.64Å
482	M	65.8	Low	65.1	Low	73 Å²	73	80.1 Å²	80.1	36%	0.36	42%	0.42	S	S	.	.			trans	-97	134.3	171.1	-61.2	-164.7	71.1	0	0	110	A435 R437 I456 T484	A435-M482 HydrophobicContact CB-CB 4.17Å; A435-M482 HydrophobicContact CB-SD 4.46Å; A435-M482 PolarHBondContact O-N 3.24Å; A435-M482 VanDerWaalsContact O-N 3.07Å; R437-M482 HydrophobicContact CB-CG 4.08Å; R437-M482 HydrophobicContact CB-SD 4.01Å; I456-M482 HydrophobicContact CD1-CE 4.23Å; I456-M482 HydrophobicContact CD1-SD 3.95Å; I456-M482 HydrophobicContact CG1-SD 3.96Å; I456-M482 HydrophobicContact CG2-SD 3.89Å; M482-T484 PolarHBondContact O-N 3.16Å
483	E	58.9	Low	64.2	Low	172 Å²	172	78.2 Å²	78.2	80%	0.804	42%	0.417	S	S	*	.			trans	-76.2	110.6	-168.5	-167.5	174.6	-148.5	0	0	111.6
484	T	48.3	Very low	63.9	Low	72 Å²	72	81.2 Å²	81.2	44%	0.442	44%	0.436	S	S	.	.			trans	-137.2	128.4	164.1	64.5	0	0	0	0	109.9	T434 M482	T434-T484 WeakPolarHBondContact CG2-OG1 3.43Å; T434-T484 VanDerWaalsContact OG1-CG2 3.26Å; T434-T484 WeakPolarHBondContact OG1-CG2 3.32Å; T434-T484 PolarHBondContact OG1-OG1 2.88Å; M482-T484 PolarHBondContact O-N 3.16Å
485	S	42.7	Very low	63.9	Low	99 Å²	99	81.1 Å²	81.1	69%	0.692	43%	0.432	S	S	*	.	S	Bend	trans	77.7	146.3	-179.3	81.5	0	0	0	0	117.4	T487	S485-T487 VanDerWaalsContact C-N 3.27Å; S485-T487 PolarHBondContact O-N 3.17Å
486	N	41.3	Very low	63.9	Low	175 Å²	175	82.2 Å²	82.2	94%	0.936	44%	0.441	S	S	*	.	S	Bend	trans	-69.1	50.8	-163	-70	-36.9	0	0	0	116.4
487	T	39.7	Very low	63.9	Low	104 Å²	104	80.3 Å²	80.3	64%	0.638	44%	0.438	S	S	*	.			trans	-119.1	113.7	177.8	-17.2	0	0	0	0	110.9	S485 L489	S485-T487 VanDerWaalsContact C-N 3.27Å; S485-T487 PolarHBondContact O-N 3.17Å; T487-L489 PolarHBondContact O-N 2.86Å
488	Y	41.8	Very low	63.9	Low	230 Å²	230	85.9 Å²	85.9	90%	0.902	46%	0.464	S	S	*	.			trans	-58.1	100.2	179.5	-81.5	-91.9	0	0	0	111.9	S490	Y488-S490 PolarHBondContact O-N 3.25Å
489	L	48	Very low	63.8	Low	69 Å²	69	86.1 Å²	86.1	36%	0.361	47%	0.465	S	S	.	.			trans	-86.9	101.6	164	-76.3	160.7	0	0	0	107.6	I410 L431 M433 T487 D491	I410-L489 HydrophobicContact CD1-CD2 3.77Å; I410-L489 HydrophobicContact CG1-CD2 4.09Å; I410-L489 HydrophobicContact CG2-CD2 3.91Å; L431-L489 HydrophobicContact CD1-CD2 3.87Å; M433-L489 HydrophobicContact CE-CD1 4.43Å; T487-L489 PolarHBondContact O-N 2.86Å; L489-D491 PolarHBondContact O-N 2.84Å
490	S	42.1	Very low	63.7	Low	123 Å²	123	92.4 Å²	92.4	86%	0.86	49%	0.494	S	S	*	.	S	Bend	trans	-72.6	7.4	-173.7	59.3	0	0	0	0	115	Y488	Y488-S490 PolarHBondContact O-N 3.25Å
491	D	47.2	Very low	63.6	Low	70 Å²	70	91.3 Å²	91.3	37%	0.374	49%	0.488	S	S	.	.			trans	-146.7	86	-169.4	-149.3	-16.5	0	0	0	110.5	I410 L489 T493	I410-D491 HydrophobicContact CD1-CB 4.13Å; L489-D491 PolarHBondContact O-N 2.84Å; D491-T493 PolarHBondContact O-N 3.09Å; D491-T493 WeakPolarHBondContact OD1-CB 2.99Å; D491-T493 WeakPolarHBondContact OD1-CG2 3.49Å; D491-T493 PolarHBondContact OD1-N 3.05Å; D491-T493 PolarHBondContact OD1-OG1 3.11Å
492	E	55.1	Low	63.6	Low	121 Å²	121	91.4 Å²	91.4	57%	0.565	49%	0.491	S	S	*	.			trans	-78.6	13.2	170.6	-65.5	-176.8	155.5	0	0	112.2	P494	E492-P494 WeakPolarHBondContact O-CD 3.23Å
493	T	62	Low	63.8	Low	84 Å²	84	92.1 Å²	92.1	52%	0.515	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-66.4	126.8	-179.3	55.2	0	0	0	0	110.4	D491 E495	D491-T493 PolarHBondContact O-N 3.09Å; D491-T493 WeakPolarHBondContact OD1-CB 2.99Å; D491-T493 WeakPolarHBondContact OD1-CG2 3.49Å; D491-T493 PolarHBondContact OD1-N 3.05Å; D491-T493 PolarHBondContact OD1-OG1 3.11Å; T493-E495 PolarHBondContact O-N 3.05Å; T493-E495 VanDerWaalsContact O-N 3.16Å
494	P	73	Confident	64.1	Low	72 Å²	72	88.8 Å²	88.8	47%	0.468	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-66.4	117.3	176.4	25.7	-32.9	0	0	0	109.1	C478 V480 E492 C496	C478-P494 HydrophobicContact CB-CB 4.42Å; V480-P494 HydrophobicContact CG2-CB 3.71Å; E492-P494 WeakPolarHBondContact O-CD 3.23Å; P494-C496 PolarHBondContact O-N 2.69Å
495	E	83	Confident	64.5	Low	48 Å²	48	94.9 Å²	94.9	22%	0.224	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	122.5	165.5	-76.6	-74.7	179.8	0	0	107.1	K409 I413 C478 M479 T493	K409-E495 VanDerWaalsContact CD-OE1 3.23Å; K409-E495 WeakPolarHBondContact CD-OE1 3.39Å; K409-E495 VanDerWaalsContact CE-OE1 3.25Å; K409-E495 WeakPolarHBondContact CE-OE1 3.46Å; K409-E495 IonicContact NZ-OE1 3.22Å; K409-E495 PolarHBondContact NZ-OE1 3.28Å; K409-E495 IonicContact NZ-OE2 2.7Å; K409-E495 PolarHBondContact NZ-OE2 3.26Å; I413-E495 HydrophobicContact CD1-CB 3.88Å; I413-E495 WeakPolarHBondContact CD1-O 3.26Å; I413-E495 HydrophobicContact CG1-CB 4.32Å; C478-E495 CarbonylContact C-O 3.52Å; C478-E495 VanDerWaalsContact CA-O 3.27Å; C478-E495 WeakPolarHBondContact CA-O 3.4Å; M479-E495 PolarHBondContact N-O 2.74Å; M479-E495 PolarHBondContact O-N 3.47Å; T493-E495 PolarHBondContact O-N 3.05Å; T493-E495 VanDerWaalsContact O-N 3.16Å
496	C	85	Confident	64.2	Low	38 Å²	38	97.9 Å²	97.9	26%	0.257	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	144.4	-177.3	-64.5	0	0	0	0	110.4	V477 C478 P494	V477-C496 CarbonylContact O-C 3.05Å; V477-C496 VanDerWaalsContact O-CA 3.23Å; V477-C496 WeakPolarHBondContact O-CA 3.36Å; C478-C496 HydrophobicContact CB-CB 4.14Å; C478-C496 WeakPolarHBondContact CB-SG 3.44Å; C478-C496 WeakPolarHBondContact SG-CB 3.33Å; C478-C496 CovalentContact SG-SG 2.04Å; C478-C496 PolarHBondContact SG-SG 2.79Å; P494-C496 PolarHBondContact O-N 2.69Å
497	I	86.3	Confident	64	Low	61 Å²	61	100 Å²	100	31%	0.313	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	142.8	176.8	-171	169	0	0	0	109.8	I413 V415 V477	I413-I497 HydrophobicContact CB-CG2 4.45Å; I413-I497 HydrophobicContact CG2-CG2 4.16Å; V415-I497 HydrophobicContact CB-CG2 4.23Å; V415-I497 HydrophobicContact CG2-CG2 3.42Å; V415-I497 VanDerWaalsContact CG2-CG2 3.42Å; V477-I497 HydrophobicContact CB-CG2 4.31Å; V477-I497 PolarHBondContact N-O 3.33Å; V477-I497 PolarHBondContact O-N 3.38Å
498	E	87.3	Confident	63.6	Low	117 Å²	117	100.6 Å²	100.6	55%	0.547	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	142.6	179.9	-69.1	173.5	-178.5	0	0	109.7	Y475 R476	Y475-E498 WeakPolarHBondContact O-CA 3.28Å; R476-E498 HydrophobicContact CB-CG 4.03Å; R476-E498 WeakPolarHBondContact CD-OE1 3.45Å; R476-E498 HydrophobicContact CG-CG 3.9Å; R476-E498 IonicContact CZ-OE1 2.75Å; R476-E498 IonicContact NE-OE1 2.75Å; R476-E498 IonicContact NH1-OE1 3.95Å; R476-E498 PolarHBondContact NH1-OE1 3.05Å
499	T	84.2	Confident	63.4	Low	24 Å²	24	95.1 Å²	95.1	15%	0.147	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	160.8	-172.7	-170.4	0	0	0	0	110	V415 I423 P474 Y475 V477	V415-T499 HydrophobicContact CG1-CG2 3.67Å; I423-T499 HydrophobicContact CD1-CG2 3.73Å; I423-T499 HydrophobicContact CG2-CG2 4.33Å; P474-T499 CarbonylContact C-O 3.16Å; P474-T499 WeakPolarHBondContact CA-O 3.41Å; Y475-T499 PolarHBondContact N-O 2.96Å; Y475-T499 PolarHBondContact O-N 2.91Å; V477-T499 HydrophobicContact CG2-CG2 4.39Å
500	E	83.6	Confident	62.6	Low	132 Å²	132	98.1 Å²	98.1	62%	0.617	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126	138.1	179.2	-72.2	173.8	173.4	0	0	109.9	S417 P474	S417-E500 VanDerWaalsContact CB-O 3.28Å; S417-E500 WeakPolarHBondContact CB-O 3.42Å; S417-E500 PolarHBondContact OG-O 3.05Å; P474-E500 HydrophobicContact CB-CG 3.92Å
501	T	82.8	Confident	62.2	Low	5 Å²	5	98.5 Å²	98.5	3%	0.031	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-64.5	148.3	170.5	43.8	0	0	0	0	110.5	T420 I423 L469 E470 E472 S473 Y475	T420-T501 WeakPolarHBondContact O-CB 3.33Å; I423-T501 HydrophobicContact CD1-CG2 3.84Å; I423-T501 HydrophobicContact CG1-CG2 4.04Å; L469-T501 HydrophobicContact CB-CG2 3.93Å; L469-T501 HydrophobicContact CD1-CG2 4.17Å; E470-T501 WeakPolarHBondContact O-CB 3.41Å; E470-T501 WeakPolarHBondContact O-CG2 3.36Å; E470-T501 PolarHBondContact O-OG1 3.37Å; E472-T501 PolarHBondContact N-OG1 2.99Å; E472-T501 VanDerWaalsContact N-OG1 3.08Å; S473-T501 PolarHBondContact N-OG1 3.24Å; S473-T501 PolarHBondContact O-N 3.13Å; S473-T501 PolarHBondContact O-OG1 3.01Å; Y475-T501 HydrophobicContact CD2-CG2 4.21Å; Y475-T501 HydrophobicContact CE2-CG2 4.02Å
502	A	77.4	Confident	61.4	Low	30 Å²	30	101.5 Å²	101.5	25%	0.248	54%	0.542	C	S	.	.	P	Polyproline II helix	trans	-64.6	146.8	-175.2	0	0	0	0	0	111.3	S419 T420	S419-A502 WeakPolarHBondContact O-CB 3.06Å; S419-A502 PolarHBondContact O-N 3.2Å; T420-A502 WeakPolarHBondContact CA-O 3.33Å
503	P	70.4	Confident	60.1	Low	89 Å²	89	103 Å²	103	58%	0.578	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-65.7	147.5	-179.7	26.1	-34.3	0	0	0	112.6	E472 K505	E472-P503 HydrophobicContact CG-CB 4.04Å; E472-P503 WeakPolarHBondContact OE1-CA 3.49Å; E472-P503 WeakPolarHBondContact OE1-CB 3.36Å; P503-K505 PolarHBondContact O-N 3.14Å
504	L	65.6	Low	58.6	Low	101 Å²	101	106 Å²	106	53%	0.529	57%	0.565	S	S	.	*			trans	-66.6	105.8	170.6	-92.4	160.2	0	0	0	107.7	T420 P471 E472 M506	T420-L504 HydrophobicContact CG2-CD2 4.26Å; T420-L504 HydrophobicContact CG2-CG 4.23Å; P471-L504 HydrophobicContact CB-CD1 3.85Å; P471-L504 HydrophobicContact CB-CG 4Å; P471-L504 HydrophobicContact CG-CD1 3.73Å; P471-L504 HydrophobicContact CG-CG 4.37Å; E472-L504 PolarHBondContact OE1-N 3.28Å; L504-M506 VanDerWaalsContact C-N 3.35Å; L504-M506 PolarHBondContact O-N 3.34Å
505	K	56	Low	56.5	Low	200 Å²	200	114.2 Å²	114.2	87%	0.87	59%	0.587	S	S	*	*			trans	-60.1	99.4	170.2	-82.6	-173.6	174.6	179.8	0	108.9	P503 Y507	P503-K505 PolarHBondContact O-N 3.14Å; K505-Y507 PolarHBondContact O-N 2.97Å
506	M	36.6	Very low	54	Low	163 Å²	163	120.6 Å²	120.6	80%	0.803	62%	0.617	S	S	*	*			trans	-56	109.7	172.1	-76.4	-173.9	70.2	0	0	109.4	L504 N508	L504-M506 VanDerWaalsContact C-N 3.35Å; L504-M506 PolarHBondContact O-N 3.34Å; M506-N508 PolarHBondContact O-N 3.09Å; M506-N508 VanDerWaalsContact O-N 3.1Å
507	Y	36.7	Very low	51.3	Low	219 Å²	219	126.3 Å²	126.3	86%	0.859	64%	0.64	S	S	*	*			trans	-75.7	94.8	167.5	-163.2	-86.3	0	0	0	107.4	K505 P509	K505-Y507 PolarHBondContact O-N 2.97Å; Y507-P509 VanDerWaalsContact O-CD 3.24Å; Y507-P509 WeakPolarHBondContact O-CD 3.34Å
508	N	31.8	Very low	48.5	Very low	116 Å²	116	129.4 Å²	129.4	62%	0.62	65%	0.653	S	S	*	*			trans	-58.7	118.1	178	-83	-13.9	0	0	0	110.1	M506 T510	M506-N508 PolarHBondContact O-N 3.09Å; M506-N508 VanDerWaalsContact O-N 3.1Å; N508-T510 PolarHBondContact O-N 3.05Å
509	P	37.6	Very low	45.6	Very low	116 Å²	116	132.2 Å²	132.2	75%	0.753	66%	0.663	S	S	*	*			trans	-85.1	95.1	175.5	33.3	-29.4	0	0	0	109.2	Y507	Y507-P509 VanDerWaalsContact O-CD 3.24Å; Y507-P509 WeakPolarHBondContact O-CD 3.34Å
510	T	31	Very low	43	Very low	132 Å²	132	137.9 Å²	137.9	81%	0.81	69%	0.688	S	S	*	*			trans	-112.8	91.5	167.5	34.2	0	0	0	0	111	N508	N508-T510 PolarHBondContact O-N 3.05Å
511	T	33.7	Very low	40.8	Very low	130 Å²	130	137.6 Å²	137.6	80%	0.798	70%	0.698	S	S	*	*			trans	-71.3	121.9	160.6	45.4	0	0	0	0	110
512	T	29.9	Very low	38.2	Very low	134 Å²	134	145.2 Å²	145.2	82%	0.822	73%	0.727	S	S	*	*				178.5	122.5	117.4	34.6	0	0	0	0	112
513	L	29.1	Very low	36	Very low	152 Å²	152	154 Å²	154	80%	0.796	76%	0.76	S	S	*	*			trans	41.4	125.6	133	-135.8	73.1	0	0	0	121
514	N	29.6	Very low	34.2	Very low	146 Å²	146	155.9 Å²	155.9	78%	0.781	77%	0.765	S	S	*	*			trans	64	100.5	157.2	-61.8	-13.6	0	0	0	119
515	R	28.1	Very low	32.7	Very low	246 Å²	246	156.3 Å²	156.3	93%	0.928	78%	0.776	S	S	*	*				-159.6	119.8	115.9	-173	148.8	175.6	157.4	-2.5	111.3
516	E	32.1	Very low	31.7	Very low	181 Å²	181	152.5 Å²	152.5	85%	0.846	78%	0.775	S	S	*	*			trans	-70.3	170.6	165	-66.3	179.1	122.3	0	0	111.4
517	Q	28.4	Very low	32.3	Very low	159 Å²	159	152.9 Å²	152.9	74%	0.743	78%	0.779	S	S	*	*			trans	103.1	107.5	148.4	-154.1	167.3	4.8	0	0	118.3
518	E	27.2	Very low	33.3	Very low	125 Å²	125	146.7 Å²	146.7	58%	0.584	77%	0.766	S	S	*	*			trans	89.2	120.8	141.5	-81.9	175.3	-135.7	0	0	123.4
519	K	26.7	Very low	33.9	Very low	177 Å²	177	147.6 Å²	147.6	77%	0.77	77%	0.77	S	S	*	*			trans	84.9	108.9	137.4	-73.1	165.4	-180	152.7	0	119.3
520	E	28.1	Very low	34.5	Very low	142 Å²	142	146.1 Å²	146.1	66%	0.664	77%	0.768	S	S	*	*			trans	-59.9	175.4	147.9	-52.6	-168.6	165.9	0	0	112.3	Y522	E520-Y522 WeakPolarHBondContact OE2-CD2 3.29Å; E520-Y522 WeakPolarHBondContact OE2-CE2 3.31Å; E520-Y522 PolarHBondContact OE2-N 3.06Å
521	P	38	Very low	35.4	Very low	126 Å²	126	143.8 Å²	143.8	82%	0.818	76%	0.762	S	S	*	*				-135.2	127.1	92.7	34.7	-23.4	0	0	0	115.7
522	Y	29	Very low	36.5	Very low	166 Å²	166	144.1 Å²	144.1	65%	0.651	76%	0.757	S	S	*	*			trans	23.6	121.6	137.5	-86.6	-103.1	0	0	0	119.6	E520 N524	E520-Y522 WeakPolarHBondContact OE2-CD2 3.29Å; E520-Y522 WeakPolarHBondContact OE2-CE2 3.31Å; E520-Y522 PolarHBondContact OE2-N 3.06Å; Y522-N524 HydrophobicContact CD1-CB 4.45Å; Y522-N524 WeakPolarHBondContact CE1-ND2 3.25Å
523	K	29.5	Very low	37.9	Very low	214 Å²	214	142.5 Å²	142.5	93%	0.93	74%	0.742	S	S	*	*				-142.6	97	123.7	-123.6	-179.9	-174.1	-179.8	0	111.6
524	N	33.6	Very low	39.5	Very low	128 Å²	128	137.4 Å²	137.4	68%	0.684	73%	0.727	S	S	*	*			trans	-77.8	145.7	170.7	-82.5	-9.8	0	0	0	111.4	Y522	Y522-N524 HydrophobicContact CD1-CB 4.45Å; Y522-N524 WeakPolarHBondContact CE1-ND2 3.25Å
525	S	34.4	Very low	41.3	Very low	110 Å²	110	132.3 Å²	132.3	77%	0.769	71%	0.708	S	S	*	*			trans	-153.1	112.2	139	56.9	0	0	0	0	111.9
526	S	35.3	Very low	43.1	Very low	120 Å²	120	123.1 Å²	123.1	84%	0.839	69%	0.685	S	S	*	*			trans	59.2	113.6	159.9	50.4	0	0	0	0	120.2
527	L	47.5	Very low	45.3	Very low	172 Å²	172	119.1 Å²	119.1	90%	0.901	67%	0.673	S	S	*	*			trans	-86.7	-166	171.2	-130.7	86.1	0	0	0	110.8
528	P	59.1	Low	47.5	Very low	88 Å²	88	114 Å²	114	57%	0.571	66%	0.658	S	S	*	*			trans	-115.1	-172.8	-142.7	37.7	-17.3	0	0	0	113.8
529	L	44.3	Very low	49.9	Very low	136 Å²	136	114 Å²	114	71%	0.712	66%	0.661	S	S	*	*	S	Bend	trans	-148.1	-30.2	164.2	-139.7	81.1	0	0	0	115.5	A531 I533	L529-A531 PolarHBondContact O-N 3.48Å; L529-I533 HydrophobicContact CD2-CD1 4.46Å
530	A	50.3	Low	52.5	Low	85 Å²	85	109.9 Å²	109.9	70%	0.702	65%	0.65	S	S	*	*	H	α-helix	trans	-70.2	-34.7	-169.5	0	0	0	0	0	115.4	G534	A530-G534 PolarHBondContact O-N 3.04Å
531	A	50	Low	55	Low	83 Å²	83	105.4 Å²	105.4	69%	0.686	64%	0.638	S	S	*	*	H	α-helix	trans	-71	-35.3	-170.3	0	0	0	0	0	114.1	L529 G535	L529-A531 PolarHBondContact O-N 3.48Å; A531-G535 PolarHBondContact O-N 3.14Å
532	I	56.3	Low	57.2	Low	136 Å²	136	104.7 Å²	104.7	70%	0.697	63%	0.626	S	S	*	*	H	α-helix	trans	-75.1	-37.2	-176.1	-58.2	176.4	0	0	0	110.7	G535 A536	I532-G535 PolarHBondContact O-N 3.42Å; I532-A536 PolarHBondContact O-N 3.02Å
533	I	58.6	Low	59.8	Low	101 Å²	101	99.3 Å²	99.3	52%	0.518	62%	0.616	S	S	.	*	H	α-helix	trans	-67.3	-42.9	178.8	-57.8	173.6	0	0	0	110.5	L529 G535 A536 V537	L529-I533 HydrophobicContact CD2-CD1 4.46Å; I533-G535 PolarHBondContact O-N 2.87Å; I533-A536 PolarHBondContact O-N 3.48Å; I533-V537 WeakPolarHBondContact O-CG2 3.24Å; I533-V537 PolarHBondContact O-N 3.16Å; I533-V537 VanDerWaalsContact O-N 3.11Å
534	G	63.5	Low	62.3	Low	45 Å²	45	94.1 Å²	94.1	46%	0.464	60%	0.598	S	S	.	*	H	α-helix	trans	-60.3	-43.1	176.8	0	0	0	0	0	113.4	A530 V537 A538	A530-G534 PolarHBondContact O-N 3.04Å; G534-V537 PolarHBondContact O-N 3.31Å; G534-A538 PolarHBondContact O-N 3.15Å
535	G	67.8	Low	64.6	Low	38 Å²	38	93.4 Å²	93.4	39%	0.392	59%	0.593	S	S	.	*	H	α-helix	trans	-64.1	-40.4	177.2	0	0	0	0	0	113.5	A531 I532 I533 L539	A531-G535 PolarHBondContact O-N 3.14Å; I532-G535 PolarHBondContact O-N 3.42Å; I533-G535 PolarHBondContact O-N 2.87Å; G535-L539 PolarHBondContact O-N 3.16Å
536	A	64.8	Low	66.8	Low	54 Å²	54	91.1 Å²	91.1	45%	0.446	58%	0.581	S	S	.	*	H	α-helix	trans	-66.5	-42.5	178	0	0	0	0	0	112.5	I532 I533 A538 L539 V540	I532-A536 PolarHBondContact O-N 3.02Å; I533-A536 PolarHBondContact O-N 3.48Å; A536-A538 PolarHBondContact O-N 2.9Å; A536-L539 PolarHBondContact O-N 3.4Å; A536-V540 WeakPolarHBondContact O-CG2 3.49Å; A536-V540 PolarHBondContact O-N 3.28Å; A536-V540 VanDerWaalsContact O-N 3.17Å
537	V	78.9	Confident	68.9	Low	96 Å²	96	90.1 Å²	90.1	58%	0.582	57%	0.566	S	S	*	*	H	α-helix	trans	-64.5	-40.8	179.2	172.9	0	0	0	0	111.5	I533 G534 L539 V540 A541	I533-V537 WeakPolarHBondContact O-CG2 3.24Å; I533-V537 PolarHBondContact O-N 3.16Å; I533-V537 VanDerWaalsContact O-N 3.11Å; G534-V537 PolarHBondContact O-N 3.31Å; V537-L539 PolarHBondContact O-N 3.28Å; V537-V540 PolarHBondContact O-N 2.85Å; V537-A541 PolarHBondContact O-N 3.16Å
538	A	73.8	Confident	70.4	Confident	52 Å²	52	86 Å²	86	43%	0.43	55%	0.547	S	S	.	.	H	α-helix	trans	-61.4	-43.3	177.5	0	0	0	0	0	112.5	G534 A536 A541 I542	G534-A538 PolarHBondContact O-N 3.15Å; A536-A538 PolarHBondContact O-N 2.9Å; A538-A541 PolarHBondContact O-N 3.4Å; A538-I542 WeakPolarHBondContact O-CG1 3.4Å; A538-I542 PolarHBondContact O-N 2.95Å; A538-I542 VanDerWaalsContact O-N 3.08Å
539	L	77.4	Confident	71.1	Confident	125 Å²	125	85.9 Å²	85.9	65%	0.654	55%	0.548	S	S	*	.	H	α-helix	trans	-66.5	-37.6	178.5	-70.9	171.4	0	0	0	112.6	G535 A536 V537 I542 A543	G535-L539 PolarHBondContact O-N 3.16Å; A536-L539 PolarHBondContact O-N 3.4Å; V537-L539 PolarHBondContact O-N 3.28Å; L539-I542 PolarHBondContact O-N 3.2Å; L539-A543 WeakPolarHBondContact O-CB 3.39Å; L539-A543 PolarHBondContact O-N 3.37Å
540	V	82.8	Confident	72.8	Confident	90 Å²	90	86.8 Å²	86.8	55%	0.545	54%	0.542	S	S	.	.	H	α-helix	trans	-67.1	-39.8	175.1	174	0	0	0	0	111.5	A536 V537 A543 L544	A536-V540 WeakPolarHBondContact O-CG2 3.49Å; A536-V540 PolarHBondContact O-N 3.28Å; A536-V540 VanDerWaalsContact O-N 3.17Å; V537-V540 PolarHBondContact O-N 2.85Å; V540-A543 PolarHBondContact O-N 2.87Å; V540-L544 HydrophobicContact CG1-CD1 4.05Å; V540-L544 WeakPolarHBondContact O-CG 2.99Å; V540-L544 PolarHBondContact O-N 3.34Å
541	A	80	Confident	73.9	Confident	48 Å²	48	89.9 Å²	89.9	40%	0.397	54%	0.536	S	S	.	.	H	α-helix	trans	-63.2	-41.8	176.5	0	0	0	0	0	112.4	V537 A538 L544 L545	V537-A541 PolarHBondContact O-N 3.16Å; A538-A541 PolarHBondContact O-N 3.4Å; A541-L544 PolarHBondContact O-N 3.05Å; A541-L545 PolarHBondContact O-N 3.14Å
542	I	85.1	Confident	74.9	Confident	112 Å²	112	90.4 Å²	90.4	57%	0.574	53%	0.531	S	S	*	.	H	α-helix	trans	-64.9	-42	176.2	-67	164.8	0	0	0	110.9	A538 L539 L545 A546	A538-I542 WeakPolarHBondContact O-CG1 3.4Å; A538-I542 PolarHBondContact O-N 2.95Å; A538-I542 VanDerWaalsContact O-N 3.08Å; L539-I542 PolarHBondContact O-N 3.2Å; I542-L545 PolarHBondContact O-N 3.45Å; I542-A546 PolarHBondContact O-N 3.16Å
543	A	82.8	Confident	75.3	Confident	53 Å²	53	92 Å²	92	44%	0.438	54%	0.535	S	S	.	.	H	α-helix	trans	-64.3	-39.1	176.6	0	0	0	0	0	112.7	L539 V540 A546 L547	L539-A543 WeakPolarHBondContact O-CB 3.39Å; L539-A543 PolarHBondContact O-N 3.37Å; V540-A543 PolarHBondContact O-N 2.87Å; A543-A546 PolarHBondContact O-N 3.43Å; A543-L547 PolarHBondContact O-N 3.09Å
544	L	82.9	Confident	75.5	Confident	104 Å²	104	94.9 Å²	94.9	55%	0.545	54%	0.539	S	S	.	.	H	α-helix	trans	-66.5	-42.1	175.2	-76.5	168.6	0	0	0	112.2	V540 A541 A546 L547 V548	V540-L544 HydrophobicContact CG1-CD1 4.05Å; V540-L544 WeakPolarHBondContact O-CG 2.99Å; V540-L544 PolarHBondContact O-N 3.34Å; A541-L544 PolarHBondContact O-N 3.05Å; L544-A546 PolarHBondContact O-N 3.29Å; L544-L547 PolarHBondContact O-N 3.09Å; L544-V548 WeakPolarHBondContact O-CG2 3.18Å; L544-V548 PolarHBondContact O-N 3.01Å
545	L	79.9	Confident	75	Confident	113 Å²	113	96.5 Å²	96.5	59%	0.592	54%	0.537	S	S	*	.	H	α-helix	trans	-60.9	-43.8	174.2	-83.8	163	0	0	0	111.8	A541 I542 L547 V548 C549	A541-L545 PolarHBondContact O-N 3.14Å; I542-L545 PolarHBondContact O-N 3.45Å; L545-L547 VanDerWaalsContact C-N 3.34Å; L545-L547 PolarHBondContact O-N 3.41Å; L545-V548 PolarHBondContact O-N 3.05Å; L545-C549 PolarHBondContact O-N 2.85Å; L545-C549 PolarHBondContact O-SG 3.12Å; L545-C549 VanDerWaalsContact O-SG 3.37Å
546	A	81.6	Confident	74.1	Confident	62 Å²	62	97.7 Å²	97.7	51%	0.512	55%	0.55	S	S	.	.	H	α-helix	trans	-60.8	-40.9	175.5	0	0	0	0	0	112.4	I542 A543 L544 W550	I542-A546 PolarHBondContact O-N 3.16Å; A543-A546 PolarHBondContact O-N 3.43Å; L544-A546 PolarHBondContact O-N 3.29Å; A546-W550 WeakPolarHBondContact O-CB 3.42Å; A546-W550 PolarHBondContact O-N 3Å
547	L	80.4	Confident	73.3	Confident	100 Å²	100	100 Å²	100	52%	0.524	56%	0.562	S	S	.	*	H	α-helix	trans	-65.6	-40	174.9	-84.1	163.9	0	0	0	112.8	A543 L544 L545 W550 Y551	A543-L547 PolarHBondContact O-N 3.09Å; L544-L547 PolarHBondContact O-N 3.09Å; L545-L547 VanDerWaalsContact C-N 3.34Å; L545-L547 PolarHBondContact O-N 3.41Å; L547-W550 HydrophobicContact CD2-CE3 4.35Å; L547-W550 PolarHBondContact O-N 3.12Å; L547-Y551 WeakPolarHBondContact O-CB 3.04Å; L547-Y551 PolarHBondContact O-N 3.04Å
548	V	78.4	Confident	71.6	Confident	84 Å²	84	102.4 Å²	102.4	51%	0.509	57%	0.571	S	S	.	*	H	α-helix	trans	-65.4	-46.2	175.6	170.8	0	0	0	0	110.8	L544 L545 W550 Y551 V552	L544-V548 WeakPolarHBondContact O-CG2 3.18Å; L544-V548 PolarHBondContact O-N 3.01Å; L545-V548 PolarHBondContact O-N 3.05Å; V548-W550 VanDerWaalsContact C-N 3.32Å; V548-W550 PolarHBondContact O-N 3.4Å; V548-Y551 PolarHBondContact O-N 2.78Å; V548-V552 HydrophobicContact CG1-CG2 4.33Å; V548-V552 WeakPolarHBondContact O-CB 3.44Å; V548-V552 WeakPolarHBondContact O-CG2 3.32Å; V548-V552 PolarHBondContact O-N 3.12Å
549	C	74.4	Confident	70	Confident	86 Å²	86	110.1 Å²	110.1	58%	0.581	60%	0.596	S	S	*	*	H	α-helix	trans	-59.7	-41.9	175.2	-69.9	0	0	0	0	112	L545 H553	L545-C549 PolarHBondContact O-N 2.85Å; L545-C549 PolarHBondContact O-SG 3.12Å; L545-C549 VanDerWaalsContact O-SG 3.37Å; C549-H553 WeakPolarHBondContact O-CB 3.41Å; C549-H553 PolarHBondContact O-N 3.09Å
550	W	79.6	Confident	68.3	Low	155 Å²	155	109.5 Å²	109.5	59%	0.587	60%	0.602	S	S	*	*	H	α-helix	trans	-65.3	-40.6	176	-174.4	64.9	0	0	0	112.7	A546 L547 V548 R554	A546-W550 WeakPolarHBondContact O-CB 3.42Å; A546-W550 PolarHBondContact O-N 3Å; L547-W550 HydrophobicContact CD2-CE3 4.35Å; L547-W550 PolarHBondContact O-N 3.12Å; V548-W550 VanDerWaalsContact C-N 3.32Å; V548-W550 PolarHBondContact O-N 3.4Å; W550-R554 VanDerWaalsContact CH2-NH1 3.35Å; W550-R554 VanDerWaalsContact CZ2-NH1 3.33Å; W550-R554 WeakPolarHBondContact O-CB 3.42Å; W550-R554 PolarHBondContact O-N 3.22Å
551	Y	73.4	Confident	66.4	Low	150 Å²	150	116.5 Å²	116.5	59%	0.588	62%	0.619	S	S	*	*	H	α-helix	trans	-66.8	-44.7	177.5	-173.8	-102.7	0	0	0	112.3	L547 V548 R554 N555	L547-Y551 WeakPolarHBondContact O-CB 3.04Å; L547-Y551 PolarHBondContact O-N 3.04Å; V548-Y551 PolarHBondContact O-N 2.78Å; Y551-R554 PolarHBondContact O-N 2.94Å; Y551-N555 PolarHBondContact O-N 2.8Å; Y551-N555 PolarHBondContact OH-ND2 3.39Å
552	V	69.9	Low	64.4	Low	95 Å²	95	122 Å²	122	58%	0.576	64%	0.641	S	S	*	*	H	α-helix	trans	-63.2	-44.3	176.8	171.8	0	0	0	0	111	V548 R554 N555 G556	V548-V552 HydrophobicContact CG1-CG2 4.33Å; V548-V552 WeakPolarHBondContact O-CB 3.44Å; V548-V552 WeakPolarHBondContact O-CG2 3.32Å; V548-V552 PolarHBondContact O-N 3.12Å; V552-R554 VanDerWaalsContact C-N 3.27Å; V552-R554 PolarHBondContact O-N 3.16Å; V552-N555 PolarHBondContact O-N 3.37Å; V552-G556 PolarHBondContact O-N 3.18Å
553	H	66	Low	62.1	Low	168 Å²	168	123.4 Å²	123.4	78%	0.778	66%	0.66	S	S	*	*	H	α-helix	trans	-63.4	-32.1	176.1	-170.7	-83.8	0	0	0	112.6	C549	C549-H553 WeakPolarHBondContact O-CB 3.41Å; C549-H553 PolarHBondContact O-N 3.09Å
554	R	61.4	Low	59.6	Low	163 Å²	163	125 Å²	125	62%	0.615	67%	0.673	S	S	*	*	H	α-helix	trans	-80.3	-32	179.8	-165.8	170.6	-175.8	167.6	0.2	113.7	W550 Y551 V552	W550-R554 VanDerWaalsContact CH2-NH1 3.35Å; W550-R554 VanDerWaalsContact CZ2-NH1 3.33Å; W550-R554 WeakPolarHBondContact O-CB 3.42Å; W550-R554 PolarHBondContact O-N 3.22Å; Y551-R554 PolarHBondContact O-N 2.94Å; V552-R554 VanDerWaalsContact C-N 3.27Å; V552-R554 PolarHBondContact O-N 3.16Å
555	N	52.7	Low	57	Low	78 Å²	78	130.2 Å²	130.2	42%	0.417	69%	0.687	S	S	.	*	H	α-helix	trans	-94.6	-7.7	178.9	-81.7	1.9	0	0	0	114.6	Y551 V552 S557	Y551-N555 PolarHBondContact O-N 2.8Å; Y551-N555 PolarHBondContact OH-ND2 3.39Å; V552-N555 PolarHBondContact O-N 3.37Å; N555-S557 PolarHBondContact O-N 3.04Å
556	G	49.4	Very low	54.7	Low	64 Å²	64	130.6 Å²	130.6	66%	0.66	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-63.4	-4.6	178.4	0	0	0	0	0	116.1	V552 L558	V552-G556 PolarHBondContact O-N 3.18Å; G556-L558 VanDerWaalsContact C-N 3.32Å; G556-L558 PolarHBondContact O-N 3.48Å
557	S	48.6	Very low	52.5	Low	101 Å²	101	137.2 Å²	137.2	71%	0.706	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-84.7	7	-177.6	65	0	0	0	0	115.2	N555	N555-S557 PolarHBondContact O-N 3.04Å
558	L	43.5	Very low	50.1	Low	147 Å²	147	136.1 Å²	136.1	77%	0.77	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-107	7.3	-172.2	-90	166.3	0	0	0	116.4	G556	G556-L558 VanDerWaalsContact C-N 3.32Å; G556-L558 PolarHBondContact O-N 3.48Å
559	F	39.4	Very low	48	Very low	214 Å²	214	142.4 Å²	142.4	94%	0.939	74%	0.744	S	S	*	*	S	Bend	trans	-127	43.7	173.6	-119.7	-85.7	0	0	0	114.1
560	S	41.6	Very low	46.2	Very low	113 Å²	113	148.8 Å²	148.8	79%	0.79	76%	0.755	S	S	*	*			trans	-137.9	80.5	163.9	-172.6	0	0	0	0	110.8
561	R	44.1	Very low	44	Very low	237 Å²	237	152.6 Å²	152.6	89%	0.894	77%	0.77	S	S	*	*			trans	-160.6	67.4	171.6	-145.2	166.4	168.9	177.3	-6.3	113.3
562	N	37.9	Very low	42.4	Very low	163 Å²	163	154.6 Å²	154.6	87%	0.872	78%	0.782	S	S	*	*			trans	-170.3	87	151.1	-96.3	-16.3	0	0	0	111.3
563	C	36.3	Very low	40.6	Very low	142 Å²	142	156.8 Å²	156.8	96%	0.959	79%	0.79	S	S	*	*				-169.1	135.9	128.2	-109.2	0	0	0	0	109.6
564	A	30.5	Very low	39	Very low	87 Å²	87	155.9 Å²	155.9	72%	0.719	79%	0.791	S	S	*	*			trans	-104.6	142.5	-171.3	0	0	0	0	0	111.6
565	Y	28.7	Very low	37.4	Very low	212 Å²	212	159.6 Å²	159.6	83%	0.831	81%	0.807	S	S	*	*			trans	40.1	113.8	149.5	-78.2	-96.7	0	0	0	119.5
566	S	31.1	Very low	36.4	Very low	122 Å²	122	160.4 Å²	160.4	85%	0.853	82%	0.824	S	S	*	*				-133.1	144	121.4	83.8	0	0	0	0	109.8
567	K	34.9	Very low	35.6	Very low	200 Å²	200	166.4 Å²	166.4	87%	0.87	84%	0.835	S	S	*	*			trans	-114.7	90.5	-170.4	-150.9	178.1	-170.6	178.3	0	108.6
568	G	30.6	Very low	34.8	Very low	77 Å²	77	166.8 Å²	166.8	79%	0.794	85%	0.845	S	S	*	*			trans	-106.6	140.9	179.9	0	0	0	0	0	112.5
569	R	34.5	Very low	34.2	Very low	217 Å²	217	163.1 Å²	163.1	82%	0.819	84%	0.842	S	S	*	*			trans	-100.1	142.7	-169.8	-129.2	-179	-178.2	179.6	0.8	111.6
570	R	35.1	Very low	34.3	Very low	219 Å²	219	160.3 Å²	160.3	83%	0.826	84%	0.842	S	S	*	*			trans	69.5	150.3	167	-56.1	165.6	172.2	173.5	-5.4	113.3
571	R	33.6	Very low	33.6	Very low	236 Å²	236	163.5 Å²	163.5	89%	0.891	84%	0.842	S	S	*	*			cis	-136.1	166.7	7	-131.1	168.3	-172.7	161.3	-3.6	109
572	K	39.6	Very low	33.4	Very low	192 Å²	192	160.8 Å²	160.8	84%	0.835	84%	0.837	S	S	*	*			trans	-90.6	126	-178.4	168.9	-163.6	-177.4	-171	0	108.6
573	D	32.7	Very low	33.2	Very low	141 Å²	141	159.8 Å²	159.8	75%	0.754	83%	0.831	S	S	*	*			trans	-155.4	152.1	158.8	-78.8	-45.7	0	0	0	111.3
574	D	32.9	Very low	33.6	Very low	149 Å²	149	160.2 Å²	160.2	80%	0.797	82%	0.824	S	S	*	*			trans	64.6	102.3	158.2	-54.3	-20.5	0	0	0	123.6
575	Y	27.3	Very low	33.8	Very low	240 Å²	240	161.1 Å²	161.1	94%	0.941	83%	0.825	S	S	*	*			trans	-145.9	112.6	146.7	-120.4	-86.7	0	0	0	109
576	A	31.2	Very low	34	Very low	95 Å²	95	158.9 Å²	158.9	79%	0.785	83%	0.826	S	S	*	*			trans	-174.9	92.8	160.1	0	0	0	0	0	106.8
577	E	33.7	Very low	34	Very low	190 Å²	190	160.5 Å²	160.5	89%	0.888	82%	0.824	S	S	*	*				63.7	104.3	80.5	-165.8	169	-157.9	0	0	112.7	G579	E577-G579 PolarHBondContact O-N 2.69Å
578	A	31.6	Very low	33.8	Very low	110 Å²	110	157.1 Å²	157.1	91%	0.909	81%	0.812	S	S	*	*			trans	-81.2	104.8	179.3	0	0	0	0	0	110.9
579	G	31.3	Very low	34	Very low	69 Å²	69	161.1 Å²	161.1	71%	0.711	81%	0.813	S	S	*	*			trans	-115	119.1	169.4	0	0	0	0	0	110.8	E577 K581	E577-G579 PolarHBondContact O-N 2.69Å; G579-K581 PolarHBondContact O-N 2.04Å
580	T	40.9	Very low	33.8	Very low	155 Å²	155	160 Å²	160	95%	0.951	81%	0.809	S	S	*	*			trans	-65.8	124.5	-179.8	44.9	0	0	0	0	111.6
581	K	27.5	Very low	33.9	Very low	181 Å²	181	158.1 Å²	158.1	79%	0.787	81%	0.809	S	S	*	*			trans	-123	123	166.9	-164.4	179.5	175.9	-166.8	0	111.5	G579	G579-K581 PolarHBondContact O-N 2.04Å
582	K	40.5	Very low	34.3	Very low	180 Å²	180	153.8 Å²	153.8	78%	0.783	81%	0.809	S	S	*	*			trans	-58.2	122.7	169.7	174.2	-173.3	-174.9	178.5	0	111
583	D	33.7	Very low	34.1	Very low	141 Å²	141	150 Å²	150	75%	0.754	81%	0.807	S	S	*	*			trans	-136	140	160.1	-89.9	-45.9	0	0	0	110.5
584	N	43.9	Very low	34.3	Very low	152 Å²	152	153.5 Å²	153.5	81%	0.813	82%	0.816	S	S	*	*			trans	-85.6	119	178	-66	-25.2	0	0	0	109.1
585	S	35	Very low	34.4	Very low	105 Å²	105	154.4 Å²	154.4	73%	0.734	82%	0.815	S	S	*	*			trans	-130.2	114.9	158.5	52.2	0	0	0	0	110.1	L587	S585-L587 PolarHBondContact O-N 3.4Å
586	I	32.5	Very low	34.6	Very low	165 Å²	165	151.8 Å²	151.8	85%	0.846	81%	0.814	S	S	*	*			trans	-72.7	116.2	169.1	-67.1	166.7	0	0	0	106.5	E588	I586-E588 PolarHBondContact O-N 2.89Å; I586-E588 VanDerWaalsContact O-N 3.13Å
587	L	31.8	Very low	34.9	Very low	156 Å²	156	153.6 Å²	153.6	82%	0.817	81%	0.809	S	S	*	*			trans	-79.4	88.5	170.5	-86.8	160.6	0	0	0	109.3	S585 I589	S585-L587 PolarHBondContact O-N 3.4Å; L587-I589 PolarHBondContact O-N 3.5Å
588	E	30.1	Very low	35	Very low	130 Å²	130	150.2 Å²	150.2	61%	0.607	80%	0.803	S	S	*	*			trans	-73.4	102	164	-169.1	-177.2	166.9	0	0	108.4	I586 R590	I586-E588 PolarHBondContact O-N 2.89Å; I586-E588 VanDerWaalsContact O-N 3.13Å; E588-R590 HydrophobicContact CG-CG 4.36Å; E588-R590 PolarHBondContact O-N 3.08Å; E588-R590 IonicContact OE1-CZ 3.68Å; E588-R590 IonicContact OE1-NE 2.72Å; E588-R590 PolarHBondContact OE1-NE 2.78Å; E588-R590 IonicContact OE1-NH2 3.92Å; E588-R590 PolarHBondContact OE1-NH2 2.86Å
589	I	34.5	Very low	35.4	Very low	160 Å²	160	152.8 Å²	152.8	82%	0.821	80%	0.8	S	S	*	*			trans	-72.9	109	175.9	-60.1	173.7	0	0	0	108.3	L587	L587-I589 PolarHBondContact O-N 3.5Å
590	R	29.6	Very low	35.6	Very low	194 Å²	194	157 Å²	157	73%	0.732	81%	0.807	S	S	*	*			trans	-116.6	112.5	165.2	-70.6	-162.7	-176.3	-147.6	1.5	111.6	E588	E588-R590 HydrophobicContact CG-CG 4.36Å; E588-R590 PolarHBondContact O-N 3.08Å; E588-R590 IonicContact OE1-CZ 3.68Å; E588-R590 IonicContact OE1-NE 2.72Å; E588-R590 PolarHBondContact OE1-NE 2.78Å; E588-R590 IonicContact OE1-NH2 3.92Å; E588-R590 PolarHBondContact OE1-NH2 2.86Å
591	E	38.1	Very low	35.6	Very low	180 Å²	180	157.5 Å²	157.5	84%	0.841	80%	0.803	S	S	*	*	S	Bend	trans	65.1	162.9	155.9	-63.5	-178.6	177.6	0	0	118.3
592	T	42.1	Very low	36	Very low	144 Å²	144	157.9 Å²	157.9	88%	0.883	81%	0.808	S	S	*	*	S	Bend	trans	-104.2	93.1	-145.5	50.6	0	0	0	0	113.1
593	S	35.7	Very low	36.2	Very low	114 Å²	114	158.7 Å²	158.7	80%	0.797	81%	0.814	S	S	*	*			trans	-167.5	136.6	147.8	43.4	0	0	0	0	111.4
594	F	35.8	Very low	36.4	Very low	214 Å²	214	158.5 Å²	158.5	94%	0.939	82%	0.818	S	S	*	*			trans	-93.8	126.3	164.5	-89	-91.6	0	0	0	108.5
595	Q	34.8	Very low	35.9	Very low	168 Å²	168	155.6 Å²	155.6	79%	0.785	81%	0.81	S	S	*	*			trans	-116.1	118.8	172.2	-169.6	176.5	16.4	0	0	109.2
596	M	32	Very low	36.2	Very low	184 Å²	184	160.8 Å²	160.8	91%	0.906	82%	0.819	S	S	*	*			trans	-96.5	135.9	169.3	-74.7	-178	162.3	0	0	109.4
597	I	38.2	Very low	36.2	Very low	133 Å²	133	159.6 Å²	159.6	68%	0.682	81%	0.81	S	S	*	*			trans	-118.8	122.1	175.8	-56.9	176.3	0	0	0	107.6
598	P	34.4	Very low	36.3	Very low	119 Å²	119	161.1 Å²	161.1	77%	0.773	81%	0.813	S	S	*	*			trans	-74.5	136.9	180	29.6	-33.6	0	0	0	111.5	N600	P598-N600 PolarHBondContact O-N 2.88Å
599	I	40	Very low	36.6	Very low	164 Å²	164	163.8 Å²	163.8	84%	0.841	82%	0.823	S	S	*	*			trans	-96.5	85.7	174.1	-56.1	175.8	0	0	0	108.8
600	N	36.3	Very low	36.5	Very low	159 Å²	159	161.2 Å²	161.2	85%	0.85	81%	0.814	S	S	*	*			trans	-166.2	141	141.8	-106.4	-15.8	0	0	0	112	P598 E602	P598-N600 PolarHBondContact O-N 2.88Å; N600-E602 PolarHBondContact O-N 2.94Å
601	N	42.1	Very low	36.6	Very low	164 Å²	164	159.5 Å²	159.5	88%	0.877	82%	0.818	S	S	*	*			trans	-82.1	108.6	175.4	-105.1	-8.2	0	0	0	109.8
602	E	34.6	Very low	36.1	Very low	189 Å²	189	158.8 Å²	158.8	88%	0.883	81%	0.814	S	S	*	*			trans	-160	153.4	138.5	-113.4	167.3	-150.1	0	0	110.3	N600 V604	N600-E602 PolarHBondContact O-N 2.94Å; E602-V604 PolarHBondContact O-N 2.81Å
603	Q	45.4	Very low	35.7	Very low	197 Å²	197	157.8 Å²	157.8	92%	0.921	81%	0.809	S	S	*	*			trans	-77.8	116.8	-157.1	-64.1	167.6	-77.5	0	0	113.4
604	V	37	Very low	35.4	Very low	137 Å²	137	159.6 Å²	159.6	83%	0.83	81%	0.807	S	S	*	*			trans	-130.4	145.7	158.6	-175.4	0	0	0	0	109.5	E602	E602-V604 PolarHBondContact O-N 2.81Å
605	S	35	Very low	35.2	Very low	92 Å²	92	157.7 Å²	157.7	64%	0.643	80%	0.799	S	S	*	*			trans	-62.2	153.8	-173	37.8	0	0	0	0	114.4	E607	S605-E607 PolarHBondContact O-N 2.81Å; S605-E607 VanDerWaalsContact O-N 3.08Å
606	K	39.6	Very low	35	Very low	214 Å²	214	154.9 Å²	154.9	93%	0.93	80%	0.795	S	S	*	*			trans	-58.2	108.6	172.2	-73.8	-179.4	172.2	-175.4	0	111.2
607	E	34.2	Very low	35	Very low	140 Å²	140	152.1 Å²	152.1	65%	0.654	79%	0.792	S	S	*	*			trans	-120.1	127.3	157.3	-68.3	-175.6	164	0	0	107.9	S605 F609	S605-E607 PolarHBondContact O-N 2.81Å; S605-E607 VanDerWaalsContact O-N 3.08Å; E607-F609 PolarHBondContact O-N 2.97Å
608	E	33.9	Very low	34.7	Very low	188 Å²	188	154 Å²	154	88%	0.879	80%	0.803	S	S	*	*			trans	-78.7	106	176.2	-77.4	-179.6	127.5	0	0	109.6	V610	E608-V610 HydrophobicContact CB-CG2 4.5Å; E608-V610 PolarHBondContact O-N 3.21Å
609	F	35	Very low	34.8	Very low	185 Å²	185	151.8 Å²	151.8	81%	0.811	80%	0.802	S	S	*	*			trans	-74.2	91.5	171.3	-64.8	-76.5	0	0	0	110.5	E607	E607-F609 PolarHBondContact O-N 2.97Å
610	V	33	Very low	34.3	Very low	106 Å²	106	152.7 Å²	152.7	64%	0.642	81%	0.805	S	S	*	*			trans	-85.4	119.2	172.4	-179.6	0	0	0	0	109.7	E608	E608-V610 HydrophobicContact CB-CG2 4.5Å; E608-V610 PolarHBondContact O-N 3.21Å
611	I	32	Very low	34.1	Very low	158 Å²	158	152.9 Å²	152.9	81%	0.81	81%	0.806	S	S	*	*			trans	-83.4	114.3	173.7	-59.4	174.9	0	0	0	109
612	H	26.4	Very low	33.5	Very low	165 Å²	165	152.7 Å²	152.7	76%	0.764	80%	0.804	S	S	*	*			trans	-80.4	125.2	168.6	-82.8	-69.5	0	0	0	111.2
613	T	33.6	Very low	33.2	Very low	124 Å²	124	154.4 Å²	154.4	76%	0.761	80%	0.804	S	S	*	*			trans	-80.7	132.1	168.3	48.8	0	0	0	0	110.3	F615	T613-F615 VanDerWaalsContact C-N 3.33Å; T613-F615 PolarHBondContact O-N 3.07Å
614	I	30.8	Very low	32.3	Very low	151 Å²	151	154.5 Å²	154.5	77%	0.774	80%	0.801	S	S	*	*	S	Bend	trans	-82.5	-6.3	-169.1	-64.4	174.7	0	0	0	113.4
615	F	30.4	Very low	31.9	Very low	174 Å²	174	155.3 Å²	155.3	76%	0.763	80%	0.801	S	S	*	*			trans	-137.2	127.8	178.2	-64.2	-78.1	0	0	0	112.6	T613	T613-F615 VanDerWaalsContact C-N 3.33Å; T613-F615 PolarHBondContact O-N 3.07Å
616	P	30.8	Very low	31.5	Very low	109 Å²	109	155.5 Å²	155.5	71%	0.708	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-84.1	145	166.9	33.8	-31.9	0	0	0	111
617	P	33.1	Very low	31.1	Very low	127 Å²	127	154.1 Å²	154.1	83%	0.825	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.5	143.2	165.3	30.7	-32.9	0	0	0	110.3
618	N	32	Very low	30.8	Very low	172 Å²	172	151.7 Å²	151.7	92%	0.92	80%	0.797	S	S	*	*	S	Bend	trans	-63.1	138.2	-172.4	-73.5	-40.9	0	0	0	113.8
619	G	36.4	Very low	30.6	Very low	73 Å²	73	151 Å²	151	75%	0.753	79%	0.794	S	S	*	*			trans	101.3	71.3	143.5	0	0	0	0	0	118
620	M	29.6	Very low	30.2	Very low	182 Å²	182	147.1 Å²	147.1	90%	0.897	79%	0.79	S	S	*	*			trans	-147.3	115.1	148.9	-112.9	166.2	66.8	0	0	111.3
621	N	32	Very low	29.9	Very low	163 Å²	163	147.5 Å²	147.5	87%	0.872	80%	0.797	S	S	*	*			trans	-65.3	136	164.7	-81.9	-36.5	0	0	0	109.2
622	L	28.4	Very low	29.8	Very low	161 Å²	161	144.4 Å²	144.4	84%	0.843	79%	0.79	S	S	*	*			trans	-165.9	123.4	140.5	-105.9	158.3	0	0	0	111.2
623	Y	28.8	Very low	29.8	Very low	224 Å²	224	142.3 Å²	142.3	88%	0.878	78%	0.784	S	S	*	*			trans	-56.6	146.1	161	-83.1	-111.4	0	0	0	110
624	K	27.1	Very low	29.6	Very low	200 Å²	200	147 Å²	147	87%	0.87	79%	0.788	S	S	*	*				172	143.3	88.4	-155.8	170.2	-176.2	179.7	0	112.9
625	N	27.1	Very low	29.4	Very low	153 Å²	153	144 Å²	144	82%	0.818	78%	0.78	S	S	*	*			trans	-56.8	156	166.9	-77	-16.9	0	0	0	113.6
626	S	27	Very low	29.3	Very low	96 Å²	96	145.5 Å²	145.5	67%	0.671	78%	0.782	S	S	*	*				178.6	126.7	111.2	56.7	0	0	0	0	115.7
627	H	30.8	Very low	29.2	Very low	186 Å²	186	150.2 Å²	150.2	86%	0.861	79%	0.786	S	S	*	*			trans	57.6	154.8	149.3	-55.3	-53.8	0	0	0	119.5
628	S	29.1	Very low	29	Very low	89 Å²	89	150.1 Å²	150.1	62%	0.622	78%	0.778	S	S	*	*			cis	-159.1	177	-26.2	63	0	0	0	0	107.1
629	E	28.5	Very low	28.8	Very low	173 Å²	173	147.2 Å²	147.2	81%	0.808	77%	0.772	S	S	*	*			cis	-158.7	-146.1	11.2	-146.3	152.1	-59.9	0	0	113.1
630	S	28.1	Very low	28.3	Very low	104 Å²	104	147.8 Å²	147.8	73%	0.727	78%	0.777	S	S	*	*			trans	-21.6	141.7	171.9	63.9	0	0	0	0	119.4
631	S	27.1	Very low	28.2	Very low	113 Å²	113	146.4 Å²	146.4	79%	0.79	77%	0.772	S	S	*	*				-160.4	154.4	57.4	57.5	0	0	0	0	115.9
632	S	28.5	Very low	28.4	Very low	94 Å²	94	144.3 Å²	144.3	66%	0.657	77%	0.767	S	S	*	*			trans	-52.4	157.8	175.5	53.2	0	0	0	0	114.4
633	N	26.8	Very low	28.4	Very low	120 Å²	120	143 Å²	143	64%	0.642	76%	0.761	S	S	*	*				-174.4	142.5	59.4	-116.2	-37.5	0	0	0	113.1
634	R	29.2	Very low	28.4	Very low	223 Å²	223	138.2 Å²	138.2	84%	0.842	76%	0.76	S	S	*	*			trans	54.9	144	137.4	-71.9	173	175.2	178.1	-2.3	120.9
635	S	27.2	Very low	28.7	Very low	87 Å²	87	135.7 Å²	135.7	61%	0.608	76%	0.756	S	S	*	*			cis	-178.8	165.1	-6.4	46.9	0	0	0	0	112.2
636	Y	27.6	Very low	29	Very low	206 Å²	206	137.6 Å²	137.6	81%	0.808	76%	0.76	S	S	*	*			trans	75.4	119.5	173	-71.8	-92.6	0	0	0	115.9
637	R	29.7	Very low	29.2	Very low	209 Å²	209	136.9 Å²	136.9	79%	0.789	76%	0.755	S	S	*	*			cis	73.2	139	47.6	-70.1	-169	176.5	-179.2	-0.7	113
638	D	28.6	Very low	29.4	Very low	124 Å²	124	136.1 Å²	136.1	66%	0.663	75%	0.751	S	S	*	*			cis	-158.1	169.7	17.9	-135.7	-22.6	0	0	0	115.3
639	S	27.7	Very low	29.7	Very low	112 Å²	112	140.9 Å²	140.9	78%	0.783	78%	0.784	S	S	*	*			trans	72.1	123.8	150.1	-58.1	0	0	0	0	122.6
640	G	26.3	Very low	29.8	Very low	84 Å²	84	139.3 Å²	139.3	87%	0.866	78%	0.783	S	S	*	*			trans	165.7	57	163.7	0	0	0	0	0	118.2
641	I	26.2	Very low	29.9	Very low	153 Å²	153	141.1 Å²	141.1	79%	0.785	79%	0.786	S	S	*	*			trans	-99.8	140.6	171.6	-76.1	173.8	0	0	0	107
642	P	36.3	Very low	30	Very low	120 Å²	120	142.7 Å²	142.7	78%	0.779	79%	0.786	S	S	*	*				-149.3	168.9	68.2	40.7	-19.6	0	0	0	121
643	D	27.8	Very low	30.1	Very low	134 Å²	134	145.5 Å²	145.5	72%	0.717	79%	0.793	S	S	*	*			trans	-49.4	161.7	176.1	-45.1	-65.3	0	0	0	117.2
644	S	30.4	Very low	30.3	Very low	123 Å²	123	147.1 Å²	147.1	86%	0.86	80%	0.803	S	S	*	*			trans	-155.9	110.4	137.6	-76.7	0	0	0	0	110.3
645	D	32.5	Very low	30.4	Very low	147 Å²	147	142.1 Å²	142.1	79%	0.786	80%	0.8	S	S	*	*			trans	-62.7	148.8	165.3	-76	-56.4	0	0	0	111
646	H	33.5	Very low	30.6	Very low	192 Å²	192	146 Å²	146	89%	0.889	81%	0.814	S	S	*	*			trans	-155	115.2	133.6	-93.6	-41	0	0	0	111.8
647	S	32.2	Very low	30.8	Very low	81 Å²	81	141.4 Å²	141.4	57%	0.566	82%	0.815	S	S	*	*			trans	-75.1	149.9	160	46.4	0	0	0	0	111
648	H	34.2	Very low	30.9	Very low	171 Å²	171	135.8 Å²	135.8	79%	0.792	82%	0.817	S	S	*	*				174.9	150	103.6	-93.3	-63.9	0	0	0	114.6
649	S	35.6	Very low	31.2	Very low	188 Å²	188	136.8 Å²	136.8	100%	1.315	83%	0.831	S	S	*	*			trans	60.1	0	153.5	58.6	0	0	0	0	119.1

Retrieved 649 of 649 residues in 233.5 ms (Link to these results)

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